******************************************************************************** * GENERAL UTILITY LATTICE PROGRAM * * Julian Gale, Imperial College * ******************************************************************************** * Version = 1.4.43 * Last modified = 25th March 2003 * ******************************************************************************** * single - perform a single point run * * phonon - calculate phonons for final geometry * ******************************************************************************** * DLV generated input file for MgO * ******************************************************************************** Job Started at 15:22.25 4th February 2016 Number of CPUs = 1 Total number of configurations input = 1 ******************************************************************************** * Input for Configuration = 1 * ******************************************************************************** Formula = OMg Number of irreducible atoms/shells = 2 Total number atoms/shells = 2 Dimensionality = 3 : Bulk Cartesian lattice vectors (Angstroms) : 0.000000 2.105970 2.105970 2.105970 0.000000 2.105970 2.105970 2.105970 0.000000 Cell parameters (Angstroms/Degrees): a = 2.9783 alpha = 60.0000 b = 2.9783 beta = 60.0000 c = 2.9783 gamma = 60.0000 Initial cell volume = 18.680416 Angs**3 Shrinking factors = 32 32 32 Temperature of configuration = 0.000 K Pressure of configuration = 0.000 GPa Fractional coordinates of asymmetric unit : -------------------------------------------------------------------------------- No. Atomic x y z Charge Occupancy Label (Frac) (Frac) (Frac) (e) (Frac) -------------------------------------------------------------------------------- 1 O c 0.500000 0.500000 0.500000 -2.000000 1.000000 2 Mg c 0.000000 0.000000 0.000000 2.000000 1.000000 -------------------------------------------------------------------------------- Brillouin zone sampling points : 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0.484375 0.828125 0.953125 0.0001 16224 0.484375 0.828125 0.984375 0.0001 16225 0.484375 0.859375 0.015625 0.0001 16226 0.484375 0.859375 0.046875 0.0001 16227 0.484375 0.859375 0.078125 0.0001 16228 0.484375 0.859375 0.109375 0.0001 16229 0.484375 0.859375 0.140625 0.0001 16230 0.484375 0.859375 0.171875 0.0001 16231 0.484375 0.859375 0.203125 0.0001 16232 0.484375 0.859375 0.234375 0.0001 16233 0.484375 0.859375 0.265625 0.0001 16234 0.484375 0.859375 0.296875 0.0001 16235 0.484375 0.859375 0.328125 0.0001 16236 0.484375 0.859375 0.359375 0.0001 16237 0.484375 0.859375 0.390625 0.0001 16238 0.484375 0.859375 0.421875 0.0001 16239 0.484375 0.859375 0.453125 0.0001 16240 0.484375 0.859375 0.484375 0.0001 16241 0.484375 0.859375 0.515625 0.0001 16242 0.484375 0.859375 0.546875 0.0001 16243 0.484375 0.859375 0.578125 0.0001 16244 0.484375 0.859375 0.609375 0.0001 16245 0.484375 0.859375 0.640625 0.0001 16246 0.484375 0.859375 0.671875 0.0001 16247 0.484375 0.859375 0.703125 0.0001 16248 0.484375 0.859375 0.734375 0.0001 16249 0.484375 0.859375 0.765625 0.0001 16250 0.484375 0.859375 0.796875 0.0001 16251 0.484375 0.859375 0.828125 0.0001 16252 0.484375 0.859375 0.859375 0.0001 16253 0.484375 0.859375 0.890625 0.0001 16254 0.484375 0.859375 0.921875 0.0001 16255 0.484375 0.859375 0.953125 0.0001 16256 0.484375 0.859375 0.984375 0.0001 16257 0.484375 0.890625 0.015625 0.0001 16258 0.484375 0.890625 0.046875 0.0001 16259 0.484375 0.890625 0.078125 0.0001 16260 0.484375 0.890625 0.109375 0.0001 16261 0.484375 0.890625 0.140625 0.0001 16262 0.484375 0.890625 0.171875 0.0001 16263 0.484375 0.890625 0.203125 0.0001 16264 0.484375 0.890625 0.234375 0.0001 16265 0.484375 0.890625 0.265625 0.0001 16266 0.484375 0.890625 0.296875 0.0001 16267 0.484375 0.890625 0.328125 0.0001 16268 0.484375 0.890625 0.359375 0.0001 16269 0.484375 0.890625 0.390625 0.0001 16270 0.484375 0.890625 0.421875 0.0001 16271 0.484375 0.890625 0.453125 0.0001 16272 0.484375 0.890625 0.484375 0.0001 16273 0.484375 0.890625 0.515625 0.0001 16274 0.484375 0.890625 0.546875 0.0001 16275 0.484375 0.890625 0.578125 0.0001 16276 0.484375 0.890625 0.609375 0.0001 16277 0.484375 0.890625 0.640625 0.0001 16278 0.484375 0.890625 0.671875 0.0001 16279 0.484375 0.890625 0.703125 0.0001 16280 0.484375 0.890625 0.734375 0.0001 16281 0.484375 0.890625 0.765625 0.0001 16282 0.484375 0.890625 0.796875 0.0001 16283 0.484375 0.890625 0.828125 0.0001 16284 0.484375 0.890625 0.859375 0.0001 16285 0.484375 0.890625 0.890625 0.0001 16286 0.484375 0.890625 0.921875 0.0001 16287 0.484375 0.890625 0.953125 0.0001 16288 0.484375 0.890625 0.984375 0.0001 16289 0.484375 0.921875 0.015625 0.0001 16290 0.484375 0.921875 0.046875 0.0001 16291 0.484375 0.921875 0.078125 0.0001 16292 0.484375 0.921875 0.109375 0.0001 16293 0.484375 0.921875 0.140625 0.0001 16294 0.484375 0.921875 0.171875 0.0001 16295 0.484375 0.921875 0.203125 0.0001 16296 0.484375 0.921875 0.234375 0.0001 16297 0.484375 0.921875 0.265625 0.0001 16298 0.484375 0.921875 0.296875 0.0001 16299 0.484375 0.921875 0.328125 0.0001 16300 0.484375 0.921875 0.359375 0.0001 16301 0.484375 0.921875 0.390625 0.0001 16302 0.484375 0.921875 0.421875 0.0001 16303 0.484375 0.921875 0.453125 0.0001 16304 0.484375 0.921875 0.484375 0.0001 16305 0.484375 0.921875 0.515625 0.0001 16306 0.484375 0.921875 0.546875 0.0001 16307 0.484375 0.921875 0.578125 0.0001 16308 0.484375 0.921875 0.609375 0.0001 16309 0.484375 0.921875 0.640625 0.0001 16310 0.484375 0.921875 0.671875 0.0001 16311 0.484375 0.921875 0.703125 0.0001 16312 0.484375 0.921875 0.734375 0.0001 16313 0.484375 0.921875 0.765625 0.0001 16314 0.484375 0.921875 0.796875 0.0001 16315 0.484375 0.921875 0.828125 0.0001 16316 0.484375 0.921875 0.859375 0.0001 16317 0.484375 0.921875 0.890625 0.0001 16318 0.484375 0.921875 0.921875 0.0001 16319 0.484375 0.921875 0.953125 0.0001 16320 0.484375 0.921875 0.984375 0.0001 16321 0.484375 0.953125 0.015625 0.0001 16322 0.484375 0.953125 0.046875 0.0001 16323 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0.484375 0.953125 0.859375 0.0001 16349 0.484375 0.953125 0.890625 0.0001 16350 0.484375 0.953125 0.921875 0.0001 16351 0.484375 0.953125 0.953125 0.0001 16352 0.484375 0.953125 0.984375 0.0001 16353 0.484375 0.984375 0.015625 0.0001 16354 0.484375 0.984375 0.046875 0.0001 16355 0.484375 0.984375 0.078125 0.0001 16356 0.484375 0.984375 0.109375 0.0001 16357 0.484375 0.984375 0.140625 0.0001 16358 0.484375 0.984375 0.171875 0.0001 16359 0.484375 0.984375 0.203125 0.0001 16360 0.484375 0.984375 0.234375 0.0001 16361 0.484375 0.984375 0.265625 0.0001 16362 0.484375 0.984375 0.296875 0.0001 16363 0.484375 0.984375 0.328125 0.0001 16364 0.484375 0.984375 0.359375 0.0001 16365 0.484375 0.984375 0.390625 0.0001 16366 0.484375 0.984375 0.421875 0.0001 16367 0.484375 0.984375 0.453125 0.0001 16368 0.484375 0.984375 0.484375 0.0001 16369 0.484375 0.984375 0.515625 0.0001 16370 0.484375 0.984375 0.546875 0.0001 16371 0.484375 0.984375 0.578125 0.0001 16372 0.484375 0.984375 0.609375 0.0001 16373 0.484375 0.984375 0.640625 0.0001 16374 0.484375 0.984375 0.671875 0.0001 16375 0.484375 0.984375 0.703125 0.0001 16376 0.484375 0.984375 0.734375 0.0001 16377 0.484375 0.984375 0.765625 0.0001 16378 0.484375 0.984375 0.796875 0.0001 16379 0.484375 0.984375 0.828125 0.0001 16380 0.484375 0.984375 0.859375 0.0001 16381 0.484375 0.984375 0.890625 0.0001 16382 0.484375 0.984375 0.921875 0.0001 16383 0.484375 0.984375 0.953125 0.0001 16384 0.484375 0.984375 0.984375 0.0001 -------------------------------------------------------------------------------- ******************************************************************************** * General input information * ******************************************************************************** Species output for all configurations : -------------------------------------------------------------------------------- Species Type Atomic Atomic Charge Radii (Angs) Library Number Mass (e) Cova Ionic VDW Symbol -------------------------------------------------------------------------------- O Core 8 16.00 -2.0000 0.730 0.000 1.360 Mg Core 12 24.31 2.0000 1.100 0.000 1.640 -------------------------------------------------------------------------------- Lattice summation method = Ewald Accuracy factor for lattice sums = 8.000 Time limit = Infinity General interatomic potentials : -------------------------------------------------------------------------------- Atom Types Potential A B C D Cutoffs(Ang) 1 2 Min Max -------------------------------------------------------------------------------- O c Mg c Buckingham 0.130E+04 0.300 0.00 0.00 0.000 12.000 O c O c Buckingham 0.228E+05 0.149 27.9 0.00 0.000 12.000 -------------------------------------------------------------------------------- ******************************************************************************** * Output for configuration 1 * ******************************************************************************** Components of energy : -------------------------------------------------------------------------------- Interatomic potentials = 6.72119980 eV Monopole - monopole (real) = -5.11592628 eV Monopole - monopole (recip)= -42.68059111 eV Monopole - monopole (total)= -47.79651739 eV -------------------------------------------------------------------------------- Total lattice energy = -41.07531759 eV -------------------------------------------------------------------------------- Total lattice energy = -3963.1403 kJ/(mole unit cells) -------------------------------------------------------------------------------- Born effective charge tensors : ------------------------------------------------------------------------------- Atom x y z ------------------------------------------------------------------------------- 1 O x -2.0000 0.0000 0.0000 y 0.0000 -2.0000 0.0000 z 0.0000 0.0000 -2.0000 ------------------------------------------------------------------------------- 2 Mg x 2.0000 0.0000 0.0000 y 0.0000 2.0000 0.0000 z 0.0000 0.0000 2.0000 ------------------------------------------------------------------------------- Elastic Constant Matrix: (Units=GPa) ------------------------------------------------------------------------------- Indices 1 2 3 4 5 6 ------------------------------------------------------------------------------- 1 372.1322 162.8789 162.8789 0.0000 0.0000 0.0000 2 162.8789 372.1322 162.8789 0.0000 0.0000 0.0000 3 162.8789 162.8789 372.1322 0.0000 0.0000 0.0000 4 0.0000 0.0000 0.0000 162.8713 0.0000 0.0000 5 0.0000 0.0000 0.0000 0.0000 162.8713 0.0000 6 0.0000 0.0000 0.0000 0.0000 0.0000 162.8713 ------------------------------------------------------------------------------- Elastic Compliance Matrix: (Units=1/GPa) ------------------------------------------------------------------------------- Indices 1 2 3 4 5 6 ------------------------------------------------------------------------------- 1 0.003664 -0.001115 -0.001115 0.000000 0.000000 0.000000 2 -0.001115 0.003664 -0.001115 0.000000 0.000000 0.000000 3 -0.001115 -0.001115 0.003664 0.000000 0.000000 0.000000 4 0.000000 0.000000 0.000000 0.006140 0.000000 0.000000 5 0.000000 0.000000 0.000000 0.000000 0.006140 0.000000 6 0.000000 0.000000 0.000000 0.000000 0.000000 0.006140 ------------------------------------------------------------------------------- Mechanical properties : ------------------------------------------------------------------------------- Convention : Reuss Voight Hill ------------------------------------------------------------------------------- Bulk Modulus (GPa) = 232.62999 232.62999 232.62999 Shear Modulus (GPa) = 133.20887 139.57346 136.39116 ------------------------------------------------------------------------------- Velocity S-wave (km/s) = 19.28082 19.73605 19.50976 Velocity P-wave (km/s) = 33.83599 34.18415 34.01052 ------------------------------------------------------------------------------- Compressibility (1/GPa) = 0.00042987 ------------------------------------------------------------------------------- Stress axis : x y z ------------------------------------------------------------------------------- Youngs Modulii (GPa) = 272.95840 272.95840 272.95840 ------------------------------------------------------------------------------- Poissons Ratio (x) = 0.30444 0.30444 Poissons Ratio (y) = 0.30444 0.30444 Poissons Ratio (z) = 0.30444 0.30444 ------------------------------------------------------------------------------- Piezoelectric Strain Matrix: (Units=C/m**2) ------------------------------------------------------------------------------- Indices 1 2 3 4 5 6 ------------------------------------------------------------------------------- x 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 y 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 z 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 ------------------------------------------------------------------------------- Piezoelectric Stress Matrix: (Units=10**-11 C/N) ------------------------------------------------------------------------------- Indices 1 2 3 4 5 6 ------------------------------------------------------------------------------- x 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 y 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 z 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 ------------------------------------------------------------------------------- Static dielectric constant tensor : ------------------------------------------------------------------------------- x y z ------------------------------------------------------------------------------- x 7.83192 0.00000 0.00000 y 0.00000 7.83192 0.00000 z 0.00000 0.00000 7.83192 -------------------------------------------------------------------------------- Static refractive indices : ------------------------------------------------------------------------------- 1 = 2.79856 2 = 2.79856 3 = 2.79856 ------------------------------------------------------------------------------- Phonon Calculation : Number of k points for this configuration = **** -------------------------------------------------------------------------------- K point 1 = 0.015625 0.015625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 12.61 12.61 24.01 399.73 399.73 1118.44 -------------------------------------------------------------------------------- K point 2 = 0.015625 0.015625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 29.55 35.35 59.44 399.04 400.17 1116.21 -------------------------------------------------------------------------------- K point 3 = 0.015625 0.015625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 53.30 59.16 105.66 397.92 399.92 1110.92 -------------------------------------------------------------------------------- K point 4 = 0.015625 0.015625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 77.53 83.13 152.94 396.38 399.14 1102.55 -------------------------------------------------------------------------------- K point 5 = 0.015625 0.015625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 101.48 106.74 200.43 394.42 397.86 1091.15 -------------------------------------------------------------------------------- K point 6 = 0.015625 0.015625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 124.87 129.73 247.89 392.03 396.08 1076.79 -------------------------------------------------------------------------------- K point 7 = 0.015625 0.015625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 147.48 151.88 295.20 389.22 393.77 1059.58 -------------------------------------------------------------------------------- K point 8 = 0.015625 0.015625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 169.16 173.05 342.22 385.99 390.94 1039.65 -------------------------------------------------------------------------------- K point 9 = 0.015625 0.015625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.76 193.08 382.33 386.80 389.59 1017.15 -------------------------------------------------------------------------------- K point 10 = 0.015625 0.015625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.15 211.85 378.25 383.54 434.93 992.30 -------------------------------------------------------------------------------- K point 11 = 0.015625 0.015625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.17 229.24 373.78 379.07 480.13 965.32 -------------------------------------------------------------------------------- K point 12 = 0.015625 0.015625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.67 245.12 368.99 374.10 524.21 936.57 -------------------------------------------------------------------------------- K point 13 = 0.015625 0.015625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.40 259.28 364.01 368.76 566.64 906.57 -------------------------------------------------------------------------------- K point 14 = 0.015625 0.015625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.01 271.43 359.13 363.30 606.48 876.27 -------------------------------------------------------------------------------- K point 15 = 0.015625 0.015625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.87 281.05 354.92 358.18 641.76 847.67 -------------------------------------------------------------------------------- K point 16 = 0.015625 0.015625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.04 287.31 352.27 354.23 667.78 825.47 -------------------------------------------------------------------------------- K point 17 = 0.015625 0.015625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.51 289.15 352.14 352.51 675.57 818.63 -------------------------------------------------------------------------------- K point 18 = 0.015625 0.015625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.07 286.04 353.54 354.73 660.62 831.68 -------------------------------------------------------------------------------- K point 19 = 0.015625 0.015625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.55 278.54 356.81 359.21 630.71 856.81 -------------------------------------------------------------------------------- K point 20 = 0.015625 0.015625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.98 267.70 361.30 364.55 593.57 886.32 -------------------------------------------------------------------------------- K point 21 = 0.015625 0.015625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.09 254.35 366.22 370.05 552.72 916.66 -------------------------------------------------------------------------------- K point 22 = 0.015625 0.015625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 239.01 239.32 371.14 375.31 509.67 946.32 -------------------------------------------------------------------------------- K point 23 = 0.015625 0.015625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.00 222.91 375.80 380.15 465.17 974.53 -------------------------------------------------------------------------------- K point 24 = 0.015625 0.015625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 203.51 205.03 380.11 384.48 419.67 1000.83 -------------------------------------------------------------------------------- K point 25 = 0.015625 0.015625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 183.72 185.82 373.25 384.20 388.27 1024.92 -------------------------------------------------------------------------------- K point 26 = 0.015625 0.015625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 162.75 165.39 326.59 387.59 391.50 1046.57 -------------------------------------------------------------------------------- K point 27 = 0.015625 0.015625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 140.76 143.87 279.45 390.67 394.19 1065.61 -------------------------------------------------------------------------------- K point 28 = 0.015625 0.015625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 117.91 121.40 232.07 393.33 396.34 1081.88 -------------------------------------------------------------------------------- K point 29 = 0.015625 0.015625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 94.40 98.15 184.56 395.57 397.98 1095.25 -------------------------------------------------------------------------------- K point 30 = 0.015625 0.015625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 70.49 74.31 137.06 397.40 399.12 1105.64 -------------------------------------------------------------------------------- K point 31 = 0.015625 0.015625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 46.72 50.20 89.83 398.81 399.78 1112.97 -------------------------------------------------------------------------------- K point 32 = 0.015625 0.015625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 25.01 26.72 43.99 399.77 399.98 1117.18 -------------------------------------------------------------------------------- K point 33 = 0.015625 0.046875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 29.55 35.35 59.44 399.04 400.17 1116.21 -------------------------------------------------------------------------------- K point 34 = 0.015625 0.046875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 41.28 42.66 67.00 400.22 400.48 1114.53 -------------------------------------------------------------------------------- K point 35 = 0.015625 0.046875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 56.95 63.44 100.85 399.35 401.41 1109.90 -------------------------------------------------------------------------------- K point 36 = 0.015625 0.046875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 76.76 85.49 143.62 397.54 401.57 1102.47 -------------------------------------------------------------------------------- K point 37 = 0.015625 0.046875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 98.61 107.91 188.74 395.25 401.09 1092.06 -------------------------------------------------------------------------------- K point 38 = 0.015625 0.046875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 121.06 130.12 234.70 392.57 400.04 1078.69 -------------------------------------------------------------------------------- K point 39 = 0.015625 0.046875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 143.37 151.74 280.95 389.57 398.40 1062.45 -------------------------------------------------------------------------------- K point 40 = 0.015625 0.046875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 165.12 172.54 327.18 386.28 396.16 1043.45 -------------------------------------------------------------------------------- K point 41 = 0.015625 0.046875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.99 192.32 372.66 383.14 393.40 1021.83 -------------------------------------------------------------------------------- K point 42 = 0.015625 0.046875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 205.73 210.98 378.46 389.57 419.41 997.77 -------------------------------------------------------------------------------- K point 43 = 0.015625 0.046875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.10 228.45 374.35 385.46 464.34 971.51 -------------------------------------------------------------------------------- K point 44 = 0.015625 0.046875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.80 244.67 369.99 380.68 508.46 943.34 -------------------------------------------------------------------------------- K point 45 = 0.015625 0.046875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.58 259.51 365.53 375.36 551.22 913.72 -------------------------------------------------------------------------------- K point 46 = 0.015625 0.046875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.24 272.57 361.23 369.68 591.87 883.40 -------------------------------------------------------------------------------- K point 47 = 0.015625 0.046875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.52 283.18 357.53 364.04 628.86 853.91 -------------------------------------------------------------------------------- K point 48 = 0.015625 0.046875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.84 290.40 355.00 359.28 658.70 828.75 -------------------------------------------------------------------------------- K point 49 = 0.015625 0.046875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.26 293.29 353.44 357.44 673.66 815.67 -------------------------------------------------------------------------------- K point 50 = 0.015625 0.046875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.90 291.54 352.88 359.67 665.88 822.51 -------------------------------------------------------------------------------- K point 51 = 0.015625 0.046875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.91 285.60 354.47 364.21 639.91 844.73 -------------------------------------------------------------------------------- K point 52 = 0.015625 0.046875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.24 276.34 357.80 369.70 604.74 873.33 -------------------------------------------------------------------------------- K point 53 = 0.015625 0.046875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.72 264.64 362.01 375.35 565.08 903.61 -------------------------------------------------------------------------------- K point 54 = 0.015625 0.046875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 244.94 251.04 366.53 380.72 522.91 933.58 -------------------------------------------------------------------------------- K point 55 = 0.015625 0.046875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.32 235.81 371.03 385.57 479.17 962.31 -------------------------------------------------------------------------------- K point 56 = 0.015625 0.046875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.13 219.09 375.35 389.76 434.47 989.27 -------------------------------------------------------------------------------- K point 57 = 0.015625 0.046875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 190.62 201.00 379.29 387.46 395.02 1014.11 -------------------------------------------------------------------------------- K point 58 = 0.015625 0.046875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 169.96 181.66 342.53 383.26 396.78 1036.60 -------------------------------------------------------------------------------- K point 59 = 0.015625 0.046875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 148.37 161.20 296.41 386.72 399.05 1056.53 -------------------------------------------------------------------------------- K point 60 = 0.015625 0.046875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 126.06 139.79 250.21 389.86 400.74 1073.75 -------------------------------------------------------------------------------- K point 61 = 0.015625 0.046875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 103.37 117.63 204.26 392.68 401.81 1088.15 -------------------------------------------------------------------------------- K point 62 = 0.015625 0.046875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 80.79 94.97 159.09 395.15 402.24 1099.63 -------------------------------------------------------------------------------- K point 63 = 0.015625 0.046875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 59.37 72.02 116.01 397.24 401.92 1108.16 -------------------------------------------------------------------------------- K point 64 = 0.015625 0.046875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 41.71 48.61 79.31 398.90 400.67 1113.77 -------------------------------------------------------------------------------- K point 65 = 0.015625 0.078125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 53.30 59.16 105.66 397.92 399.92 1110.92 -------------------------------------------------------------------------------- K point 66 = 0.015625 0.078125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 56.95 63.44 100.85 399.35 401.41 1109.90 -------------------------------------------------------------------------------- K point 67 = 0.015625 0.078125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 74.36 75.13 114.78 401.94 402.21 1105.29 -------------------------------------------------------------------------------- K point 68 = 0.015625 0.078125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 89.36 94.50 145.73 401.34 403.61 1098.19 -------------------------------------------------------------------------------- K point 69 = 0.015625 0.078125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 106.91 114.90 184.59 399.40 404.18 1088.53 -------------------------------------------------------------------------------- K point 70 = 0.015625 0.078125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 126.56 135.64 226.58 396.71 404.04 1076.10 -------------------------------------------------------------------------------- K point 71 = 0.015625 0.078125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 147.22 156.24 270.00 393.61 403.23 1060.85 -------------------------------------------------------------------------------- K point 72 = 0.015625 0.078125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 168.02 176.36 314.07 390.31 401.75 1042.85 -------------------------------------------------------------------------------- K point 73 = 0.015625 0.078125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 188.28 195.81 358.07 387.15 399.61 1022.19 -------------------------------------------------------------------------------- K point 74 = 0.015625 0.078125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 207.45 214.54 381.86 395.89 404.91 999.04 -------------------------------------------------------------------------------- K point 75 = 0.015625 0.078125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.10 232.49 378.71 392.72 447.95 973.60 -------------------------------------------------------------------------------- K point 76 = 0.015625 0.078125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.01 249.47 375.02 388.34 491.38 946.13 -------------------------------------------------------------------------------- K point 77 = 0.015625 0.078125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.14 265.08 371.32 383.29 533.90 917.02 -------------------------------------------------------------------------------- K point 78 = 0.015625 0.078125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.42 278.86 367.82 377.75 574.79 886.90 -------------------------------------------------------------------------------- K point 79 = 0.015625 0.078125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.68 290.18 364.70 372.21 612.86 856.91 -------------------------------------------------------------------------------- K point 80 = 0.015625 0.078125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.53 298.25 361.61 368.09 645.50 829.66 -------------------------------------------------------------------------------- K point 81 = 0.015625 0.078125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.25 302.29 357.82 367.52 666.57 811.29 -------------------------------------------------------------------------------- K point 82 = 0.015625 0.078125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.91 302.04 354.82 370.19 666.66 811.17 -------------------------------------------------------------------------------- K point 83 = 0.015625 0.078125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.93 297.93 354.05 374.78 645.71 829.40 -------------------------------------------------------------------------------- K point 84 = 0.015625 0.078125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.67 290.70 355.51 380.21 613.08 856.61 -------------------------------------------------------------------------------- K point 85 = 0.015625 0.078125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.05 281.00 358.46 385.72 574.96 886.63 -------------------------------------------------------------------------------- K point 86 = 0.015625 0.078125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.88 269.28 362.17 390.86 534.01 916.83 -------------------------------------------------------------------------------- K point 87 = 0.015625 0.078125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.72 255.78 366.19 395.37 491.46 946.05 -------------------------------------------------------------------------------- K point 88 = 0.015625 0.078125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 218.96 240.64 370.28 398.97 448.10 973.66 -------------------------------------------------------------------------------- K point 89 = 0.015625 0.078125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.90 223.97 374.29 397.60 408.40 999.28 -------------------------------------------------------------------------------- K point 90 = 0.015625 0.078125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 179.80 205.85 358.21 378.29 405.64 1022.65 -------------------------------------------------------------------------------- K point 91 = 0.015625 0.078125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 158.93 186.37 314.30 382.02 406.85 1043.56 -------------------------------------------------------------------------------- K point 92 = 0.015625 0.078125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 137.63 165.62 270.74 385.60 407.42 1061.88 -------------------------------------------------------------------------------- K point 93 = 0.015625 0.078125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 116.37 143.67 228.35 388.98 407.16 1077.49 -------------------------------------------------------------------------------- K point 94 = 0.015625 0.078125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 95.90 120.48 188.27 392.11 405.95 1090.32 -------------------------------------------------------------------------------- K point 95 = 0.015625 0.078125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 77.54 96.00 152.50 394.95 403.68 1100.34 -------------------------------------------------------------------------------- K point 96 = 0.015625 0.078125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 63.58 71.63 123.99 397.40 400.61 1107.42 -------------------------------------------------------------------------------- K point 97 = 0.015625 0.109375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 77.53 83.13 152.94 396.38 399.14 1102.55 -------------------------------------------------------------------------------- K point 98 = 0.015625 0.109375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 76.76 85.49 143.62 397.54 401.57 1102.47 -------------------------------------------------------------------------------- K point 99 = 0.015625 0.109375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 89.36 94.50 145.73 401.34 403.61 1098.19 -------------------------------------------------------------------------------- K point 100 = 0.015625 0.109375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 106.86 107.27 162.24 404.59 404.84 1091.04 -------------------------------------------------------------------------------- K point 101 = 0.015625 0.109375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 121.60 125.74 190.73 404.40 406.68 1081.59 -------------------------------------------------------------------------------- K point 102 = 0.015625 0.109375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 138.23 144.94 225.87 402.72 407.63 1069.75 -------------------------------------------------------------------------------- K point 103 = 0.015625 0.109375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 156.56 164.42 264.36 400.16 407.77 1055.34 -------------------------------------------------------------------------------- K point 104 = 0.015625 0.109375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 175.64 183.90 304.63 397.18 407.17 1038.28 -------------------------------------------------------------------------------- K point 105 = 0.015625 0.109375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.49 203.26 345.73 394.22 405.82 1018.62 -------------------------------------------------------------------------------- K point 106 = 0.015625 0.109375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.32 222.38 383.30 394.90 404.13 996.45 -------------------------------------------------------------------------------- K point 107 = 0.015625 0.109375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.76 240.96 386.16 400.15 432.07 971.93 -------------------------------------------------------------------------------- K point 108 = 0.015625 0.109375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.66 258.58 383.43 396.48 473.75 945.28 -------------------------------------------------------------------------------- K point 109 = 0.015625 0.109375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.99 274.78 380.61 392.02 515.26 916.82 -------------------------------------------------------------------------------- K point 110 = 0.015625 0.109375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.68 289.10 377.86 387.17 555.75 887.07 -------------------------------------------------------------------------------- K point 111 = 0.015625 0.109375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.58 301.01 374.71 382.89 594.22 856.90 -------------------------------------------------------------------------------- K point 112 = 0.015625 0.109375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.44 309.90 370.15 380.94 628.72 828.23 -------------------------------------------------------------------------------- K point 113 = 0.015625 0.109375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.80 315.18 364.65 381.79 654.63 805.64 -------------------------------------------------------------------------------- K point 114 = 0.015625 0.109375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.91 316.66 359.68 384.85 662.75 798.30 -------------------------------------------------------------------------------- K point 115 = 0.015625 0.109375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.93 314.67 356.48 389.33 648.05 811.25 -------------------------------------------------------------------------------- K point 116 = 0.015625 0.109375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.59 309.74 355.62 394.41 618.59 836.45 -------------------------------------------------------------------------------- K point 117 = 0.015625 0.109375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.42 302.35 356.77 399.43 582.34 865.98 -------------------------------------------------------------------------------- K point 118 = 0.015625 0.109375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.29 292.79 359.22 403.95 542.85 896.34 -------------------------------------------------------------------------------- K point 119 = 0.015625 0.109375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.94 281.26 362.39 407.66 501.77 926.04 -------------------------------------------------------------------------------- K point 120 = 0.015625 0.109375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.90 267.81 365.95 410.17 460.20 954.35 -------------------------------------------------------------------------------- K point 121 = 0.015625 0.109375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.56 252.46 369.69 407.38 422.77 980.83 -------------------------------------------------------------------------------- K point 122 = 0.015625 0.109375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 192.26 235.19 372.68 374.13 415.97 1005.20 -------------------------------------------------------------------------------- K point 123 = 0.015625 0.109375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 172.38 215.92 332.75 377.44 415.41 1027.24 -------------------------------------------------------------------------------- K point 124 = 0.015625 0.109375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.33 194.57 293.40 381.30 414.23 1046.82 -------------------------------------------------------------------------------- K point 125 = 0.015625 0.109375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 132.69 171.03 256.45 385.10 412.04 1063.82 -------------------------------------------------------------------------------- K point 126 = 0.015625 0.109375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 114.31 145.48 223.00 388.79 408.73 1078.13 -------------------------------------------------------------------------------- K point 127 = 0.015625 0.109375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 98.47 119.04 194.07 392.30 404.43 1089.64 -------------------------------------------------------------------------------- K point 128 = 0.015625 0.109375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 86.82 94.92 170.39 395.48 399.96 1098.02 -------------------------------------------------------------------------------- K point 129 = 0.015625 0.140625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 101.48 106.74 200.43 394.42 397.86 1091.15 -------------------------------------------------------------------------------- K point 130 = 0.015625 0.140625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 98.61 107.91 188.74 395.25 401.09 1092.06 -------------------------------------------------------------------------------- K point 131 = 0.015625 0.140625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 106.91 114.90 184.59 399.40 404.18 1088.53 -------------------------------------------------------------------------------- K point 132 = 0.015625 0.140625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 121.60 125.74 190.73 404.40 406.68 1081.59 -------------------------------------------------------------------------------- K point 133 = 0.015625 0.140625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 138.44 138.61 208.18 408.08 408.30 1072.17 -------------------------------------------------------------------------------- K point 134 = 0.015625 0.140625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.83 156.31 234.43 408.30 410.53 1060.57 -------------------------------------------------------------------------------- K point 135 = 0.015625 0.140625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 168.82 174.71 266.05 407.09 411.80 1046.72 -------------------------------------------------------------------------------- K point 136 = 0.015625 0.140625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.92 193.63 300.82 405.04 412.19 1030.48 -------------------------------------------------------------------------------- K point 137 = 0.015625 0.140625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 203.07 213.01 337.46 402.69 411.78 1011.76 -------------------------------------------------------------------------------- K point 138 = 0.015625 0.140625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 219.45 232.57 374.49 401.04 410.69 990.59 -------------------------------------------------------------------------------- K point 139 = 0.015625 0.140625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.67 251.79 394.60 406.95 419.17 967.05 -------------------------------------------------------------------------------- K point 140 = 0.015625 0.140625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.55 270.07 393.70 404.78 456.68 941.32 -------------------------------------------------------------------------------- K point 141 = 0.015625 0.140625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.99 286.90 391.78 401.37 496.15 913.64 -------------------------------------------------------------------------------- K point 142 = 0.015625 0.140625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.92 301.83 389.28 398.10 535.42 884.42 -------------------------------------------------------------------------------- K point 143 = 0.015625 0.140625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.23 314.39 385.27 396.37 573.54 854.33 -------------------------------------------------------------------------------- K point 144 = 0.015625 0.140625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.76 324.13 379.63 396.74 608.99 824.76 -------------------------------------------------------------------------------- K point 145 = 0.015625 0.140625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.22 330.70 373.22 398.88 638.43 798.98 -------------------------------------------------------------------------------- K point 146 = 0.015625 0.140625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.12 334.02 366.93 402.37 654.06 784.73 -------------------------------------------------------------------------------- K point 147 = 0.015625 0.140625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.72 334.31 361.71 406.69 646.95 790.93 -------------------------------------------------------------------------------- K point 148 = 0.015625 0.140625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.39 331.92 358.42 411.23 621.51 813.20 -------------------------------------------------------------------------------- K point 149 = 0.015625 0.140625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.11 327.12 357.32 415.45 587.38 841.96 -------------------------------------------------------------------------------- K point 150 = 0.015625 0.140625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.48 320.02 358.02 418.96 549.51 872.42 -------------------------------------------------------------------------------- K point 151 = 0.015625 0.140625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.31 310.66 359.94 421.44 510.07 902.64 -------------------------------------------------------------------------------- K point 152 = 0.015625 0.140625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.27 298.94 362.63 422.34 470.62 931.73 -------------------------------------------------------------------------------- K point 153 = 0.015625 0.140625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.88 284.68 365.81 417.37 436.25 959.18 -------------------------------------------------------------------------------- K point 154 = 0.015625 0.140625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 206.58 267.60 369.32 387.65 426.61 984.67 -------------------------------------------------------------------------------- K point 155 = 0.015625 0.140625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 187.80 247.35 351.97 373.13 423.72 1007.98 -------------------------------------------------------------------------------- K point 156 = 0.015625 0.140625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 169.05 223.73 318.53 377.08 420.33 1028.94 -------------------------------------------------------------------------------- K point 157 = 0.015625 0.140625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 150.96 197.12 288.36 381.15 415.89 1047.40 -------------------------------------------------------------------------------- K point 158 = 0.015625 0.140625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 134.36 168.85 261.56 385.27 410.42 1063.20 -------------------------------------------------------------------------------- K point 159 = 0.015625 0.140625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 120.37 141.28 237.88 389.34 404.32 1076.08 -------------------------------------------------------------------------------- K point 160 = 0.015625 0.140625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 110.18 117.91 217.29 393.16 398.78 1085.62 -------------------------------------------------------------------------------- K point 161 = 0.015625 0.171875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 124.87 129.73 247.89 392.03 396.08 1076.79 -------------------------------------------------------------------------------- K point 162 = 0.015625 0.171875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 121.06 130.12 234.70 392.57 400.04 1078.69 -------------------------------------------------------------------------------- K point 163 = 0.015625 0.171875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 126.56 135.64 226.58 396.71 404.04 1076.10 -------------------------------------------------------------------------------- K point 164 = 0.015625 0.171875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 138.23 144.94 225.87 402.72 407.63 1069.75 -------------------------------------------------------------------------------- K point 165 = 0.015625 0.171875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.83 156.31 234.43 408.30 410.53 1060.57 -------------------------------------------------------------------------------- K point 166 = 0.015625 0.171875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 168.80 168.82 251.91 412.28 412.46 1049.19 -------------------------------------------------------------------------------- K point 167 = 0.015625 0.171875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.67 185.75 275.95 412.89 415.02 1035.74 -------------------------------------------------------------------------------- K point 168 = 0.015625 0.171875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.83 203.69 304.18 412.25 416.58 1020.15 -------------------------------------------------------------------------------- K point 169 = 0.015625 0.171875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.37 222.75 335.09 410.96 417.22 1002.31 -------------------------------------------------------------------------------- K point 170 = 0.015625 0.171875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.39 242.65 367.60 409.65 417.10 982.14 -------------------------------------------------------------------------------- K point 171 = 0.015625 0.171875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.45 262.62 397.80 410.65 417.77 959.65 -------------------------------------------------------------------------------- K point 172 = 0.015625 0.171875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.30 281.85 404.09 412.74 441.97 934.93 -------------------------------------------------------------------------------- K point 173 = 0.015625 0.171875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.83 299.65 402.97 411.19 477.79 908.16 -------------------------------------------------------------------------------- K point 174 = 0.015625 0.171875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.92 315.47 400.15 410.44 514.74 879.63 -------------------------------------------------------------------------------- K point 175 = 0.015625 0.171875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.51 328.90 395.54 411.35 551.57 849.86 -------------------------------------------------------------------------------- K point 176 = 0.015625 0.171875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.48 339.63 389.61 413.70 587.04 819.82 -------------------------------------------------------------------------------- K point 177 = 0.015625 0.171875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.67 347.55 382.87 417.14 618.73 791.74 -------------------------------------------------------------------------------- K point 178 = 0.015625 0.171875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.80 352.68 375.87 421.26 640.76 771.41 -------------------------------------------------------------------------------- K point 179 = 0.015625 0.171875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.36 355.23 369.29 425.57 642.48 769.42 -------------------------------------------------------------------------------- K point 180 = 0.015625 0.171875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.73 355.39 363.96 429.58 622.28 787.38 -------------------------------------------------------------------------------- K point 181 = 0.015625 0.171875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.48 353.36 360.45 432.88 590.61 814.94 -------------------------------------------------------------------------------- K point 182 = 0.015625 0.171875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.73 349.04 358.92 435.13 554.36 845.44 -------------------------------------------------------------------------------- K point 183 = 0.015625 0.171875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.12 342.12 359.10 436.02 516.58 876.22 -------------------------------------------------------------------------------- K point 184 = 0.015625 0.171875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.38 332.22 360.52 434.90 479.42 906.18 -------------------------------------------------------------------------------- K point 185 = 0.015625 0.171875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 239.15 318.74 362.81 427.54 448.40 934.70 -------------------------------------------------------------------------------- K point 186 = 0.015625 0.171875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 221.98 300.89 365.74 402.00 436.81 961.43 -------------------------------------------------------------------------------- K point 187 = 0.015625 0.171875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 204.37 278.08 369.13 372.88 431.29 986.10 -------------------------------------------------------------------------------- K point 188 = 0.015625 0.171875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 186.89 250.77 346.74 373.04 425.43 1008.49 -------------------------------------------------------------------------------- K point 189 = 0.015625 0.171875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 170.17 220.76 323.62 377.20 418.64 1028.40 -------------------------------------------------------------------------------- K point 190 = 0.015625 0.171875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 155.01 190.53 302.47 381.59 411.10 1045.58 -------------------------------------------------------------------------------- K point 191 = 0.015625 0.171875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 142.36 162.71 282.69 386.09 403.46 1059.71 -------------------------------------------------------------------------------- K point 192 = 0.015625 0.171875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 133.13 140.29 264.29 390.46 397.05 1070.31 -------------------------------------------------------------------------------- K point 193 = 0.015625 0.203125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 147.48 151.88 295.20 389.22 393.77 1059.58 -------------------------------------------------------------------------------- K point 194 = 0.015625 0.203125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 143.37 151.74 280.95 389.57 398.40 1062.45 -------------------------------------------------------------------------------- K point 195 = 0.015625 0.203125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 147.22 156.24 270.00 393.61 403.23 1060.85 -------------------------------------------------------------------------------- K point 196 = 0.015625 0.203125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 156.56 164.42 264.36 400.16 407.77 1055.34 -------------------------------------------------------------------------------- K point 197 = 0.015625 0.203125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 168.82 174.71 266.05 407.09 411.80 1046.72 -------------------------------------------------------------------------------- K point 198 = 0.015625 0.203125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.67 185.75 275.95 412.89 415.02 1035.74 -------------------------------------------------------------------------------- K point 199 = 0.015625 0.203125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.52 197.70 292.87 417.06 417.19 1022.75 -------------------------------------------------------------------------------- K point 200 = 0.015625 0.203125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.81 213.66 314.67 418.02 420.02 1007.81 -------------------------------------------------------------------------------- K point 201 = 0.015625 0.203125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.83 231.35 339.58 417.99 421.85 990.83 -------------------------------------------------------------------------------- K point 202 = 0.015625 0.203125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.62 250.84 366.50 417.54 422.84 971.71 -------------------------------------------------------------------------------- K point 203 = 0.015625 0.203125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.60 271.37 394.27 417.28 423.70 950.36 -------------------------------------------------------------------------------- K point 204 = 0.015625 0.203125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.48 291.81 412.75 419.12 432.90 926.80 -------------------------------------------------------------------------------- K point 205 = 0.015625 0.203125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.10 311.06 412.98 420.77 461.88 901.11 -------------------------------------------------------------------------------- K point 206 = 0.015625 0.203125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.34 328.31 410.04 422.70 495.01 873.49 -------------------------------------------------------------------------------- K point 207 = 0.015625 0.203125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.14 343.05 405.50 425.83 529.35 844.29 -------------------------------------------------------------------------------- K point 208 = 0.015625 0.203125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.43 355.07 399.75 429.99 563.76 814.18 -------------------------------------------------------------------------------- K point 209 = 0.015625 0.203125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.14 364.43 393.07 434.80 596.44 784.60 -------------------------------------------------------------------------------- K point 210 = 0.015625 0.203125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.10 371.33 385.82 439.77 623.34 759.40 -------------------------------------------------------------------------------- K point 211 = 0.015625 0.203125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.05 375.63 378.84 444.37 634.65 748.22 -------------------------------------------------------------------------------- K point 212 = 0.015625 0.203125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.54 371.17 379.10 448.13 621.69 759.70 -------------------------------------------------------------------------------- K point 213 = 0.015625 0.203125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.08 365.64 379.63 450.70 593.02 785.35 -------------------------------------------------------------------------------- K point 214 = 0.015625 0.203125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.37 361.90 377.95 451.76 558.32 815.76 -------------------------------------------------------------------------------- K point 215 = 0.015625 0.203125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.65 360.05 373.51 451.02 522.00 847.16 -------------------------------------------------------------------------------- K point 216 = 0.015625 0.203125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.53 359.81 365.44 447.80 487.05 878.07 -------------------------------------------------------------------------------- K point 217 = 0.015625 0.203125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.69 352.21 360.87 438.51 459.30 907.76 -------------------------------------------------------------------------------- K point 218 = 0.015625 0.203125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.78 332.23 362.89 417.78 446.39 935.79 -------------------------------------------------------------------------------- K point 219 = 0.015625 0.203125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 221.39 305.39 365.72 396.58 438.14 961.84 -------------------------------------------------------------------------------- K point 220 = 0.015625 0.203125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 205.11 274.15 369.21 378.26 429.65 985.64 -------------------------------------------------------------------------------- K point 221 = 0.015625 0.203125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.61 241.67 361.26 373.32 420.47 1006.92 -------------------------------------------------------------------------------- K point 222 = 0.015625 0.203125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 175.61 210.58 344.63 377.80 410.94 1025.37 -------------------------------------------------------------------------------- K point 223 = 0.015625 0.203125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 163.96 183.16 327.88 382.59 401.91 1040.62 -------------------------------------------------------------------------------- K point 224 = 0.015625 0.203125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 155.39 161.82 311.20 387.38 394.77 1052.18 -------------------------------------------------------------------------------- K point 225 = 0.015625 0.234375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 169.16 173.05 342.22 385.99 390.94 1039.65 -------------------------------------------------------------------------------- K point 226 = 0.015625 0.234375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 165.12 172.54 327.18 386.28 396.16 1043.45 -------------------------------------------------------------------------------- K point 227 = 0.015625 0.234375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 168.02 176.36 314.07 390.31 401.75 1042.85 -------------------------------------------------------------------------------- K point 228 = 0.015625 0.234375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 175.64 183.90 304.63 397.18 407.17 1038.28 -------------------------------------------------------------------------------- K point 229 = 0.015625 0.234375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.92 193.63 300.82 405.04 412.19 1030.48 -------------------------------------------------------------------------------- K point 230 = 0.015625 0.234375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.83 203.69 304.18 412.25 416.58 1020.15 -------------------------------------------------------------------------------- K point 231 = 0.015625 0.234375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.81 213.66 314.67 418.02 420.02 1007.81 -------------------------------------------------------------------------------- K point 232 = 0.015625 0.234375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.45 224.77 330.64 422.27 422.34 993.65 -------------------------------------------------------------------------------- K point 233 = 0.015625 0.234375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.95 239.70 350.13 423.53 425.37 977.65 -------------------------------------------------------------------------------- K point 234 = 0.015625 0.234375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.60 257.17 371.73 424.06 427.51 959.71 -------------------------------------------------------------------------------- K point 235 = 0.015625 0.234375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.59 277.05 394.55 424.26 429.27 939.68 -------------------------------------------------------------------------------- K point 236 = 0.015625 0.234375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.56 298.19 416.37 424.31 433.11 917.50 -------------------------------------------------------------------------------- K point 237 = 0.015625 0.234375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.33 319.12 421.69 428.68 450.68 893.16 -------------------------------------------------------------------------------- K point 238 = 0.015625 0.234375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.76 338.42 419.12 433.18 478.04 866.75 -------------------------------------------------------------------------------- K point 239 = 0.015625 0.234375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.78 355.18 415.04 438.20 508.33 838.47 -------------------------------------------------------------------------------- K point 240 = 0.015625 0.234375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.36 369.03 409.74 443.99 540.30 808.75 -------------------------------------------------------------------------------- K point 241 = 0.015625 0.234375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.45 380.15 403.38 450.12 572.62 778.47 -------------------------------------------------------------------------------- K point 242 = 0.015625 0.234375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.02 388.85 396.22 456.00 602.63 749.85 -------------------------------------------------------------------------------- K point 243 = 0.015625 0.234375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.94 388.24 395.79 461.09 623.22 729.65 -------------------------------------------------------------------------------- K point 244 = 0.015625 0.234375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.97 380.47 400.60 464.95 620.77 731.31 -------------------------------------------------------------------------------- K point 245 = 0.015625 0.234375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.76 373.23 403.51 467.25 596.42 753.66 -------------------------------------------------------------------------------- K point 246 = 0.015625 0.234375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.89 367.27 404.17 467.71 563.34 783.79 -------------------------------------------------------------------------------- K point 247 = 0.015625 0.234375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.22 363.10 401.88 466.02 528.19 815.85 -------------------------------------------------------------------------------- K point 248 = 0.015625 0.234375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.01 360.80 395.14 461.47 495.12 847.79 -------------------------------------------------------------------------------- K point 249 = 0.015625 0.234375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.82 360.17 381.23 451.57 470.25 878.69 -------------------------------------------------------------------------------- K point 250 = 0.015625 0.234375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.35 357.87 360.94 436.18 456.77 908.04 -------------------------------------------------------------------------------- K point 251 = 0.015625 0.234375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.24 327.13 362.86 422.50 446.16 935.44 -------------------------------------------------------------------------------- K point 252 = 0.015625 0.234375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.15 293.42 365.76 410.66 434.94 960.57 -------------------------------------------------------------------------------- K point 253 = 0.015625 0.234375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 208.74 259.98 369.48 399.01 422.92 983.11 -------------------------------------------------------------------------------- K point 254 = 0.015625 0.234375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 195.72 229.02 373.85 386.61 410.84 1002.69 -------------------------------------------------------------------------------- K point 255 = 0.015625 0.234375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 184.84 202.48 372.66 378.98 399.98 1018.93 -------------------------------------------------------------------------------- K point 256 = 0.015625 0.234375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 176.74 182.34 357.78 383.96 391.94 1031.39 -------------------------------------------------------------------------------- K point 257 = 0.015625 0.265625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.76 193.08 382.33 386.80 389.59 1017.15 -------------------------------------------------------------------------------- K point 258 = 0.015625 0.265625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.99 192.32 372.66 383.14 393.40 1021.83 -------------------------------------------------------------------------------- K point 259 = 0.015625 0.265625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 188.28 195.81 358.07 387.15 399.61 1022.19 -------------------------------------------------------------------------------- K point 260 = 0.015625 0.265625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.49 203.26 345.73 394.22 405.82 1018.62 -------------------------------------------------------------------------------- K point 261 = 0.015625 0.265625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 203.07 213.01 337.46 402.69 411.78 1011.76 -------------------------------------------------------------------------------- K point 262 = 0.015625 0.265625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.37 222.75 335.09 410.96 417.22 1002.31 -------------------------------------------------------------------------------- K point 263 = 0.015625 0.265625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.83 231.35 339.58 417.99 421.85 990.83 -------------------------------------------------------------------------------- K point 264 = 0.015625 0.265625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.95 239.70 350.13 423.53 425.37 977.65 -------------------------------------------------------------------------------- K point 265 = 0.015625 0.265625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.28 249.72 364.85 427.75 427.75 962.84 -------------------------------------------------------------------------------- K point 266 = 0.015625 0.265625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.79 263.51 381.95 429.25 430.92 946.29 -------------------------------------------------------------------------------- K point 267 = 0.015625 0.265625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.89 280.67 400.25 430.19 433.52 927.85 -------------------------------------------------------------------------------- K point 268 = 0.015625 0.265625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.06 300.78 418.79 430.53 436.80 907.36 -------------------------------------------------------------------------------- K point 269 = 0.015625 0.265625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.05 322.43 429.31 434.07 445.91 884.74 -------------------------------------------------------------------------------- K point 270 = 0.015625 0.265625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.73 343.83 427.38 441.12 465.86 859.97 -------------------------------------------------------------------------------- K point 271 = 0.015625 0.265625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.03 363.31 423.98 447.62 490.43 833.12 -------------------------------------------------------------------------------- K point 272 = 0.015625 0.265625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.91 379.84 419.29 454.63 518.27 804.40 -------------------------------------------------------------------------------- K point 273 = 0.015625 0.265625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.37 393.34 413.43 461.67 548.64 774.30 -------------------------------------------------------------------------------- K point 274 = 0.015625 0.265625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.42 404.16 406.60 468.11 579.82 743.92 -------------------------------------------------------------------------------- K point 275 = 0.015625 0.265625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.04 398.74 412.98 473.47 607.72 716.73 -------------------------------------------------------------------------------- K point 276 = 0.015625 0.265625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.17 390.51 419.65 477.43 619.84 704.74 -------------------------------------------------------------------------------- K point 277 = 0.015625 0.265625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.62 382.25 424.15 479.79 603.45 720.47 -------------------------------------------------------------------------------- K point 278 = 0.015625 0.265625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.10 374.60 426.01 480.38 572.78 749.94 -------------------------------------------------------------------------------- K point 279 = 0.015625 0.265625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.31 368.23 424.28 478.87 539.21 782.72 -------------------------------------------------------------------------------- K point 280 = 0.015625 0.265625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.14 363.63 417.05 474.27 508.54 815.75 -------------------------------------------------------------------------------- K point 281 = 0.015625 0.265625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.87 360.95 401.14 464.21 487.48 847.88 -------------------------------------------------------------------------------- K point 282 = 0.015625 0.265625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.06 360.05 375.21 450.75 476.13 878.50 -------------------------------------------------------------------------------- K point 283 = 0.015625 0.265625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.37 342.98 360.73 438.52 467.03 907.16 -------------------------------------------------------------------------------- K point 284 = 0.015625 0.265625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.50 308.93 362.73 427.12 457.23 933.50 -------------------------------------------------------------------------------- K point 285 = 0.015625 0.265625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.14 275.88 365.87 415.93 446.07 957.14 -------------------------------------------------------------------------------- K point 286 = 0.015625 0.265625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 214.98 245.84 369.96 405.12 433.43 977.72 -------------------------------------------------------------------------------- K point 287 = 0.015625 0.265625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 204.73 220.55 374.80 395.46 419.44 994.84 -------------------------------------------------------------------------------- K point 288 = 0.015625 0.265625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.00 201.69 379.99 388.24 404.41 1008.10 -------------------------------------------------------------------------------- K point 289 = 0.015625 0.296875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.15 211.85 378.25 383.54 434.93 992.30 -------------------------------------------------------------------------------- K point 290 = 0.015625 0.296875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 205.73 210.98 378.46 389.57 419.41 997.77 -------------------------------------------------------------------------------- K point 291 = 0.015625 0.296875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 207.45 214.54 381.86 395.89 404.91 999.04 -------------------------------------------------------------------------------- K point 292 = 0.015625 0.296875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.32 222.38 383.30 394.90 404.13 996.45 -------------------------------------------------------------------------------- K point 293 = 0.015625 0.296875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 219.45 232.57 374.49 401.04 410.69 990.59 -------------------------------------------------------------------------------- K point 294 = 0.015625 0.296875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.39 242.65 367.60 409.65 417.10 982.14 -------------------------------------------------------------------------------- K point 295 = 0.015625 0.296875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.62 250.84 366.50 417.54 422.84 971.71 -------------------------------------------------------------------------------- K point 296 = 0.015625 0.296875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.60 257.17 371.73 424.06 427.51 959.71 -------------------------------------------------------------------------------- K point 297 = 0.015625 0.296875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.79 263.51 381.95 429.25 430.92 946.29 -------------------------------------------------------------------------------- K point 298 = 0.015625 0.296875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.70 272.26 395.20 433.25 433.32 931.40 -------------------------------------------------------------------------------- K point 299 = 0.015625 0.296875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.04 284.80 409.86 434.99 436.50 914.86 -------------------------------------------------------------------------------- K point 300 = 0.015625 0.296875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.50 301.47 424.87 436.08 439.80 896.47 -------------------------------------------------------------------------------- K point 301 = 0.015625 0.296875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.81 321.58 435.90 438.74 445.75 876.03 -------------------------------------------------------------------------------- K point 302 = 0.015625 0.296875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.82 343.57 434.74 446.92 459.43 853.42 -------------------------------------------------------------------------------- K point 303 = 0.015625 0.296875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.47 365.46 432.12 454.17 477.60 828.62 -------------------------------------------------------------------------------- K point 304 = 0.015625 0.296875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.71 385.34 428.16 461.75 499.69 801.69 -------------------------------------------------------------------------------- K point 305 = 0.015625 0.296875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.56 402.20 422.93 468.91 526.24 772.82 -------------------------------------------------------------------------------- K point 306 = 0.015625 0.296875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.05 416.02 416.52 474.99 556.45 742.49 -------------------------------------------------------------------------------- K point 307 = 0.015625 0.296875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.25 409.04 427.18 479.72 588.11 711.94 -------------------------------------------------------------------------------- K point 308 = 0.015625 0.296875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.19 400.76 435.70 483.12 615.22 686.32 -------------------------------------------------------------------------------- K point 309 = 0.015625 0.296875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.83 392.03 441.15 485.35 616.02 686.94 -------------------------------------------------------------------------------- K point 310 = 0.015625 0.296875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.06 383.30 442.70 486.46 589.90 714.67 -------------------------------------------------------------------------------- K point 311 = 0.015625 0.296875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.66 375.21 439.28 485.86 559.31 748.30 -------------------------------------------------------------------------------- K point 312 = 0.015625 0.296875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.38 368.43 429.43 481.54 532.86 782.48 -------------------------------------------------------------------------------- K point 313 = 0.015625 0.296875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.17 363.45 411.42 471.09 516.08 815.79 -------------------------------------------------------------------------------- K point 314 = 0.015625 0.296875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.27 360.50 385.23 456.98 507.35 847.57 -------------------------------------------------------------------------------- K point 315 = 0.015625 0.296875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.22 353.92 359.55 442.75 501.02 877.34 -------------------------------------------------------------------------------- K point 316 = 0.015625 0.296875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.70 321.20 360.26 428.92 494.19 904.71 -------------------------------------------------------------------------------- K point 317 = 0.015625 0.296875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 244.42 289.55 362.51 415.53 485.83 929.28 -------------------------------------------------------------------------------- K point 318 = 0.015625 0.296875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.10 260.99 366.05 403.00 475.63 950.69 -------------------------------------------------------------------------------- K point 319 = 0.015625 0.296875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.43 237.23 370.64 392.18 463.57 968.55 -------------------------------------------------------------------------------- K point 320 = 0.015625 0.296875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.01 219.78 375.85 384.29 449.87 982.51 -------------------------------------------------------------------------------- K point 321 = 0.015625 0.328125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.17 229.24 373.78 379.07 480.13 965.32 -------------------------------------------------------------------------------- K point 322 = 0.015625 0.328125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.10 228.45 374.35 385.46 464.34 971.51 -------------------------------------------------------------------------------- K point 323 = 0.015625 0.328125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.10 232.49 378.71 392.72 447.95 973.60 -------------------------------------------------------------------------------- K point 324 = 0.015625 0.328125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.76 240.96 386.16 400.15 432.07 971.93 -------------------------------------------------------------------------------- K point 325 = 0.015625 0.328125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.67 251.79 394.60 406.95 419.17 967.05 -------------------------------------------------------------------------------- K point 326 = 0.015625 0.328125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.45 262.62 397.80 410.65 417.77 959.65 -------------------------------------------------------------------------------- K point 327 = 0.015625 0.328125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.60 271.37 394.27 417.28 423.70 950.36 -------------------------------------------------------------------------------- K point 328 = 0.015625 0.328125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.59 277.05 394.55 424.26 429.27 939.68 -------------------------------------------------------------------------------- K point 329 = 0.015625 0.328125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.89 280.67 400.25 430.19 433.52 927.85 -------------------------------------------------------------------------------- K point 330 = 0.015625 0.328125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.04 284.80 409.86 434.99 436.50 914.86 -------------------------------------------------------------------------------- K point 331 = 0.015625 0.328125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.44 292.09 421.47 438.64 438.81 900.55 -------------------------------------------------------------------------------- K point 332 = 0.015625 0.328125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.46 303.28 433.65 440.53 441.93 884.64 -------------------------------------------------------------------------------- K point 333 = 0.015625 0.328125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.19 319.27 441.39 444.70 446.96 866.88 -------------------------------------------------------------------------------- K point 334 = 0.015625 0.328125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.64 339.12 441.04 451.03 458.14 847.05 -------------------------------------------------------------------------------- K point 335 = 0.015625 0.328125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.72 361.25 439.28 458.50 470.65 825.00 -------------------------------------------------------------------------------- K point 336 = 0.015625 0.328125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.39 383.61 436.14 466.36 486.22 800.69 -------------------------------------------------------------------------------- K point 337 = 0.015625 0.328125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.68 404.24 431.63 472.86 507.31 774.19 -------------------------------------------------------------------------------- K point 338 = 0.015625 0.328125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.65 422.06 425.83 477.40 534.24 745.68 -------------------------------------------------------------------------------- K point 339 = 0.015625 0.328125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.37 418.80 436.85 480.12 565.61 715.57 -------------------------------------------------------------------------------- K point 340 = 0.015625 0.328125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.95 410.76 448.19 481.60 599.28 684.78 -------------------------------------------------------------------------------- K point 341 = 0.015625 0.328125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.47 401.95 454.65 483.12 628.34 659.55 -------------------------------------------------------------------------------- K point 342 = 0.015625 0.328125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.96 392.71 454.37 485.64 614.26 678.58 -------------------------------------------------------------------------------- K point 343 = 0.015625 0.328125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.34 383.52 447.42 487.21 586.77 713.51 -------------------------------------------------------------------------------- K point 344 = 0.015625 0.328125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.47 375.01 434.46 484.09 564.13 748.85 -------------------------------------------------------------------------------- K point 345 = 0.015625 0.328125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.14 367.84 415.32 474.13 550.00 783.17 -------------------------------------------------------------------------------- K point 346 = 0.015625 0.328125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.29 362.58 390.30 459.54 542.67 815.87 -------------------------------------------------------------------------------- K point 347 = 0.015625 0.328125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.14 359.26 361.46 443.68 537.89 846.48 -------------------------------------------------------------------------------- K point 348 = 0.015625 0.328125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.21 330.66 358.59 427.97 532.90 874.61 -------------------------------------------------------------------------------- K point 349 = 0.015625 0.328125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.18 301.08 359.59 412.97 526.42 899.88 -------------------------------------------------------------------------------- K point 350 = 0.015625 0.328125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.77 274.42 362.28 399.29 517.93 921.92 -------------------------------------------------------------------------------- K point 351 = 0.015625 0.328125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.68 252.42 366.35 387.80 507.30 940.36 -------------------------------------------------------------------------------- K point 352 = 0.015625 0.328125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.57 236.48 371.36 379.68 494.61 954.91 -------------------------------------------------------------------------------- K point 353 = 0.015625 0.359375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.67 245.12 368.99 374.10 524.21 936.57 -------------------------------------------------------------------------------- K point 354 = 0.015625 0.359375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.80 244.67 369.99 380.68 508.46 943.34 -------------------------------------------------------------------------------- K point 355 = 0.015625 0.359375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.01 249.47 375.02 388.34 491.38 946.13 -------------------------------------------------------------------------------- K point 356 = 0.015625 0.359375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.66 258.58 383.43 396.48 473.75 945.28 -------------------------------------------------------------------------------- K point 357 = 0.015625 0.359375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.55 270.07 393.70 404.78 456.68 941.32 -------------------------------------------------------------------------------- K point 358 = 0.015625 0.359375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.30 281.85 404.09 412.74 441.97 934.93 -------------------------------------------------------------------------------- K point 359 = 0.015625 0.359375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.48 291.81 412.75 419.12 432.90 926.80 -------------------------------------------------------------------------------- K point 360 = 0.015625 0.359375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.56 298.19 416.37 424.31 433.11 917.50 -------------------------------------------------------------------------------- K point 361 = 0.015625 0.359375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.06 300.78 418.79 430.53 436.80 907.36 -------------------------------------------------------------------------------- K point 362 = 0.015625 0.359375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.50 301.47 424.87 436.08 439.80 896.47 -------------------------------------------------------------------------------- K point 363 = 0.015625 0.359375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.46 303.28 433.65 440.53 441.93 884.64 -------------------------------------------------------------------------------- K point 364 = 0.015625 0.359375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.26 309.00 443.46 443.72 444.05 871.60 -------------------------------------------------------------------------------- K point 365 = 0.015625 0.359375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.84 318.73 445.59 446.97 453.30 856.98 -------------------------------------------------------------------------------- K point 366 = 0.015625 0.359375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.82 333.85 446.17 451.77 462.31 840.48 -------------------------------------------------------------------------------- K point 367 = 0.015625 0.359375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.42 353.19 445.32 459.22 470.37 821.87 -------------------------------------------------------------------------------- K point 368 = 0.015625 0.359375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.62 375.19 443.03 468.80 478.71 801.01 -------------------------------------------------------------------------------- K point 369 = 0.015625 0.359375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.42 397.89 439.31 475.79 492.77 777.92 -------------------------------------------------------------------------------- K point 370 = 0.015625 0.359375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.90 419.39 434.21 478.53 514.62 752.71 -------------------------------------------------------------------------------- K point 371 = 0.015625 0.359375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.16 427.72 438.60 478.52 542.34 725.68 -------------------------------------------------------------------------------- K point 372 = 0.015625 0.359375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.32 420.14 454.76 476.28 574.24 697.35 -------------------------------------------------------------------------------- K point 373 = 0.015625 0.359375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.53 411.53 464.98 474.53 608.64 668.65 -------------------------------------------------------------------------------- K point 374 = 0.015625 0.359375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.93 402.19 460.35 481.23 637.27 647.86 -------------------------------------------------------------------------------- K point 375 = 0.015625 0.359375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.58 392.48 449.43 486.02 614.83 681.43 -------------------------------------------------------------------------------- K point 376 = 0.015625 0.359375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.49 382.87 434.50 484.17 595.72 716.98 -------------------------------------------------------------------------------- K point 377 = 0.015625 0.359375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.53 374.00 415.33 474.71 583.94 751.54 -------------------------------------------------------------------------------- K point 378 = 0.015625 0.359375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.54 366.54 392.02 459.84 577.94 784.53 -------------------------------------------------------------------------------- K point 379 = 0.015625 0.359375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.44 360.95 365.71 442.81 574.45 815.47 -------------------------------------------------------------------------------- K point 380 = 0.015625 0.359375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.39 337.62 358.14 425.62 570.96 843.95 -------------------------------------------------------------------------------- K point 381 = 0.015625 0.359375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.89 310.51 357.41 409.33 566.07 869.56 -------------------------------------------------------------------------------- K point 382 = 0.015625 0.359375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.59 286.04 358.84 394.74 559.10 891.93 -------------------------------------------------------------------------------- K point 383 = 0.015625 0.359375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.21 265.99 362.08 382.76 549.79 910.74 -------------------------------------------------------------------------------- K point 384 = 0.015625 0.359375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.45 251.69 366.65 374.54 538.10 925.68 -------------------------------------------------------------------------------- K point 385 = 0.015625 0.390625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.40 259.28 364.01 368.76 566.64 906.57 -------------------------------------------------------------------------------- K point 386 = 0.015625 0.390625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.58 259.51 365.53 375.36 551.22 913.72 -------------------------------------------------------------------------------- K point 387 = 0.015625 0.390625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.14 265.08 371.32 383.29 533.90 917.02 -------------------------------------------------------------------------------- K point 388 = 0.015625 0.390625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.99 274.78 380.61 392.02 515.26 916.82 -------------------------------------------------------------------------------- K point 389 = 0.015625 0.390625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.99 286.90 391.78 401.37 496.15 913.64 -------------------------------------------------------------------------------- K point 390 = 0.015625 0.390625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.83 299.65 402.97 411.19 477.79 908.16 -------------------------------------------------------------------------------- K point 391 = 0.015625 0.390625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.10 311.06 412.98 420.77 461.88 901.11 -------------------------------------------------------------------------------- K point 392 = 0.015625 0.390625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.33 319.12 421.69 428.68 450.68 893.16 -------------------------------------------------------------------------------- K point 393 = 0.015625 0.390625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.05 322.43 429.31 434.07 445.91 884.74 -------------------------------------------------------------------------------- K point 394 = 0.015625 0.390625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.81 321.58 435.90 438.74 445.75 876.03 -------------------------------------------------------------------------------- K point 395 = 0.015625 0.390625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.19 319.27 441.39 444.70 446.96 866.88 -------------------------------------------------------------------------------- K point 396 = 0.015625 0.390625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.84 318.73 445.59 446.97 453.30 856.98 -------------------------------------------------------------------------------- K point 397 = 0.015625 0.390625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.99 322.80 448.28 448.64 461.27 845.90 -------------------------------------------------------------------------------- K point 398 = 0.015625 0.390625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.06 331.02 450.00 451.44 468.62 833.23 -------------------------------------------------------------------------------- K point 399 = 0.015625 0.390625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.28 345.07 450.08 456.96 474.74 818.63 -------------------------------------------------------------------------------- K point 400 = 0.015625 0.390625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.08 363.63 448.68 465.73 479.37 801.92 -------------------------------------------------------------------------------- K point 401 = 0.015625 0.390625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.47 385.14 445.79 477.14 483.60 783.05 -------------------------------------------------------------------------------- K point 402 = 0.015625 0.390625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.53 407.67 441.44 480.98 498.00 762.14 -------------------------------------------------------------------------------- K point 403 = 0.015625 0.390625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.35 429.18 435.79 479.65 520.29 739.59 -------------------------------------------------------------------------------- K point 404 = 0.015625 0.390625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.08 428.59 448.30 476.02 547.07 716.13 -------------------------------------------------------------------------------- K point 405 = 0.015625 0.390625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.91 420.41 461.34 472.45 576.51 693.24 -------------------------------------------------------------------------------- K point 406 = 0.015625 0.390625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.01 411.28 457.43 478.86 604.91 674.62 -------------------------------------------------------------------------------- K point 407 = 0.015625 0.390625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.56 401.47 445.93 484.21 620.96 672.42 -------------------------------------------------------------------------------- K point 408 = 0.015625 0.390625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.69 391.36 430.94 482.57 617.78 694.81 -------------------------------------------------------------------------------- K point 409 = 0.015625 0.390625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.45 381.44 412.64 473.29 612.13 725.21 -------------------------------------------------------------------------------- K point 410 = 0.015625 0.390625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.77 372.30 391.26 458.29 609.27 756.33 -------------------------------------------------------------------------------- K point 411 = 0.015625 0.390625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.48 364.30 367.80 440.52 607.96 786.28 -------------------------------------------------------------------------------- K point 412 = 0.015625 0.390625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.47 342.20 359.42 422.26 606.41 814.17 -------------------------------------------------------------------------------- K point 413 = 0.015625 0.390625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.85 317.77 356.47 404.93 603.35 839.45 -------------------------------------------------------------------------------- K point 414 = 0.015625 0.390625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.02 295.71 356.13 389.60 598.08 861.65 -------------------------------------------------------------------------------- K point 415 = 0.015625 0.390625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.62 277.75 358.11 377.26 590.23 880.42 -------------------------------------------------------------------------------- K point 416 = 0.015625 0.390625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.33 265.24 361.90 369.03 579.72 895.45 -------------------------------------------------------------------------------- K point 417 = 0.015625 0.421875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.01 271.43 359.13 363.30 606.48 876.27 -------------------------------------------------------------------------------- K point 418 = 0.015625 0.421875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.24 272.57 361.23 369.68 591.87 883.40 -------------------------------------------------------------------------------- K point 419 = 0.015625 0.421875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.42 278.86 367.82 377.75 574.79 886.90 -------------------------------------------------------------------------------- K point 420 = 0.015625 0.421875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.68 289.10 377.86 387.17 555.75 887.07 -------------------------------------------------------------------------------- K point 421 = 0.015625 0.421875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.92 301.83 389.28 398.10 535.42 884.42 -------------------------------------------------------------------------------- K point 422 = 0.015625 0.421875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.92 315.47 400.15 410.44 514.74 879.63 -------------------------------------------------------------------------------- K point 423 = 0.015625 0.421875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.34 328.31 410.04 422.70 495.01 873.49 -------------------------------------------------------------------------------- K point 424 = 0.015625 0.421875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.76 338.42 419.12 433.18 478.04 866.75 -------------------------------------------------------------------------------- K point 425 = 0.015625 0.421875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.73 343.83 427.38 441.12 465.86 859.97 -------------------------------------------------------------------------------- K point 426 = 0.015625 0.421875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.82 343.57 434.74 446.92 459.43 853.42 -------------------------------------------------------------------------------- K point 427 = 0.015625 0.421875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.64 339.12 441.04 451.03 458.14 847.05 -------------------------------------------------------------------------------- K point 428 = 0.015625 0.421875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.82 333.85 446.17 451.77 462.31 840.48 -------------------------------------------------------------------------------- K point 429 = 0.015625 0.421875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.06 331.02 450.00 451.44 468.62 833.23 -------------------------------------------------------------------------------- K point 430 = 0.015625 0.421875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.53 333.40 452.08 452.53 474.72 824.76 -------------------------------------------------------------------------------- K point 431 = 0.015625 0.421875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.03 340.05 453.46 455.03 479.74 814.64 -------------------------------------------------------------------------------- K point 432 = 0.015625 0.421875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.52 352.87 452.96 460.89 483.23 802.58 -------------------------------------------------------------------------------- K point 433 = 0.015625 0.421875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.58 370.34 450.93 470.24 484.99 788.50 -------------------------------------------------------------------------------- K point 434 = 0.015625 0.421875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.28 390.81 447.39 482.74 485.55 772.50 -------------------------------------------------------------------------------- K point 435 = 0.015625 0.421875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.72 412.11 442.40 482.70 500.79 755.02 -------------------------------------------------------------------------------- K point 436 = 0.015625 0.421875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.04 431.29 436.17 479.59 521.60 736.84 -------------------------------------------------------------------------------- K point 437 = 0.015625 0.421875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.44 428.30 444.71 477.24 545.39 719.39 -------------------------------------------------------------------------------- K point 438 = 0.015625 0.421875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.14 419.59 446.29 479.19 570.33 705.04 -------------------------------------------------------------------------------- K point 439 = 0.015625 0.421875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.37 410.01 438.01 481.96 593.40 697.53 -------------------------------------------------------------------------------- K point 440 = 0.015625 0.421875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.35 399.85 424.59 479.49 610.93 701.12 -------------------------------------------------------------------------------- K point 441 = 0.015625 0.421875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.25 389.47 407.82 470.12 621.79 716.45 -------------------------------------------------------------------------------- K point 442 = 0.015625 0.421875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.18 379.31 388.46 455.18 628.50 738.95 -------------------------------------------------------------------------------- K point 443 = 0.015625 0.421875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.08 366.44 370.73 437.11 632.98 763.97 -------------------------------------------------------------------------------- K point 444 = 0.015625 0.421875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.82 344.47 362.80 418.20 635.45 788.85 -------------------------------------------------------------------------------- K point 445 = 0.015625 0.421875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.22 322.72 357.43 400.13 635.52 812.16 -------------------------------------------------------------------------------- K point 446 = 0.015625 0.421875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.29 303.12 354.80 384.23 632.82 833.04 -------------------------------------------------------------------------------- K point 447 = 0.015625 0.421875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.32 287.34 354.95 371.62 627.10 850.93 -------------------------------------------------------------------------------- K point 448 = 0.015625 0.421875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.83 276.72 357.49 363.44 618.30 865.42 -------------------------------------------------------------------------------- K point 449 = 0.015625 0.453125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.87 281.05 354.92 358.18 641.76 847.67 -------------------------------------------------------------------------------- K point 450 = 0.015625 0.453125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.52 283.18 357.53 364.04 628.86 853.91 -------------------------------------------------------------------------------- K point 451 = 0.015625 0.453125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.68 290.18 364.70 372.21 612.86 856.91 -------------------------------------------------------------------------------- K point 452 = 0.015625 0.453125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.58 301.01 374.71 382.89 594.22 856.90 -------------------------------------------------------------------------------- K point 453 = 0.015625 0.453125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.23 314.39 385.27 396.37 573.54 854.33 -------------------------------------------------------------------------------- K point 454 = 0.015625 0.453125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.51 328.90 395.54 411.35 551.57 849.86 -------------------------------------------------------------------------------- K point 455 = 0.015625 0.453125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.14 343.05 405.50 425.83 529.35 844.29 -------------------------------------------------------------------------------- K point 456 = 0.015625 0.453125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.78 355.18 415.04 438.20 508.33 838.47 -------------------------------------------------------------------------------- K point 457 = 0.015625 0.453125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.03 363.31 423.98 447.62 490.43 833.12 -------------------------------------------------------------------------------- K point 458 = 0.015625 0.453125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.47 365.46 432.12 454.17 477.60 828.62 -------------------------------------------------------------------------------- K point 459 = 0.015625 0.453125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.72 361.25 439.28 458.50 470.65 825.00 -------------------------------------------------------------------------------- K point 460 = 0.015625 0.453125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.42 353.19 445.32 459.22 470.37 821.87 -------------------------------------------------------------------------------- K point 461 = 0.015625 0.453125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.28 345.07 450.08 456.96 474.74 818.63 -------------------------------------------------------------------------------- K point 462 = 0.015625 0.453125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.03 340.05 453.46 455.03 479.74 814.64 -------------------------------------------------------------------------------- K point 463 = 0.015625 0.453125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.83 340.74 454.88 455.41 483.92 809.31 -------------------------------------------------------------------------------- K point 464 = 0.015625 0.453125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.74 345.80 455.77 457.48 486.73 802.26 -------------------------------------------------------------------------------- K point 465 = 0.015625 0.453125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.54 357.22 454.62 463.22 487.89 793.32 -------------------------------------------------------------------------------- K point 466 = 0.015625 0.453125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.94 373.23 451.92 472.28 487.36 782.55 -------------------------------------------------------------------------------- K point 467 = 0.015625 0.453125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.04 391.96 447.72 484.32 485.50 770.34 -------------------------------------------------------------------------------- K point 468 = 0.015625 0.453125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.99 410.61 442.08 482.17 499.82 757.42 -------------------------------------------------------------------------------- K point 469 = 0.015625 0.453125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.97 425.10 435.13 479.46 517.84 744.96 -------------------------------------------------------------------------------- K point 470 = 0.015625 0.453125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.22 426.86 430.91 478.79 538.43 734.59 -------------------------------------------------------------------------------- K point 471 = 0.015625 0.453125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.01 417.76 426.71 478.73 560.85 728.23 -------------------------------------------------------------------------------- K point 472 = 0.015625 0.453125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.60 407.85 415.90 474.98 583.65 727.51 -------------------------------------------------------------------------------- K point 473 = 0.015625 0.453125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.27 397.38 401.17 465.46 605.12 733.01 -------------------------------------------------------------------------------- K point 474 = 0.015625 0.453125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.22 383.24 387.36 450.82 623.81 744.07 -------------------------------------------------------------------------------- K point 475 = 0.015625 0.453125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.59 364.17 377.19 432.93 638.79 759.11 -------------------------------------------------------------------------------- K point 476 = 0.015625 0.453125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.37 344.32 368.09 413.86 649.62 776.30 -------------------------------------------------------------------------------- K point 477 = 0.015625 0.453125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.42 325.04 360.67 395.44 656.21 793.98 -------------------------------------------------------------------------------- K point 478 = 0.015625 0.453125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.50 307.80 355.61 379.20 658.60 810.80 -------------------------------------------------------------------------------- K point 479 = 0.015625 0.453125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.47 294.12 353.40 366.45 656.87 825.78 -------------------------------------------------------------------------------- K point 480 = 0.015625 0.453125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.42 285.32 354.09 358.37 651.19 838.22 -------------------------------------------------------------------------------- K point 481 = 0.015625 0.484375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.04 287.31 352.27 354.23 667.78 825.47 -------------------------------------------------------------------------------- K point 482 = 0.015625 0.484375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.84 290.40 355.00 359.28 658.70 828.75 -------------------------------------------------------------------------------- K point 483 = 0.015625 0.484375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.53 298.25 361.61 368.09 645.50 829.66 -------------------------------------------------------------------------------- K point 484 = 0.015625 0.484375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.44 309.90 370.15 380.94 628.72 828.23 -------------------------------------------------------------------------------- K point 485 = 0.015625 0.484375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.76 324.13 379.63 396.74 608.99 824.76 -------------------------------------------------------------------------------- K point 486 = 0.015625 0.484375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.48 339.63 389.61 413.70 587.04 819.82 -------------------------------------------------------------------------------- K point 487 = 0.015625 0.484375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.43 355.07 399.75 429.99 563.76 814.18 -------------------------------------------------------------------------------- K point 488 = 0.015625 0.484375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.36 369.03 409.74 443.99 540.30 808.75 -------------------------------------------------------------------------------- K point 489 = 0.015625 0.484375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.91 379.84 419.29 454.63 518.27 804.40 -------------------------------------------------------------------------------- K point 490 = 0.015625 0.484375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.71 385.34 428.16 461.75 499.69 801.69 -------------------------------------------------------------------------------- K point 491 = 0.015625 0.484375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.39 383.61 436.14 466.36 486.22 800.69 -------------------------------------------------------------------------------- K point 492 = 0.015625 0.484375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.62 375.19 443.03 468.80 478.71 801.01 -------------------------------------------------------------------------------- K point 493 = 0.015625 0.484375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.08 363.63 448.68 465.73 479.37 801.92 -------------------------------------------------------------------------------- K point 494 = 0.015625 0.484375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.52 352.87 452.96 460.89 483.23 802.58 -------------------------------------------------------------------------------- K point 495 = 0.015625 0.484375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.74 345.80 455.77 457.48 486.73 802.26 -------------------------------------------------------------------------------- K point 496 = 0.015625 0.484375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.88 344.81 456.51 457.08 488.99 800.44 -------------------------------------------------------------------------------- K point 497 = 0.015625 0.484375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.18 348.26 456.80 458.57 489.70 796.83 -------------------------------------------------------------------------------- K point 498 = 0.015625 0.484375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.34 358.08 454.96 463.70 488.82 791.43 -------------------------------------------------------------------------------- K point 499 = 0.015625 0.484375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.15 372.27 451.59 471.59 486.57 784.55 -------------------------------------------------------------------------------- K point 500 = 0.015625 0.484375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.76 388.53 446.74 480.32 484.93 776.77 -------------------------------------------------------------------------------- K point 501 = 0.015625 0.484375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.34 403.40 440.51 478.92 495.57 769.04 -------------------------------------------------------------------------------- K point 502 = 0.015625 0.484375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.14 412.36 433.04 476.42 511.01 762.55 -------------------------------------------------------------------------------- K point 503 = 0.015625 0.484375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.42 412.48 424.47 474.08 530.14 758.55 -------------------------------------------------------------------------------- K point 504 = 0.015625 0.484375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.51 404.89 415.05 469.15 552.45 757.95 -------------------------------------------------------------------------------- K point 505 = 0.015625 0.484375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.70 392.30 405.03 459.64 576.28 760.97 -------------------------------------------------------------------------------- K point 506 = 0.015625 0.484375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.31 376.69 394.68 445.62 599.84 767.09 -------------------------------------------------------------------------------- K point 507 = 0.015625 0.484375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.58 359.39 384.37 428.40 621.67 775.37 -------------------------------------------------------------------------------- K point 508 = 0.015625 0.484375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.67 341.53 374.55 409.76 640.60 784.82 -------------------------------------------------------------------------------- K point 509 = 0.015625 0.484375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.59 324.32 365.79 391.53 655.69 794.60 -------------------------------------------------------------------------------- K point 510 = 0.015625 0.484375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.18 309.11 358.75 375.37 666.22 804.08 -------------------------------------------------------------------------------- K point 511 = 0.015625 0.484375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.16 297.26 354.13 362.75 671.79 812.72 -------------------------------------------------------------------------------- K point 512 = 0.015625 0.484375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.23 289.97 352.51 354.85 672.25 820.00 -------------------------------------------------------------------------------- K point 513 = 0.015625 0.515625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.51 289.15 352.14 352.51 675.57 818.63 -------------------------------------------------------------------------------- K point 514 = 0.015625 0.515625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.26 293.29 353.44 357.44 673.66 815.67 -------------------------------------------------------------------------------- K point 515 = 0.015625 0.515625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.25 302.29 357.82 367.52 666.57 811.29 -------------------------------------------------------------------------------- K point 516 = 0.015625 0.515625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.80 315.18 364.65 381.79 654.63 805.64 -------------------------------------------------------------------------------- K point 517 = 0.015625 0.515625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.22 330.70 373.22 398.88 638.43 798.98 -------------------------------------------------------------------------------- K point 518 = 0.015625 0.515625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.67 347.55 382.87 417.14 618.73 791.74 -------------------------------------------------------------------------------- K point 519 = 0.015625 0.515625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.14 364.43 393.07 434.80 596.44 784.60 -------------------------------------------------------------------------------- K point 520 = 0.015625 0.515625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.45 380.15 403.38 450.12 572.62 778.47 -------------------------------------------------------------------------------- K point 521 = 0.015625 0.515625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.37 393.34 413.43 461.67 548.64 774.30 -------------------------------------------------------------------------------- K point 522 = 0.015625 0.515625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.56 402.20 422.93 468.91 526.24 772.82 -------------------------------------------------------------------------------- K point 523 = 0.015625 0.515625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.68 404.24 431.63 472.86 507.31 774.19 -------------------------------------------------------------------------------- K point 524 = 0.015625 0.515625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.42 397.89 439.31 475.79 492.77 777.92 -------------------------------------------------------------------------------- K point 525 = 0.015625 0.515625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.47 385.14 445.79 477.14 483.60 783.05 -------------------------------------------------------------------------------- K point 526 = 0.015625 0.515625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.58 370.34 450.93 470.24 484.99 788.50 -------------------------------------------------------------------------------- K point 527 = 0.015625 0.515625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.54 357.22 454.62 463.22 487.89 793.32 -------------------------------------------------------------------------------- K point 528 = 0.015625 0.515625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.18 348.26 456.80 458.57 489.70 796.83 -------------------------------------------------------------------------------- K point 529 = 0.015625 0.515625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.69 345.62 456.84 457.43 490.00 798.64 -------------------------------------------------------------------------------- K point 530 = 0.015625 0.515625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.37 347.44 456.45 458.20 488.71 798.65 -------------------------------------------------------------------------------- K point 531 = 0.015625 0.515625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.93 355.48 453.95 462.27 486.03 797.06 -------------------------------------------------------------------------------- K point 532 = 0.015625 0.515625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.22 367.46 449.95 468.27 482.59 794.32 -------------------------------------------------------------------------------- K point 533 = 0.015625 0.515625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.43 380.68 444.54 473.27 481.53 791.18 -------------------------------------------------------------------------------- K point 534 = 0.015625 0.515625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.77 391.26 437.84 471.55 489.67 788.54 -------------------------------------------------------------------------------- K point 535 = 0.015625 0.515625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.54 395.21 429.99 467.88 503.59 787.32 -------------------------------------------------------------------------------- K point 536 = 0.015625 0.515625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.05 391.31 421.19 462.27 522.37 788.19 -------------------------------------------------------------------------------- K point 537 = 0.015625 0.515625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.65 381.39 411.65 453.11 544.69 791.30 -------------------------------------------------------------------------------- K point 538 = 0.015625 0.515625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.69 367.74 401.62 440.08 568.53 796.25 -------------------------------------------------------------------------------- K point 539 = 0.015625 0.515625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.52 352.09 391.39 424.02 592.22 802.23 -------------------------------------------------------------------------------- K point 540 = 0.015625 0.515625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.39 335.81 381.32 406.43 614.50 808.27 -------------------------------------------------------------------------------- K point 541 = 0.015625 0.515625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.47 320.18 371.81 389.08 634.41 813.56 -------------------------------------------------------------------------------- K point 542 = 0.015625 0.515625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.78 306.51 363.38 373.73 651.13 817.46 -------------------------------------------------------------------------------- K point 543 = 0.015625 0.515625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.13 296.07 356.64 361.98 663.95 819.64 -------------------------------------------------------------------------------- K point 544 = 0.015625 0.515625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.23 289.97 352.51 354.85 672.25 820.00 -------------------------------------------------------------------------------- K point 545 = 0.015625 0.546875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.07 286.04 353.54 354.73 660.62 831.68 -------------------------------------------------------------------------------- K point 546 = 0.015625 0.546875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.90 291.54 352.88 359.67 665.88 822.51 -------------------------------------------------------------------------------- K point 547 = 0.015625 0.546875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.91 302.04 354.82 370.19 666.66 811.17 -------------------------------------------------------------------------------- K point 548 = 0.015625 0.546875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.91 316.66 359.68 384.85 662.75 798.30 -------------------------------------------------------------------------------- K point 549 = 0.015625 0.546875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.12 334.02 366.93 402.37 654.06 784.73 -------------------------------------------------------------------------------- K point 550 = 0.015625 0.546875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.80 352.68 375.87 421.26 640.76 771.41 -------------------------------------------------------------------------------- K point 551 = 0.015625 0.546875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.10 371.33 385.82 439.77 623.34 759.40 -------------------------------------------------------------------------------- K point 552 = 0.015625 0.546875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.02 388.85 396.22 456.00 602.63 749.85 -------------------------------------------------------------------------------- K point 553 = 0.015625 0.546875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.42 404.16 406.60 468.11 579.82 743.92 -------------------------------------------------------------------------------- K point 554 = 0.015625 0.546875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.05 416.02 416.52 474.99 556.45 742.49 -------------------------------------------------------------------------------- K point 555 = 0.015625 0.546875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.65 422.06 425.83 477.40 534.24 745.68 -------------------------------------------------------------------------------- K point 556 = 0.015625 0.546875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.90 419.39 434.21 478.53 514.62 752.71 -------------------------------------------------------------------------------- K point 557 = 0.015625 0.546875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.53 407.67 441.44 480.98 498.00 762.14 -------------------------------------------------------------------------------- K point 558 = 0.015625 0.546875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.28 390.81 447.39 482.74 485.55 772.50 -------------------------------------------------------------------------------- K point 559 = 0.015625 0.546875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.94 373.23 451.92 472.28 487.36 782.55 -------------------------------------------------------------------------------- K point 560 = 0.015625 0.546875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.34 358.08 454.96 463.70 488.82 791.43 -------------------------------------------------------------------------------- K point 561 = 0.015625 0.546875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.37 347.44 456.45 458.20 488.71 798.65 -------------------------------------------------------------------------------- K point 562 = 0.015625 0.546875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.26 343.18 455.85 456.41 486.97 804.01 -------------------------------------------------------------------------------- K point 563 = 0.015625 0.546875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.29 343.33 454.77 456.42 483.74 807.62 -------------------------------------------------------------------------------- K point 564 = 0.015625 0.546875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.30 349.41 451.66 459.10 479.47 809.81 -------------------------------------------------------------------------------- K point 565 = 0.015625 0.546875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.14 358.87 447.12 462.70 475.30 811.15 -------------------------------------------------------------------------------- K point 566 = 0.015625 0.546875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.05 368.70 441.27 463.85 475.09 812.35 -------------------------------------------------------------------------------- K point 567 = 0.015625 0.546875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.29 374.99 434.22 460.48 482.25 814.12 -------------------------------------------------------------------------------- K point 568 = 0.015625 0.546875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.20 374.69 426.15 454.87 495.38 817.03 -------------------------------------------------------------------------------- K point 569 = 0.015625 0.546875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.15 367.79 417.24 446.47 513.66 821.23 -------------------------------------------------------------------------------- K point 570 = 0.015625 0.546875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.51 356.25 407.70 434.76 535.24 826.47 -------------------------------------------------------------------------------- K point 571 = 0.015625 0.546875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.69 342.12 397.75 420.27 558.14 832.09 -------------------------------------------------------------------------------- K point 572 = 0.015625 0.546875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.04 327.06 387.65 404.31 580.82 837.23 -------------------------------------------------------------------------------- K point 573 = 0.015625 0.546875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.81 312.52 377.59 388.64 602.22 841.03 -------------------------------------------------------------------------------- K point 574 = 0.015625 0.546875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.17 299.87 367.79 375.23 621.49 842.76 -------------------------------------------------------------------------------- K point 575 = 0.015625 0.546875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.10 290.43 359.22 365.26 638.00 841.91 -------------------------------------------------------------------------------- K point 576 = 0.015625 0.546875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.42 285.32 354.09 358.37 651.19 838.22 -------------------------------------------------------------------------------- K point 577 = 0.015625 0.578125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.55 278.54 356.81 359.21 630.71 856.81 -------------------------------------------------------------------------------- K point 578 = 0.015625 0.578125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.91 285.60 354.47 364.21 639.91 844.73 -------------------------------------------------------------------------------- K point 579 = 0.015625 0.578125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.93 297.93 354.05 374.78 645.71 829.40 -------------------------------------------------------------------------------- K point 580 = 0.015625 0.578125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.93 314.67 356.48 389.33 648.05 811.25 -------------------------------------------------------------------------------- K point 581 = 0.015625 0.578125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.72 334.31 361.71 406.69 646.95 790.93 -------------------------------------------------------------------------------- K point 582 = 0.015625 0.578125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.36 355.23 369.29 425.57 642.48 769.42 -------------------------------------------------------------------------------- K point 583 = 0.015625 0.578125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.05 375.63 378.84 444.37 634.65 748.22 -------------------------------------------------------------------------------- K point 584 = 0.015625 0.578125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.94 388.24 395.79 461.09 623.22 729.65 -------------------------------------------------------------------------------- K point 585 = 0.015625 0.578125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.04 398.74 412.98 473.47 607.72 716.73 -------------------------------------------------------------------------------- K point 586 = 0.015625 0.578125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.25 409.04 427.18 479.72 588.11 711.94 -------------------------------------------------------------------------------- K point 587 = 0.015625 0.578125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.37 418.80 436.85 480.12 565.61 715.57 -------------------------------------------------------------------------------- K point 588 = 0.015625 0.578125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.16 427.72 438.60 478.52 542.34 725.68 -------------------------------------------------------------------------------- K point 589 = 0.015625 0.578125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.35 429.18 435.79 479.65 520.29 739.59 -------------------------------------------------------------------------------- K point 590 = 0.015625 0.578125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.72 412.11 442.40 482.70 500.79 755.02 -------------------------------------------------------------------------------- K point 591 = 0.015625 0.578125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.04 391.96 447.72 484.32 485.50 770.34 -------------------------------------------------------------------------------- K point 592 = 0.015625 0.578125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.15 372.27 451.59 471.59 486.57 784.55 -------------------------------------------------------------------------------- K point 593 = 0.015625 0.578125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.93 355.48 453.95 462.27 486.03 797.06 -------------------------------------------------------------------------------- K point 594 = 0.015625 0.578125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.29 343.33 454.77 456.42 483.74 807.62 -------------------------------------------------------------------------------- K point 595 = 0.015625 0.578125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.59 337.48 453.62 454.11 479.84 816.26 -------------------------------------------------------------------------------- K point 596 = 0.015625 0.578125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.95 335.94 451.86 453.37 474.70 823.21 -------------------------------------------------------------------------------- K point 597 = 0.015625 0.578125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.45 339.89 448.24 454.50 469.02 828.91 -------------------------------------------------------------------------------- K point 598 = 0.015625 0.578125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.92 346.60 443.28 455.35 464.61 833.89 -------------------------------------------------------------------------------- K point 599 = 0.015625 0.578125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.64 352.86 437.10 452.85 465.42 838.75 -------------------------------------------------------------------------------- K point 600 = 0.015625 0.578125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.94 355.06 429.84 447.66 472.16 843.97 -------------------------------------------------------------------------------- K point 601 = 0.015625 0.578125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.21 351.20 421.64 440.30 484.68 849.75 -------------------------------------------------------------------------------- K point 602 = 0.015625 0.578125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.84 342.00 412.67 430.17 502.14 855.95 -------------------------------------------------------------------------------- K point 603 = 0.015625 0.578125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.27 329.44 403.07 417.57 522.54 862.06 -------------------------------------------------------------------------------- K point 604 = 0.015625 0.578125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.90 315.44 392.87 403.74 544.00 867.35 -------------------------------------------------------------------------------- K point 605 = 0.015625 0.578125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.10 301.69 381.98 390.62 565.17 870.99 -------------------------------------------------------------------------------- K point 606 = 0.015625 0.578125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.10 289.73 371.03 379.64 585.06 872.24 -------------------------------------------------------------------------------- K point 607 = 0.015625 0.578125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.03 280.99 362.22 370.66 602.95 870.51 -------------------------------------------------------------------------------- K point 608 = 0.015625 0.578125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.83 276.72 357.49 363.44 618.30 865.42 -------------------------------------------------------------------------------- K point 609 = 0.015625 0.609375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.98 267.70 361.30 364.55 593.57 886.32 -------------------------------------------------------------------------------- K point 610 = 0.015625 0.609375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.24 276.34 357.80 369.70 604.74 873.33 -------------------------------------------------------------------------------- K point 611 = 0.015625 0.609375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.67 290.70 355.51 380.21 613.08 856.61 -------------------------------------------------------------------------------- K point 612 = 0.015625 0.609375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.59 309.74 355.62 394.41 618.59 836.45 -------------------------------------------------------------------------------- K point 613 = 0.015625 0.609375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.39 331.92 358.42 411.23 621.51 813.20 -------------------------------------------------------------------------------- K point 614 = 0.015625 0.609375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.73 355.39 363.96 429.58 622.28 787.38 -------------------------------------------------------------------------------- K point 615 = 0.015625 0.609375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.54 371.17 379.10 448.13 621.69 759.70 -------------------------------------------------------------------------------- K point 616 = 0.015625 0.609375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.97 380.47 400.60 464.95 620.77 731.31 -------------------------------------------------------------------------------- K point 617 = 0.015625 0.609375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.17 390.51 419.65 477.43 619.84 704.74 -------------------------------------------------------------------------------- K point 618 = 0.015625 0.609375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.19 400.76 435.70 483.12 615.22 686.32 -------------------------------------------------------------------------------- K point 619 = 0.015625 0.609375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.95 410.76 448.19 481.60 599.28 684.78 -------------------------------------------------------------------------------- K point 620 = 0.015625 0.609375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.32 420.14 454.76 476.28 574.24 697.35 -------------------------------------------------------------------------------- K point 621 = 0.015625 0.609375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.08 428.59 448.30 476.02 547.07 716.13 -------------------------------------------------------------------------------- K point 622 = 0.015625 0.609375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.04 431.29 436.17 479.59 521.60 736.84 -------------------------------------------------------------------------------- K point 623 = 0.015625 0.609375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.99 410.61 442.08 482.17 499.82 757.42 -------------------------------------------------------------------------------- K point 624 = 0.015625 0.609375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.76 388.53 446.74 480.32 484.93 776.77 -------------------------------------------------------------------------------- K point 625 = 0.015625 0.609375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.22 367.46 449.95 468.27 482.59 794.32 -------------------------------------------------------------------------------- K point 626 = 0.015625 0.609375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.30 349.41 451.66 459.10 479.47 809.81 -------------------------------------------------------------------------------- K point 627 = 0.015625 0.609375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.95 335.94 451.86 453.37 474.70 823.21 -------------------------------------------------------------------------------- K point 628 = 0.015625 0.609375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.66 328.51 450.29 450.70 468.53 834.68 -------------------------------------------------------------------------------- K point 629 = 0.015625 0.609375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.35 325.28 447.90 449.30 461.48 844.53 -------------------------------------------------------------------------------- K point 630 = 0.015625 0.609375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.40 326.97 443.89 448.78 454.65 853.20 -------------------------------------------------------------------------------- K point 631 = 0.015625 0.609375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.60 330.77 438.61 445.80 451.49 861.15 -------------------------------------------------------------------------------- K point 632 = 0.015625 0.609375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.29 333.41 432.18 440.69 452.83 868.82 -------------------------------------------------------------------------------- K point 633 = 0.015625 0.609375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.85 331.83 424.72 434.73 458.69 876.42 -------------------------------------------------------------------------------- K point 634 = 0.015625 0.609375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.71 325.02 416.31 426.55 470.44 883.92 -------------------------------------------------------------------------------- K point 635 = 0.015625 0.609375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.33 314.16 406.92 416.22 486.89 890.95 -------------------------------------------------------------------------------- K point 636 = 0.015625 0.609375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.15 301.25 396.36 405.04 505.94 896.87 -------------------------------------------------------------------------------- K point 637 = 0.015625 0.609375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.60 288.21 384.87 394.49 525.83 900.95 -------------------------------------------------------------------------------- K point 638 = 0.015625 0.609375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.01 276.81 374.05 384.96 545.31 902.45 -------------------------------------------------------------------------------- K point 639 = 0.015625 0.609375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.57 268.67 365.91 376.41 563.48 900.76 -------------------------------------------------------------------------------- K point 640 = 0.015625 0.609375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.33 265.24 361.90 369.03 579.72 895.45 -------------------------------------------------------------------------------- K point 641 = 0.015625 0.640625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.09 254.35 366.22 370.05 552.72 916.66 -------------------------------------------------------------------------------- K point 642 = 0.015625 0.640625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.72 264.64 362.01 375.35 565.08 903.61 -------------------------------------------------------------------------------- K point 643 = 0.015625 0.640625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.05 281.00 358.46 385.72 574.96 886.63 -------------------------------------------------------------------------------- K point 644 = 0.015625 0.640625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.42 302.35 356.77 399.43 582.34 865.98 -------------------------------------------------------------------------------- K point 645 = 0.015625 0.640625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.11 327.12 357.32 415.45 587.38 841.96 -------------------------------------------------------------------------------- K point 646 = 0.015625 0.640625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.48 353.36 360.45 432.88 590.61 814.94 -------------------------------------------------------------------------------- K point 647 = 0.015625 0.640625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.08 365.64 379.63 450.70 593.02 785.35 -------------------------------------------------------------------------------- K point 648 = 0.015625 0.640625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.76 373.23 403.51 467.25 596.42 753.66 -------------------------------------------------------------------------------- K point 649 = 0.015625 0.640625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.62 382.25 424.15 479.79 603.45 720.47 -------------------------------------------------------------------------------- K point 650 = 0.015625 0.640625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.83 392.03 441.15 485.35 616.02 686.94 -------------------------------------------------------------------------------- K point 651 = 0.015625 0.640625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.47 401.95 454.65 483.12 628.34 659.55 -------------------------------------------------------------------------------- K point 652 = 0.015625 0.640625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.53 411.53 464.98 474.53 608.64 668.65 -------------------------------------------------------------------------------- K point 653 = 0.015625 0.640625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.91 420.41 461.34 472.45 576.51 693.24 -------------------------------------------------------------------------------- K point 654 = 0.015625 0.640625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.44 428.30 444.71 477.24 545.39 719.39 -------------------------------------------------------------------------------- K point 655 = 0.015625 0.640625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.97 425.10 435.13 479.46 517.84 744.96 -------------------------------------------------------------------------------- K point 656 = 0.015625 0.640625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.34 403.40 440.51 478.92 495.57 769.04 -------------------------------------------------------------------------------- K point 657 = 0.015625 0.640625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.43 380.68 444.54 473.27 481.53 791.18 -------------------------------------------------------------------------------- K point 658 = 0.015625 0.640625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.14 358.87 447.12 462.70 475.30 811.15 -------------------------------------------------------------------------------- K point 659 = 0.015625 0.640625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.45 339.89 448.24 454.50 469.02 828.91 -------------------------------------------------------------------------------- K point 660 = 0.015625 0.640625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.35 325.28 447.90 449.30 461.48 844.53 -------------------------------------------------------------------------------- K point 661 = 0.015625 0.640625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.52 316.30 446.08 446.39 452.94 858.26 -------------------------------------------------------------------------------- K point 662 = 0.015625 0.640625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.54 311.40 443.02 443.99 444.65 870.41 -------------------------------------------------------------------------------- K point 663 = 0.015625 0.640625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.22 310.76 435.56 438.89 443.04 881.36 -------------------------------------------------------------------------------- K point 664 = 0.015625 0.640625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.28 311.56 429.23 433.50 441.03 891.49 -------------------------------------------------------------------------------- K point 665 = 0.015625 0.640625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.13 310.67 424.81 427.98 439.17 901.03 -------------------------------------------------------------------------------- K point 666 = 0.015625 0.640625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.19 305.75 417.89 423.37 441.98 910.00 -------------------------------------------------------------------------------- K point 667 = 0.015625 0.640625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.95 296.63 408.84 416.22 452.38 918.16 -------------------------------------------------------------------------------- K point 668 = 0.015625 0.640625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.89 284.90 398.33 407.58 467.70 924.99 -------------------------------------------------------------------------------- K point 669 = 0.015625 0.640625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.48 272.61 387.26 398.70 485.40 929.82 -------------------------------------------------------------------------------- K point 670 = 0.015625 0.640625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.13 261.76 377.24 390.05 503.75 931.92 -------------------------------------------------------------------------------- K point 671 = 0.015625 0.640625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.07 254.25 369.95 381.88 521.59 930.69 -------------------------------------------------------------------------------- K point 672 = 0.015625 0.640625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.45 251.69 366.65 374.54 538.10 925.68 -------------------------------------------------------------------------------- K point 673 = 0.015625 0.671875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 239.01 239.32 371.14 375.31 509.67 946.32 -------------------------------------------------------------------------------- K point 674 = 0.015625 0.671875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 244.94 251.04 366.53 380.72 522.91 933.58 -------------------------------------------------------------------------------- K point 675 = 0.015625 0.671875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.88 269.28 362.17 390.86 534.01 916.83 -------------------------------------------------------------------------------- K point 676 = 0.015625 0.671875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.29 292.79 359.22 403.95 542.85 896.34 -------------------------------------------------------------------------------- K point 677 = 0.015625 0.671875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.48 320.02 358.02 418.96 549.51 872.42 -------------------------------------------------------------------------------- K point 678 = 0.015625 0.671875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.73 349.04 358.92 435.13 554.36 845.44 -------------------------------------------------------------------------------- K point 679 = 0.015625 0.671875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.37 361.90 377.95 451.76 558.32 815.76 -------------------------------------------------------------------------------- K point 680 = 0.015625 0.671875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.89 367.27 404.17 467.71 563.34 783.79 -------------------------------------------------------------------------------- K point 681 = 0.015625 0.671875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.10 374.60 426.01 480.38 572.78 749.94 -------------------------------------------------------------------------------- K point 682 = 0.015625 0.671875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.06 383.30 442.70 486.46 589.90 714.67 -------------------------------------------------------------------------------- K point 683 = 0.015625 0.671875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.96 392.71 454.37 485.64 614.26 678.58 -------------------------------------------------------------------------------- K point 684 = 0.015625 0.671875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.93 402.19 460.35 481.23 637.27 647.86 -------------------------------------------------------------------------------- K point 685 = 0.015625 0.671875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.01 411.28 457.43 478.86 604.91 674.62 -------------------------------------------------------------------------------- K point 686 = 0.015625 0.671875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.14 419.59 446.29 479.19 570.33 705.04 -------------------------------------------------------------------------------- K point 687 = 0.015625 0.671875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.22 426.86 430.91 478.79 538.43 734.59 -------------------------------------------------------------------------------- K point 688 = 0.015625 0.671875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.14 412.36 433.04 476.42 511.01 762.55 -------------------------------------------------------------------------------- K point 689 = 0.015625 0.671875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.77 391.26 437.84 471.55 489.67 788.54 -------------------------------------------------------------------------------- K point 690 = 0.015625 0.671875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.05 368.70 441.27 463.85 475.09 812.35 -------------------------------------------------------------------------------- K point 691 = 0.015625 0.671875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.92 346.60 443.28 455.35 464.61 833.89 -------------------------------------------------------------------------------- K point 692 = 0.015625 0.671875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.40 326.97 443.89 448.78 454.65 853.20 -------------------------------------------------------------------------------- K point 693 = 0.015625 0.671875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.54 311.40 443.02 443.99 444.65 870.41 -------------------------------------------------------------------------------- K point 694 = 0.015625 0.671875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.22 300.93 433.02 441.23 441.45 885.75 -------------------------------------------------------------------------------- K point 695 = 0.015625 0.671875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.62 294.40 422.28 437.80 439.24 899.52 -------------------------------------------------------------------------------- K point 696 = 0.015625 0.671875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.05 291.43 413.07 433.18 436.63 912.02 -------------------------------------------------------------------------------- K point 697 = 0.015625 0.671875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.15 289.25 407.17 427.47 432.89 923.48 -------------------------------------------------------------------------------- K point 698 = 0.015625 0.671875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.38 285.07 405.99 420.92 427.95 933.99 -------------------------------------------------------------------------------- K point 699 = 0.015625 0.671875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.22 277.39 406.20 415.23 424.30 943.40 -------------------------------------------------------------------------------- K point 700 = 0.015625 0.671875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.20 266.85 399.26 409.80 430.80 951.27 -------------------------------------------------------------------------------- K point 701 = 0.015625 0.671875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.83 255.34 389.57 402.36 444.78 957.00 -------------------------------------------------------------------------------- K point 702 = 0.015625 0.671875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.54 245.09 380.53 394.51 461.23 959.91 -------------------------------------------------------------------------------- K point 703 = 0.015625 0.671875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.64 238.27 374.05 386.82 478.21 959.36 -------------------------------------------------------------------------------- K point 704 = 0.015625 0.671875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.57 236.48 371.36 379.68 494.61 954.91 -------------------------------------------------------------------------------- K point 705 = 0.015625 0.703125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.00 222.91 375.80 380.15 465.17 974.53 -------------------------------------------------------------------------------- K point 706 = 0.015625 0.703125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.32 235.81 371.03 385.57 479.17 962.31 -------------------------------------------------------------------------------- K point 707 = 0.015625 0.703125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.72 255.78 366.19 395.37 491.46 946.05 -------------------------------------------------------------------------------- K point 708 = 0.015625 0.703125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.94 281.26 362.39 407.66 501.77 926.04 -------------------------------------------------------------------------------- K point 709 = 0.015625 0.703125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.31 310.66 359.94 421.44 510.07 902.64 -------------------------------------------------------------------------------- K point 710 = 0.015625 0.703125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.12 342.12 359.10 436.02 516.58 876.22 -------------------------------------------------------------------------------- K point 711 = 0.015625 0.703125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.65 360.05 373.51 451.02 522.00 847.16 -------------------------------------------------------------------------------- K point 712 = 0.015625 0.703125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.22 363.10 401.88 466.02 528.19 815.85 -------------------------------------------------------------------------------- K point 713 = 0.015625 0.703125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.31 368.23 424.28 478.87 539.21 782.72 -------------------------------------------------------------------------------- K point 714 = 0.015625 0.703125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.66 375.21 439.28 485.86 559.31 748.30 -------------------------------------------------------------------------------- K point 715 = 0.015625 0.703125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.34 383.52 447.42 487.21 586.77 713.51 -------------------------------------------------------------------------------- K point 716 = 0.015625 0.703125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.58 392.48 449.43 486.02 614.83 681.43 -------------------------------------------------------------------------------- K point 717 = 0.015625 0.703125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.56 401.47 445.93 484.21 620.96 672.42 -------------------------------------------------------------------------------- K point 718 = 0.015625 0.703125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.37 410.01 438.01 481.96 593.40 697.53 -------------------------------------------------------------------------------- K point 719 = 0.015625 0.703125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.01 417.76 426.71 478.73 560.85 728.23 -------------------------------------------------------------------------------- K point 720 = 0.015625 0.703125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.42 412.48 424.47 474.08 530.14 758.55 -------------------------------------------------------------------------------- K point 721 = 0.015625 0.703125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.54 395.21 429.99 467.88 503.59 787.32 -------------------------------------------------------------------------------- K point 722 = 0.015625 0.703125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.29 374.99 434.22 460.48 482.25 814.12 -------------------------------------------------------------------------------- K point 723 = 0.015625 0.703125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.64 352.86 437.10 452.85 465.42 838.75 -------------------------------------------------------------------------------- K point 724 = 0.015625 0.703125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.60 330.77 438.61 445.80 451.49 861.15 -------------------------------------------------------------------------------- K point 725 = 0.015625 0.703125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.22 310.76 435.56 438.89 443.04 881.36 -------------------------------------------------------------------------------- K point 726 = 0.015625 0.703125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.62 294.40 422.28 437.80 439.24 899.52 -------------------------------------------------------------------------------- K point 727 = 0.015625 0.703125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.92 282.53 408.85 435.97 436.09 915.82 -------------------------------------------------------------------------------- K point 728 = 0.015625 0.703125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.76 274.49 396.41 432.13 433.72 930.51 -------------------------------------------------------------------------------- K point 729 = 0.015625 0.703125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.07 269.24 386.46 427.14 430.47 943.79 -------------------------------------------------------------------------------- K point 730 = 0.015625 0.703125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.40 264.22 380.97 420.92 425.93 955.80 -------------------------------------------------------------------------------- K point 731 = 0.015625 0.703125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.26 257.20 381.42 413.46 420.16 966.45 -------------------------------------------------------------------------------- K point 732 = 0.015625 0.703125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.19 247.62 387.09 405.58 413.68 975.42 -------------------------------------------------------------------------------- K point 733 = 0.015625 0.703125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.71 236.87 389.85 402.84 408.79 982.15 -------------------------------------------------------------------------------- K point 734 = 0.015625 0.703125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 218.30 227.24 383.58 398.06 418.67 985.98 -------------------------------------------------------------------------------- K point 735 = 0.015625 0.703125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.36 221.13 378.02 391.07 433.97 986.25 -------------------------------------------------------------------------------- K point 736 = 0.015625 0.703125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.01 219.78 375.85 384.29 449.87 982.51 -------------------------------------------------------------------------------- K point 737 = 0.015625 0.734375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 203.51 205.03 380.11 384.48 419.67 1000.83 -------------------------------------------------------------------------------- K point 738 = 0.015625 0.734375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.13 219.09 375.35 389.76 434.47 989.27 -------------------------------------------------------------------------------- K point 739 = 0.015625 0.734375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 218.96 240.64 370.28 398.97 448.10 973.66 -------------------------------------------------------------------------------- K point 740 = 0.015625 0.734375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.90 267.81 365.95 410.17 460.20 954.35 -------------------------------------------------------------------------------- K point 741 = 0.015625 0.734375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.27 298.94 362.63 422.34 470.62 931.73 -------------------------------------------------------------------------------- K point 742 = 0.015625 0.734375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.38 332.22 360.52 434.90 479.42 906.18 -------------------------------------------------------------------------------- K point 743 = 0.015625 0.734375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.53 359.81 365.44 447.80 487.05 878.07 -------------------------------------------------------------------------------- K point 744 = 0.015625 0.734375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.01 360.80 395.14 461.47 495.12 847.79 -------------------------------------------------------------------------------- K point 745 = 0.015625 0.734375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.14 363.63 417.05 474.27 508.54 815.75 -------------------------------------------------------------------------------- K point 746 = 0.015625 0.734375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.38 368.43 429.43 481.54 532.86 782.48 -------------------------------------------------------------------------------- K point 747 = 0.015625 0.734375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.47 375.01 434.46 484.09 564.13 748.85 -------------------------------------------------------------------------------- K point 748 = 0.015625 0.734375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.49 382.87 434.50 484.17 595.72 716.98 -------------------------------------------------------------------------------- K point 749 = 0.015625 0.734375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.69 391.36 430.94 482.57 617.78 694.81 -------------------------------------------------------------------------------- K point 750 = 0.015625 0.734375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.35 399.85 424.59 479.49 610.93 701.12 -------------------------------------------------------------------------------- K point 751 = 0.015625 0.734375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.60 407.85 415.90 474.98 583.65 727.51 -------------------------------------------------------------------------------- K point 752 = 0.015625 0.734375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.51 404.89 415.05 469.15 552.45 757.95 -------------------------------------------------------------------------------- K point 753 = 0.015625 0.734375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.05 391.31 421.19 462.27 522.37 788.19 -------------------------------------------------------------------------------- K point 754 = 0.015625 0.734375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.20 374.69 426.15 454.87 495.38 817.03 -------------------------------------------------------------------------------- K point 755 = 0.015625 0.734375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.94 355.06 429.84 447.66 472.16 843.97 -------------------------------------------------------------------------------- K point 756 = 0.015625 0.734375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.29 333.41 432.18 440.69 452.83 868.82 -------------------------------------------------------------------------------- K point 757 = 0.015625 0.734375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.28 311.56 429.23 433.50 441.03 891.49 -------------------------------------------------------------------------------- K point 758 = 0.015625 0.734375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.05 291.43 413.07 433.18 436.63 912.02 -------------------------------------------------------------------------------- K point 759 = 0.015625 0.734375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.76 274.49 396.41 432.13 433.72 930.51 -------------------------------------------------------------------------------- K point 760 = 0.015625 0.734375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.81 261.31 380.52 430.50 430.54 947.12 -------------------------------------------------------------------------------- K point 761 = 0.015625 0.734375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.18 251.90 366.51 426.38 428.13 962.05 -------------------------------------------------------------------------------- K point 762 = 0.015625 0.734375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.51 244.52 356.08 421.00 424.63 975.43 -------------------------------------------------------------------------------- K point 763 = 0.015625 0.734375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.27 236.99 351.19 414.19 419.95 987.25 -------------------------------------------------------------------------------- K point 764 = 0.015625 0.734375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.00 227.86 352.91 406.03 414.33 997.28 -------------------------------------------------------------------------------- K point 765 = 0.015625 0.734375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 207.23 217.70 360.58 397.27 408.14 1005.03 -------------------------------------------------------------------------------- K point 766 = 0.015625 0.734375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 200.47 208.62 372.12 389.60 401.66 1009.83 -------------------------------------------------------------------------------- K point 767 = 0.015625 0.734375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.46 202.98 380.58 389.46 395.53 1011.02 -------------------------------------------------------------------------------- K point 768 = 0.015625 0.734375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.00 201.69 379.99 388.24 404.41 1008.10 -------------------------------------------------------------------------------- K point 769 = 0.015625 0.765625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 183.72 185.82 373.25 384.20 388.27 1024.92 -------------------------------------------------------------------------------- K point 770 = 0.015625 0.765625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 190.62 201.00 379.29 387.46 395.02 1014.11 -------------------------------------------------------------------------------- K point 771 = 0.015625 0.765625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.90 223.97 374.29 397.60 408.40 999.28 -------------------------------------------------------------------------------- K point 772 = 0.015625 0.765625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.56 252.46 369.69 407.38 422.77 980.83 -------------------------------------------------------------------------------- K point 773 = 0.015625 0.765625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.88 284.68 365.81 417.37 436.25 959.18 -------------------------------------------------------------------------------- K point 774 = 0.015625 0.765625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 239.15 318.74 362.81 427.54 448.40 934.70 -------------------------------------------------------------------------------- K point 775 = 0.015625 0.765625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.69 352.21 360.87 438.51 459.30 907.76 -------------------------------------------------------------------------------- K point 776 = 0.015625 0.765625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.82 360.17 381.23 451.57 470.25 878.69 -------------------------------------------------------------------------------- K point 777 = 0.015625 0.765625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.87 360.95 401.14 464.21 487.48 847.88 -------------------------------------------------------------------------------- K point 778 = 0.015625 0.765625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.17 363.45 411.42 471.09 516.08 815.79 -------------------------------------------------------------------------------- K point 779 = 0.015625 0.765625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.14 367.84 415.32 474.13 550.00 783.17 -------------------------------------------------------------------------------- K point 780 = 0.015625 0.765625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.53 374.00 415.33 474.71 583.94 751.54 -------------------------------------------------------------------------------- K point 781 = 0.015625 0.765625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.45 381.44 412.64 473.29 612.13 725.21 -------------------------------------------------------------------------------- K point 782 = 0.015625 0.765625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.25 389.47 407.82 470.12 621.79 716.45 -------------------------------------------------------------------------------- K point 783 = 0.015625 0.765625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.27 397.38 401.17 465.46 605.12 733.01 -------------------------------------------------------------------------------- K point 784 = 0.015625 0.765625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.70 392.30 405.03 459.64 576.28 760.97 -------------------------------------------------------------------------------- K point 785 = 0.015625 0.765625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.65 381.39 411.65 453.11 544.69 791.30 -------------------------------------------------------------------------------- K point 786 = 0.015625 0.765625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.15 367.79 417.24 446.47 513.66 821.23 -------------------------------------------------------------------------------- K point 787 = 0.015625 0.765625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.21 351.20 421.64 440.30 484.68 849.75 -------------------------------------------------------------------------------- K point 788 = 0.015625 0.765625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.85 331.83 424.72 434.73 458.69 876.42 -------------------------------------------------------------------------------- K point 789 = 0.015625 0.765625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.13 310.67 424.81 427.98 439.17 901.03 -------------------------------------------------------------------------------- K point 790 = 0.015625 0.765625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.15 289.25 407.17 427.47 432.89 923.48 -------------------------------------------------------------------------------- K point 791 = 0.015625 0.765625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.07 269.24 386.46 427.14 430.47 943.79 -------------------------------------------------------------------------------- K point 792 = 0.015625 0.765625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.18 251.90 366.51 426.38 428.13 962.05 -------------------------------------------------------------------------------- K point 793 = 0.015625 0.765625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.14 237.53 348.21 424.99 425.03 978.39 -------------------------------------------------------------------------------- K point 794 = 0.015625 0.765625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.15 226.93 332.83 420.74 422.66 992.95 -------------------------------------------------------------------------------- K point 795 = 0.015625 0.765625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.60 217.72 322.26 415.06 419.16 1005.78 -------------------------------------------------------------------------------- K point 796 = 0.015625 0.765625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.91 208.26 318.28 407.89 414.63 1016.75 -------------------------------------------------------------------------------- K point 797 = 0.015625 0.765625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.61 198.30 321.33 399.72 409.39 1025.47 -------------------------------------------------------------------------------- K point 798 = 0.015625 0.765625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 181.30 189.47 330.17 391.89 403.70 1031.26 -------------------------------------------------------------------------------- K point 799 = 0.015625 0.765625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 176.28 183.85 342.90 386.16 397.79 1033.43 -------------------------------------------------------------------------------- K point 800 = 0.015625 0.765625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 176.74 182.34 357.78 383.96 391.94 1031.39 -------------------------------------------------------------------------------- K point 801 = 0.015625 0.796875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 162.75 165.39 326.59 387.59 391.50 1046.57 -------------------------------------------------------------------------------- K point 802 = 0.015625 0.796875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 169.96 181.66 342.53 383.26 396.78 1036.60 -------------------------------------------------------------------------------- K point 803 = 0.015625 0.796875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 179.80 205.85 358.21 378.29 405.64 1022.65 -------------------------------------------------------------------------------- K point 804 = 0.015625 0.796875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 192.26 235.19 372.68 374.13 415.97 1005.20 -------------------------------------------------------------------------------- K point 805 = 0.015625 0.796875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 206.58 267.60 369.32 387.65 426.61 984.67 -------------------------------------------------------------------------------- K point 806 = 0.015625 0.796875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 221.98 300.89 365.74 402.00 436.81 961.43 -------------------------------------------------------------------------------- K point 807 = 0.015625 0.796875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.78 332.23 362.89 417.78 446.39 935.79 -------------------------------------------------------------------------------- K point 808 = 0.015625 0.796875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.35 357.87 360.94 436.18 456.77 908.04 -------------------------------------------------------------------------------- K point 809 = 0.015625 0.796875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.06 360.05 375.21 450.75 476.13 878.50 -------------------------------------------------------------------------------- K point 810 = 0.015625 0.796875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.27 360.50 385.23 456.98 507.35 847.57 -------------------------------------------------------------------------------- K point 811 = 0.015625 0.796875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.29 362.58 390.30 459.54 542.67 815.87 -------------------------------------------------------------------------------- K point 812 = 0.015625 0.796875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.54 366.54 392.02 459.84 577.94 784.53 -------------------------------------------------------------------------------- K point 813 = 0.015625 0.796875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.77 372.30 391.26 458.29 609.27 756.33 -------------------------------------------------------------------------------- K point 814 = 0.015625 0.796875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.18 379.31 388.46 455.18 628.50 738.95 -------------------------------------------------------------------------------- K point 815 = 0.015625 0.796875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.22 383.24 387.36 450.82 623.81 744.07 -------------------------------------------------------------------------------- K point 816 = 0.015625 0.796875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.31 376.69 394.68 445.62 599.84 767.09 -------------------------------------------------------------------------------- K point 817 = 0.015625 0.796875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.69 367.74 401.62 440.08 568.53 796.25 -------------------------------------------------------------------------------- K point 818 = 0.015625 0.796875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.51 356.25 407.70 434.76 535.24 826.47 -------------------------------------------------------------------------------- K point 819 = 0.015625 0.796875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.84 342.00 412.67 430.17 502.14 855.95 -------------------------------------------------------------------------------- K point 820 = 0.015625 0.796875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.71 325.02 416.31 426.55 470.44 883.92 -------------------------------------------------------------------------------- K point 821 = 0.015625 0.796875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.19 305.75 417.89 423.37 441.98 910.00 -------------------------------------------------------------------------------- K point 822 = 0.015625 0.796875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.38 285.07 405.99 420.92 427.95 933.99 -------------------------------------------------------------------------------- K point 823 = 0.015625 0.796875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.40 264.22 380.97 420.92 425.93 955.80 -------------------------------------------------------------------------------- K point 824 = 0.015625 0.796875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.51 244.52 356.08 421.00 424.63 975.43 -------------------------------------------------------------------------------- K point 825 = 0.015625 0.796875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.15 226.93 332.83 420.74 422.66 992.95 -------------------------------------------------------------------------------- K point 826 = 0.015625 0.796875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.22 211.48 312.18 419.62 419.72 1008.47 -------------------------------------------------------------------------------- K point 827 = 0.015625 0.796875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.97 199.92 295.69 415.40 417.47 1022.11 -------------------------------------------------------------------------------- K point 828 = 0.015625 0.796875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 183.56 189.33 285.42 409.59 414.12 1033.83 -------------------------------------------------------------------------------- K point 829 = 0.015625 0.796875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 171.43 178.99 282.82 402.44 409.90 1043.37 -------------------------------------------------------------------------------- K point 830 = 0.015625 0.796875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 161.39 169.89 287.48 395.12 405.11 1050.11 -------------------------------------------------------------------------------- K point 831 = 0.015625 0.796875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 155.19 163.80 297.61 389.52 399.98 1053.27 -------------------------------------------------------------------------------- K point 832 = 0.015625 0.796875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 155.39 161.82 311.20 387.38 394.77 1052.18 -------------------------------------------------------------------------------- K point 833 = 0.015625 0.828125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 140.76 143.87 279.45 390.67 394.19 1065.61 -------------------------------------------------------------------------------- K point 834 = 0.015625 0.828125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 148.37 161.20 296.41 386.72 399.05 1056.53 -------------------------------------------------------------------------------- K point 835 = 0.015625 0.828125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 158.93 186.37 314.30 382.02 406.85 1043.56 -------------------------------------------------------------------------------- K point 836 = 0.015625 0.828125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 172.38 215.92 332.75 377.44 415.41 1027.24 -------------------------------------------------------------------------------- K point 837 = 0.015625 0.828125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 187.80 247.35 351.97 373.13 423.72 1007.98 -------------------------------------------------------------------------------- K point 838 = 0.015625 0.828125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 204.37 278.08 369.13 372.88 431.29 986.10 -------------------------------------------------------------------------------- K point 839 = 0.015625 0.828125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 221.39 305.39 365.72 396.58 438.14 961.84 -------------------------------------------------------------------------------- K point 840 = 0.015625 0.828125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.24 327.13 362.86 422.50 446.16 935.44 -------------------------------------------------------------------------------- K point 841 = 0.015625 0.828125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.37 342.98 360.73 438.52 467.03 907.16 -------------------------------------------------------------------------------- K point 842 = 0.015625 0.828125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.22 353.92 359.55 442.75 501.02 877.34 -------------------------------------------------------------------------------- K point 843 = 0.015625 0.828125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.14 359.26 361.46 443.68 537.89 846.48 -------------------------------------------------------------------------------- K point 844 = 0.015625 0.828125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.44 360.95 365.71 442.81 574.45 815.47 -------------------------------------------------------------------------------- K point 845 = 0.015625 0.828125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.48 364.30 367.80 440.52 607.96 786.28 -------------------------------------------------------------------------------- K point 846 = 0.015625 0.828125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.08 366.44 370.73 437.11 632.98 763.97 -------------------------------------------------------------------------------- K point 847 = 0.015625 0.828125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.59 364.17 377.19 432.93 638.79 759.11 -------------------------------------------------------------------------------- K point 848 = 0.015625 0.828125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.58 359.39 384.37 428.40 621.67 775.37 -------------------------------------------------------------------------------- K point 849 = 0.015625 0.828125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.52 352.09 391.39 424.02 592.22 802.23 -------------------------------------------------------------------------------- K point 850 = 0.015625 0.828125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.69 342.12 397.75 420.27 558.14 832.09 -------------------------------------------------------------------------------- K point 851 = 0.015625 0.828125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.27 329.44 403.07 417.57 522.54 862.06 -------------------------------------------------------------------------------- K point 852 = 0.015625 0.828125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.33 314.16 406.92 416.22 486.89 890.95 -------------------------------------------------------------------------------- K point 853 = 0.015625 0.828125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.95 296.63 408.84 416.22 452.38 918.16 -------------------------------------------------------------------------------- K point 854 = 0.015625 0.828125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.22 277.39 406.20 415.23 424.30 943.40 -------------------------------------------------------------------------------- K point 855 = 0.015625 0.828125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.26 257.20 381.42 413.46 420.16 966.45 -------------------------------------------------------------------------------- K point 856 = 0.015625 0.828125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.27 236.99 351.19 414.19 419.95 987.25 -------------------------------------------------------------------------------- K point 857 = 0.015625 0.828125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.60 217.72 322.26 415.06 419.16 1005.78 -------------------------------------------------------------------------------- K point 858 = 0.015625 0.828125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.97 199.92 295.69 415.40 417.47 1022.11 -------------------------------------------------------------------------------- K point 859 = 0.015625 0.828125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 183.36 183.47 272.76 414.61 414.76 1036.35 -------------------------------------------------------------------------------- K point 860 = 0.015625 0.828125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 167.94 171.20 255.50 410.52 412.70 1048.59 -------------------------------------------------------------------------------- K point 861 = 0.015625 0.828125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 153.69 159.90 246.17 404.79 409.63 1058.72 -------------------------------------------------------------------------------- K point 862 = 0.015625 0.828125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 141.50 149.95 245.57 398.22 405.81 1066.28 -------------------------------------------------------------------------------- K point 863 = 0.015625 0.828125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 133.61 142.96 252.35 392.74 401.54 1070.41 -------------------------------------------------------------------------------- K point 864 = 0.015625 0.828125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 133.13 140.29 264.29 390.46 397.05 1070.31 -------------------------------------------------------------------------------- K point 865 = 0.015625 0.859375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 117.91 121.40 232.07 393.33 396.34 1081.88 -------------------------------------------------------------------------------- K point 866 = 0.015625 0.859375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 126.06 139.79 250.21 389.86 400.74 1073.75 -------------------------------------------------------------------------------- K point 867 = 0.015625 0.859375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 137.63 165.62 270.74 385.60 407.42 1061.88 -------------------------------------------------------------------------------- K point 868 = 0.015625 0.859375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.33 194.57 293.40 381.30 414.23 1046.82 -------------------------------------------------------------------------------- K point 869 = 0.015625 0.859375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 169.05 223.73 318.53 377.08 420.33 1028.94 -------------------------------------------------------------------------------- K point 870 = 0.015625 0.859375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 186.89 250.77 346.74 373.04 425.43 1008.49 -------------------------------------------------------------------------------- K point 871 = 0.015625 0.859375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 205.11 274.15 369.21 378.26 429.65 985.64 -------------------------------------------------------------------------------- K point 872 = 0.015625 0.859375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.15 293.42 365.76 410.66 434.94 960.57 -------------------------------------------------------------------------------- K point 873 = 0.015625 0.859375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.50 308.93 362.73 427.12 457.23 933.50 -------------------------------------------------------------------------------- K point 874 = 0.015625 0.859375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.70 321.20 360.26 428.92 494.19 904.71 -------------------------------------------------------------------------------- K point 875 = 0.015625 0.859375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.21 330.66 358.59 427.97 532.90 874.61 -------------------------------------------------------------------------------- K point 876 = 0.015625 0.859375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.39 337.62 358.14 425.62 570.96 843.95 -------------------------------------------------------------------------------- K point 877 = 0.015625 0.859375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.47 342.20 359.42 422.26 606.41 814.17 -------------------------------------------------------------------------------- K point 878 = 0.015625 0.859375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.82 344.47 362.80 418.20 635.45 788.85 -------------------------------------------------------------------------------- K point 879 = 0.015625 0.859375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.37 344.32 368.09 413.86 649.62 776.30 -------------------------------------------------------------------------------- K point 880 = 0.015625 0.859375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.67 341.53 374.55 409.76 640.60 784.82 -------------------------------------------------------------------------------- K point 881 = 0.015625 0.859375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.39 335.81 381.32 406.43 614.50 808.27 -------------------------------------------------------------------------------- K point 882 = 0.015625 0.859375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.04 327.06 387.65 404.31 580.82 837.23 -------------------------------------------------------------------------------- K point 883 = 0.015625 0.859375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.90 315.44 392.87 403.74 544.00 867.35 -------------------------------------------------------------------------------- K point 884 = 0.015625 0.859375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.15 301.25 396.36 405.04 505.94 896.87 -------------------------------------------------------------------------------- K point 885 = 0.015625 0.859375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.89 284.90 398.33 407.58 467.70 924.99 -------------------------------------------------------------------------------- K point 886 = 0.015625 0.859375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.20 266.85 399.26 409.80 430.80 951.27 -------------------------------------------------------------------------------- K point 887 = 0.015625 0.859375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.19 247.62 387.09 405.58 413.68 975.42 -------------------------------------------------------------------------------- K point 888 = 0.015625 0.859375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.00 227.86 352.91 406.03 414.33 997.28 -------------------------------------------------------------------------------- K point 889 = 0.015625 0.859375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.91 208.26 318.28 407.89 414.63 1016.75 -------------------------------------------------------------------------------- K point 890 = 0.015625 0.859375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 183.56 189.33 285.42 409.59 414.12 1033.83 -------------------------------------------------------------------------------- K point 891 = 0.015625 0.859375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 167.94 171.20 255.50 410.52 412.70 1048.59 -------------------------------------------------------------------------------- K point 892 = 0.015625 0.859375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 153.80 153.86 230.36 410.10 410.30 1061.15 -------------------------------------------------------------------------------- K point 893 = 0.015625 0.859375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 137.37 141.14 212.81 406.25 408.52 1071.60 -------------------------------------------------------------------------------- K point 894 = 0.015625 0.859375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 122.58 129.92 205.29 400.90 405.80 1079.71 -------------------------------------------------------------------------------- K point 895 = 0.015625 0.859375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 112.09 121.58 207.57 395.69 402.46 1084.72 -------------------------------------------------------------------------------- K point 896 = 0.015625 0.859375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 110.18 117.91 217.29 393.16 398.78 1085.62 -------------------------------------------------------------------------------- K point 897 = 0.015625 0.890625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 94.40 98.15 184.56 395.57 397.98 1095.25 -------------------------------------------------------------------------------- K point 898 = 0.015625 0.890625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 103.37 117.63 204.26 392.68 401.81 1088.15 -------------------------------------------------------------------------------- K point 899 = 0.015625 0.890625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 116.37 143.67 228.35 388.98 407.16 1077.49 -------------------------------------------------------------------------------- K point 900 = 0.015625 0.890625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 132.69 171.03 256.45 385.10 412.04 1063.82 -------------------------------------------------------------------------------- K point 901 = 0.015625 0.890625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 150.96 197.12 288.36 381.15 415.89 1047.40 -------------------------------------------------------------------------------- K point 902 = 0.015625 0.890625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 170.17 220.76 323.62 377.20 418.64 1028.40 -------------------------------------------------------------------------------- K point 903 = 0.015625 0.890625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.61 241.67 361.26 373.32 420.47 1006.92 -------------------------------------------------------------------------------- K point 904 = 0.015625 0.890625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 208.74 259.98 369.48 399.01 422.92 983.11 -------------------------------------------------------------------------------- K point 905 = 0.015625 0.890625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.14 275.88 365.87 415.93 446.07 957.14 -------------------------------------------------------------------------------- K point 906 = 0.015625 0.890625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 244.42 289.55 362.51 415.53 485.83 929.28 -------------------------------------------------------------------------------- K point 907 = 0.015625 0.890625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.18 301.08 359.59 412.97 526.42 899.88 -------------------------------------------------------------------------------- K point 908 = 0.015625 0.890625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.89 310.51 357.41 409.33 566.07 869.56 -------------------------------------------------------------------------------- K point 909 = 0.015625 0.890625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.85 317.77 356.47 404.93 603.35 839.45 -------------------------------------------------------------------------------- K point 910 = 0.015625 0.890625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.22 322.72 357.43 400.13 635.52 812.16 -------------------------------------------------------------------------------- K point 911 = 0.015625 0.890625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.42 325.04 360.67 395.44 656.21 793.98 -------------------------------------------------------------------------------- K point 912 = 0.015625 0.890625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.59 324.32 365.79 391.53 655.69 794.60 -------------------------------------------------------------------------------- K point 913 = 0.015625 0.890625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.47 320.18 371.81 389.08 634.41 813.56 -------------------------------------------------------------------------------- K point 914 = 0.015625 0.890625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.81 312.52 377.59 388.64 602.22 841.03 -------------------------------------------------------------------------------- K point 915 = 0.015625 0.890625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.10 301.69 381.98 390.62 565.17 870.99 -------------------------------------------------------------------------------- K point 916 = 0.015625 0.890625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.60 288.21 384.87 394.49 525.83 900.95 -------------------------------------------------------------------------------- K point 917 = 0.015625 0.890625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.48 272.61 387.26 398.70 485.40 929.82 -------------------------------------------------------------------------------- K point 918 = 0.015625 0.890625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.83 255.34 389.57 402.36 444.78 957.00 -------------------------------------------------------------------------------- K point 919 = 0.015625 0.890625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.71 236.87 389.85 402.84 408.79 982.15 -------------------------------------------------------------------------------- K point 920 = 0.015625 0.890625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 207.23 217.70 360.58 397.27 408.14 1005.03 -------------------------------------------------------------------------------- K point 921 = 0.015625 0.890625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.61 198.30 321.33 399.72 409.39 1025.47 -------------------------------------------------------------------------------- K point 922 = 0.015625 0.890625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 171.43 178.99 282.82 402.44 409.90 1043.37 -------------------------------------------------------------------------------- K point 923 = 0.015625 0.890625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 153.69 159.90 246.17 404.79 409.63 1058.72 -------------------------------------------------------------------------------- K point 924 = 0.015625 0.890625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 137.37 141.14 212.81 406.25 408.52 1071.60 -------------------------------------------------------------------------------- K point 925 = 0.015625 0.890625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 122.78 123.06 185.45 406.24 406.47 1082.15 -------------------------------------------------------------------------------- K point 926 = 0.015625 0.890625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 105.58 110.17 168.33 402.75 405.04 1090.48 -------------------------------------------------------------------------------- K point 927 = 0.015625 0.890625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 91.48 100.03 163.94 398.25 402.76 1096.14 -------------------------------------------------------------------------------- K point 928 = 0.015625 0.890625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 86.82 94.92 170.39 395.48 399.96 1098.02 -------------------------------------------------------------------------------- K point 929 = 0.015625 0.921875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 70.49 74.31 137.06 397.40 399.12 1105.64 -------------------------------------------------------------------------------- K point 930 = 0.015625 0.921875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 80.79 94.97 159.09 395.15 402.24 1099.63 -------------------------------------------------------------------------------- K point 931 = 0.015625 0.921875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 95.90 120.48 188.27 392.11 405.95 1090.32 -------------------------------------------------------------------------------- K point 932 = 0.015625 0.921875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 114.31 145.48 223.00 388.79 408.73 1078.13 -------------------------------------------------------------------------------- K point 933 = 0.015625 0.921875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 134.36 168.85 261.56 385.27 410.42 1063.20 -------------------------------------------------------------------------------- K point 934 = 0.015625 0.921875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 155.01 190.53 302.47 381.59 411.10 1045.58 -------------------------------------------------------------------------------- K point 935 = 0.015625 0.921875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 175.61 210.58 344.63 377.80 410.94 1025.37 -------------------------------------------------------------------------------- K point 936 = 0.015625 0.921875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 195.72 229.02 373.85 386.61 410.84 1002.69 -------------------------------------------------------------------------------- K point 937 = 0.015625 0.921875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 214.98 245.84 369.96 405.12 433.43 977.72 -------------------------------------------------------------------------------- K point 938 = 0.015625 0.921875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.10 260.99 366.05 403.00 475.63 950.69 -------------------------------------------------------------------------------- K point 939 = 0.015625 0.921875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.77 274.42 362.28 399.29 517.93 921.92 -------------------------------------------------------------------------------- K point 940 = 0.015625 0.921875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.59 286.04 358.84 394.74 559.10 891.93 -------------------------------------------------------------------------------- K point 941 = 0.015625 0.921875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.02 295.71 356.13 389.60 598.08 861.65 -------------------------------------------------------------------------------- K point 942 = 0.015625 0.921875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.29 303.12 354.80 384.23 632.82 833.04 -------------------------------------------------------------------------------- K point 943 = 0.015625 0.921875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.50 307.80 355.61 379.20 658.60 810.80 -------------------------------------------------------------------------------- K point 944 = 0.015625 0.921875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.18 309.11 358.75 375.37 666.22 804.08 -------------------------------------------------------------------------------- K point 945 = 0.015625 0.921875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.78 306.51 363.38 373.73 651.13 817.46 -------------------------------------------------------------------------------- K point 946 = 0.015625 0.921875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.17 299.87 367.79 375.23 621.49 842.76 -------------------------------------------------------------------------------- K point 947 = 0.015625 0.921875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.10 289.73 371.03 379.64 585.06 872.24 -------------------------------------------------------------------------------- K point 948 = 0.015625 0.921875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.01 276.81 374.05 384.96 545.31 902.45 -------------------------------------------------------------------------------- K point 949 = 0.015625 0.921875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.13 261.76 377.24 390.05 503.75 931.92 -------------------------------------------------------------------------------- K point 950 = 0.015625 0.921875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.54 245.09 380.53 394.51 461.23 959.91 -------------------------------------------------------------------------------- K point 951 = 0.015625 0.921875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 218.30 227.24 383.58 398.06 418.67 985.98 -------------------------------------------------------------------------------- K point 952 = 0.015625 0.921875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 200.47 208.62 372.12 389.60 401.66 1009.83 -------------------------------------------------------------------------------- K point 953 = 0.015625 0.921875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 181.30 189.47 330.17 391.89 403.70 1031.26 -------------------------------------------------------------------------------- K point 954 = 0.015625 0.921875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 161.39 169.89 287.48 395.12 405.11 1050.11 -------------------------------------------------------------------------------- K point 955 = 0.015625 0.921875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 141.50 149.95 245.57 398.22 405.81 1066.28 -------------------------------------------------------------------------------- K point 956 = 0.015625 0.921875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 122.58 129.92 205.29 400.90 405.80 1079.71 -------------------------------------------------------------------------------- K point 957 = 0.015625 0.921875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 105.58 110.17 168.33 402.75 405.04 1090.48 -------------------------------------------------------------------------------- K point 958 = 0.015625 0.921875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 90.71 91.28 138.65 403.15 403.41 1098.77 -------------------------------------------------------------------------------- K point 959 = 0.015625 0.921875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 73.07 78.87 123.15 400.19 402.40 1104.69 -------------------------------------------------------------------------------- K point 960 = 0.015625 0.921875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 63.58 71.63 123.99 397.40 400.61 1107.42 -------------------------------------------------------------------------------- K point 961 = 0.015625 0.953125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 46.72 50.20 89.83 398.81 399.78 1112.97 -------------------------------------------------------------------------------- K point 962 = 0.015625 0.953125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 59.37 72.02 116.01 397.24 401.92 1108.16 -------------------------------------------------------------------------------- K point 963 = 0.015625 0.953125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 77.54 96.00 152.50 394.95 403.68 1100.34 -------------------------------------------------------------------------------- K point 964 = 0.015625 0.953125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 98.47 119.04 194.07 392.30 404.43 1089.64 -------------------------------------------------------------------------------- K point 965 = 0.015625 0.953125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 120.37 141.28 237.88 389.34 404.32 1076.08 -------------------------------------------------------------------------------- K point 966 = 0.015625 0.953125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 142.36 162.71 282.69 386.09 403.46 1059.71 -------------------------------------------------------------------------------- K point 967 = 0.015625 0.953125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 163.96 183.16 327.88 382.59 401.91 1040.62 -------------------------------------------------------------------------------- K point 968 = 0.015625 0.953125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 184.84 202.48 372.66 378.98 399.98 1018.93 -------------------------------------------------------------------------------- K point 969 = 0.015625 0.953125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 204.73 220.55 374.80 395.46 419.44 994.84 -------------------------------------------------------------------------------- K point 970 = 0.015625 0.953125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.43 237.23 370.64 392.18 463.57 968.55 -------------------------------------------------------------------------------- K point 971 = 0.015625 0.953125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.68 252.42 366.35 387.80 507.30 940.36 -------------------------------------------------------------------------------- K point 972 = 0.015625 0.953125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.21 265.99 362.08 382.76 549.79 910.74 -------------------------------------------------------------------------------- K point 973 = 0.015625 0.953125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.62 277.75 358.11 377.26 590.23 880.42 -------------------------------------------------------------------------------- K point 974 = 0.015625 0.953125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.32 287.34 354.95 371.62 627.10 850.93 -------------------------------------------------------------------------------- K point 975 = 0.015625 0.953125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.47 294.12 353.40 366.45 656.87 825.78 -------------------------------------------------------------------------------- K point 976 = 0.015625 0.953125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.16 297.26 354.13 362.75 671.79 812.72 -------------------------------------------------------------------------------- K point 977 = 0.015625 0.953125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.13 296.07 356.64 361.98 663.95 819.64 -------------------------------------------------------------------------------- K point 978 = 0.015625 0.953125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.10 290.43 359.22 365.26 638.00 841.91 -------------------------------------------------------------------------------- K point 979 = 0.015625 0.953125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.03 280.99 362.22 370.66 602.95 870.51 -------------------------------------------------------------------------------- K point 980 = 0.015625 0.953125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.57 268.67 365.91 376.41 563.48 900.76 -------------------------------------------------------------------------------- K point 981 = 0.015625 0.953125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.07 254.25 369.95 381.88 521.59 930.69 -------------------------------------------------------------------------------- K point 982 = 0.015625 0.953125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.64 238.27 374.05 386.82 478.21 959.36 -------------------------------------------------------------------------------- K point 983 = 0.015625 0.953125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.36 221.13 378.02 391.07 433.97 986.25 -------------------------------------------------------------------------------- K point 984 = 0.015625 0.953125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.46 202.98 380.58 389.46 395.53 1011.02 -------------------------------------------------------------------------------- K point 985 = 0.015625 0.953125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 176.28 183.85 342.90 386.16 397.79 1033.43 -------------------------------------------------------------------------------- K point 986 = 0.015625 0.953125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 155.19 163.80 297.61 389.52 399.98 1053.27 -------------------------------------------------------------------------------- K point 987 = 0.015625 0.953125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 133.61 142.96 252.35 392.74 401.54 1070.41 -------------------------------------------------------------------------------- K point 988 = 0.015625 0.953125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 112.09 121.58 207.57 395.69 402.46 1084.72 -------------------------------------------------------------------------------- K point 989 = 0.015625 0.953125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 91.48 100.03 163.94 398.25 402.76 1096.14 -------------------------------------------------------------------------------- K point 990 = 0.015625 0.953125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 73.07 78.87 123.15 400.19 402.40 1104.69 -------------------------------------------------------------------------------- K point 991 = 0.015625 0.953125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 57.85 58.89 90.80 400.96 401.23 1110.55 -------------------------------------------------------------------------------- K point 992 = 0.015625 0.953125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 41.71 48.61 79.31 398.90 400.67 1113.77 -------------------------------------------------------------------------------- K point 993 = 0.015625 0.984375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 25.01 26.72 43.99 399.77 399.98 1117.18 -------------------------------------------------------------------------------- K point 994 = 0.015625 0.984375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 41.71 48.61 79.31 398.90 400.67 1113.77 -------------------------------------------------------------------------------- K point 995 = 0.015625 0.984375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 63.58 71.63 123.99 397.40 400.61 1107.42 -------------------------------------------------------------------------------- K point 996 = 0.015625 0.984375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 86.82 94.92 170.39 395.48 399.96 1098.02 -------------------------------------------------------------------------------- K point 997 = 0.015625 0.984375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 110.18 117.91 217.29 393.16 398.78 1085.62 -------------------------------------------------------------------------------- K point 998 = 0.015625 0.984375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 133.13 140.29 264.29 390.46 397.05 1070.31 -------------------------------------------------------------------------------- K point 999 = 0.015625 0.984375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 155.39 161.82 311.20 387.38 394.77 1052.18 -------------------------------------------------------------------------------- K point *** = 0.015625 0.984375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 176.74 182.34 357.78 383.96 391.94 1031.39 -------------------------------------------------------------------------------- K point *** = 0.015625 0.984375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.00 201.69 379.99 388.24 404.41 1008.10 -------------------------------------------------------------------------------- K point *** = 0.015625 0.984375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.01 219.78 375.85 384.29 449.87 982.51 -------------------------------------------------------------------------------- K point *** = 0.015625 0.984375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.57 236.48 371.36 379.68 494.61 954.91 -------------------------------------------------------------------------------- K point *** = 0.015625 0.984375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.45 251.69 366.65 374.54 538.10 925.68 -------------------------------------------------------------------------------- K point *** = 0.015625 0.984375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.33 265.24 361.90 369.03 579.72 895.45 -------------------------------------------------------------------------------- K point *** = 0.015625 0.984375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.83 276.72 357.49 363.44 618.30 865.42 -------------------------------------------------------------------------------- K point *** = 0.015625 0.984375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.42 285.32 354.09 358.37 651.19 838.22 -------------------------------------------------------------------------------- K point *** = 0.015625 0.984375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.23 289.97 352.51 354.85 672.25 820.00 -------------------------------------------------------------------------------- K point *** = 0.015625 0.984375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.23 289.97 352.51 354.85 672.25 820.00 -------------------------------------------------------------------------------- K point *** = 0.015625 0.984375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.42 285.32 354.09 358.37 651.19 838.22 -------------------------------------------------------------------------------- K point *** = 0.015625 0.984375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.83 276.72 357.49 363.44 618.30 865.42 -------------------------------------------------------------------------------- K point *** = 0.015625 0.984375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.33 265.24 361.90 369.03 579.72 895.45 -------------------------------------------------------------------------------- K point *** = 0.015625 0.984375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.45 251.69 366.65 374.54 538.10 925.68 -------------------------------------------------------------------------------- K point *** = 0.015625 0.984375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.57 236.48 371.36 379.68 494.61 954.91 -------------------------------------------------------------------------------- K point *** = 0.015625 0.984375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.01 219.78 375.85 384.29 449.87 982.51 -------------------------------------------------------------------------------- K point *** = 0.015625 0.984375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.00 201.69 379.99 388.24 404.41 1008.10 -------------------------------------------------------------------------------- K point *** = 0.015625 0.984375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 176.74 182.34 357.78 383.96 391.94 1031.39 -------------------------------------------------------------------------------- K point *** = 0.015625 0.984375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 155.39 161.82 311.20 387.38 394.77 1052.18 -------------------------------------------------------------------------------- K point *** = 0.015625 0.984375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 133.13 140.29 264.29 390.46 397.05 1070.31 -------------------------------------------------------------------------------- K point *** = 0.015625 0.984375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 110.18 117.91 217.29 393.16 398.78 1085.62 -------------------------------------------------------------------------------- K point *** = 0.015625 0.984375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 86.82 94.92 170.39 395.48 399.96 1098.02 -------------------------------------------------------------------------------- K point *** = 0.015625 0.984375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 63.58 71.63 123.99 397.40 400.61 1107.42 -------------------------------------------------------------------------------- K point *** = 0.015625 0.984375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 41.71 48.61 79.31 398.90 400.67 1113.77 -------------------------------------------------------------------------------- K point *** = 0.015625 0.984375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 25.01 26.72 43.99 399.77 399.98 1117.18 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 29.55 35.35 59.44 399.04 400.17 1116.21 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 41.28 42.66 67.00 400.22 400.48 1114.53 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 56.95 63.44 100.85 399.35 401.41 1109.90 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 76.76 85.49 143.62 397.54 401.57 1102.47 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 98.61 107.91 188.74 395.25 401.09 1092.06 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 121.06 130.12 234.70 392.57 400.04 1078.69 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 143.37 151.74 280.95 389.57 398.40 1062.45 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 165.12 172.54 327.18 386.28 396.16 1043.45 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.99 192.32 372.66 383.14 393.40 1021.83 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 205.73 210.98 378.46 389.57 419.41 997.77 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.10 228.45 374.35 385.46 464.34 971.51 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.80 244.67 369.99 380.68 508.46 943.34 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.58 259.51 365.53 375.36 551.22 913.72 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.24 272.57 361.23 369.68 591.87 883.40 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.52 283.18 357.53 364.04 628.86 853.91 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.84 290.40 355.00 359.28 658.70 828.75 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.26 293.29 353.44 357.44 673.66 815.67 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.90 291.54 352.88 359.67 665.88 822.51 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.91 285.60 354.47 364.21 639.91 844.73 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.24 276.34 357.80 369.70 604.74 873.33 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.72 264.64 362.01 375.35 565.08 903.61 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 244.94 251.04 366.53 380.72 522.91 933.58 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.32 235.81 371.03 385.57 479.17 962.31 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.13 219.09 375.35 389.76 434.47 989.27 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 190.62 201.00 379.29 387.46 395.02 1014.11 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 169.96 181.66 342.53 383.26 396.78 1036.60 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 148.37 161.20 296.41 386.72 399.05 1056.53 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 126.06 139.79 250.21 389.86 400.74 1073.75 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 103.37 117.63 204.26 392.68 401.81 1088.15 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 80.79 94.97 159.09 395.15 402.24 1099.63 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 59.37 72.02 116.01 397.24 401.92 1108.16 -------------------------------------------------------------------------------- K point *** = 0.046875 0.015625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 41.71 48.61 79.31 398.90 400.67 1113.77 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 41.28 42.66 67.00 400.22 400.48 1114.53 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 37.73 37.73 72.03 399.29 399.29 1115.28 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 47.96 59.13 96.59 397.68 401.17 1111.72 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 66.61 83.20 133.60 395.69 402.68 1105.00 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 88.23 106.38 176.13 393.33 403.21 1095.37 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 110.72 128.94 220.79 390.62 402.93 1082.83 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 133.22 150.80 266.31 387.60 401.94 1067.42 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 155.28 171.78 312.14 384.26 400.30 1049.24 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 176.60 191.72 357.85 380.63 398.11 1028.42 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.95 210.44 376.72 393.44 405.13 1005.11 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.15 227.83 372.56 390.76 449.24 979.51 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.98 243.77 368.19 386.47 493.53 951.91 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.23 258.11 363.73 381.52 536.72 922.69 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.54 270.70 359.39 376.07 578.12 892.48 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.41 281.24 355.58 370.40 616.54 862.46 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.99 289.24 353.06 364.99 649.34 835.26 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.28 293.92 352.75 360.65 670.37 817.04 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.72 294.34 355.16 358.37 670.34 817.07 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.79 290.05 358.63 359.74 649.28 835.34 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.52 281.58 360.97 365.44 616.47 862.55 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.75 269.87 364.54 371.41 578.06 892.57 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.97 255.69 368.65 377.15 536.68 922.75 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.49 239.56 372.88 382.41 493.51 951.94 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 221.47 221.81 377.01 387.07 449.20 979.49 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 202.68 204.06 380.68 391.06 404.38 1005.02 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.39 185.37 357.77 385.41 394.38 1028.25 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 161.18 165.55 312.09 388.68 397.03 1048.99 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 139.32 144.77 266.11 391.90 399.04 1067.05 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 117.21 123.23 220.26 394.86 400.43 1082.31 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 95.48 101.27 174.93 397.49 401.23 1094.65 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 75.20 79.44 130.90 399.67 401.49 1104.04 -------------------------------------------------------------------------------- K point *** = 0.046875 0.046875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 57.85 58.89 90.80 400.96 401.23 1110.55 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 56.95 63.44 100.85 399.35 401.41 1109.90 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 47.96 59.13 96.59 397.68 401.17 1111.72 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 60.02 64.44 109.82 398.98 400.52 1109.20 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 73.45 86.15 136.51 397.51 402.91 1103.15 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 90.72 109.77 172.11 394.99 404.91 1094.24 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 110.67 132.49 212.50 392.07 405.88 1082.51 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 131.75 154.34 255.23 388.87 405.95 1067.97 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 153.07 175.27 299.10 385.44 405.23 1050.66 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 174.05 195.16 343.39 381.84 403.82 1030.69 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.33 213.87 377.51 387.34 402.68 1008.20 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.58 231.29 373.85 397.39 433.70 983.36 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.55 247.32 369.80 393.90 477.33 956.43 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.95 261.87 365.71 389.46 520.35 927.73 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.45 274.78 361.78 384.38 562.01 897.78 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.64 285.79 358.33 378.92 601.31 867.53 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.95 294.35 355.92 373.52 636.25 838.93 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.64 299.70 355.15 369.01 662.14 816.67 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.92 301.19 355.96 366.84 669.91 809.82 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.70 298.51 357.44 368.35 654.94 822.98 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.72 291.81 359.55 372.68 625.22 848.17 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.80 281.83 362.58 378.05 588.49 877.66 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.45 269.41 366.24 383.47 548.28 907.93 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.99 255.18 370.19 388.50 506.10 937.51 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.65 239.51 374.17 392.89 462.77 965.62 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.69 222.56 378.01 396.24 419.14 991.83 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 190.40 204.45 372.15 383.09 400.48 1015.83 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 170.10 185.26 328.58 386.01 402.45 1037.42 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 149.17 165.12 284.22 389.46 403.96 1056.41 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 128.09 144.21 240.36 392.73 404.79 1072.68 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 107.57 122.74 197.69 395.72 404.88 1086.15 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 88.72 100.91 157.56 398.29 404.13 1096.79 -------------------------------------------------------------------------------- K point *** = 0.046875 0.078125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 73.07 78.87 123.15 400.19 402.40 1104.69 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 76.76 85.49 143.62 397.54 401.57 1102.47 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 66.61 83.20 133.60 395.69 402.68 1105.00 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 73.45 86.15 136.51 397.51 402.91 1103.15 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 91.11 94.73 152.49 400.74 402.68 1097.59 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 104.44 115.96 178.83 399.49 405.58 1089.15 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 120.14 138.70 212.17 396.79 408.04 1078.08 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 138.28 160.68 249.76 393.61 409.44 1064.34 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 157.67 181.72 289.82 390.16 409.87 1047.92 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 177.41 201.74 331.22 386.61 409.46 1028.86 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.84 220.63 372.28 383.80 408.56 1007.27 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.45 238.32 378.65 403.22 419.61 983.28 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.85 254.73 375.13 401.78 460.61 957.11 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.71 269.74 371.58 398.20 502.69 929.05 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.73 283.19 368.20 393.86 543.98 899.53 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.64 294.75 365.18 389.11 583.56 869.29 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.10 303.86 362.78 384.47 619.88 839.79 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.64 309.84 361.07 380.90 649.45 814.50 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.60 312.26 359.77 379.77 664.45 801.21 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.40 311.10 358.82 381.67 656.70 808.08 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.09 306.53 358.95 385.68 630.91 830.42 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.24 298.94 360.49 390.54 596.28 859.06 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.52 288.87 363.12 395.41 557.52 889.31 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.47 276.80 366.39 399.81 516.65 919.23 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.51 263.00 369.97 403.44 474.73 947.92 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 219.02 247.59 373.68 405.54 433.02 974.86 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 200.33 230.63 377.02 387.31 411.10 999.72 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 180.79 212.18 345.22 381.58 411.26 1022.28 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 160.83 192.27 303.84 385.26 411.44 1042.36 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 140.99 170.92 263.72 388.91 410.78 1059.85 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 122.05 148.14 225.98 392.42 409.12 1074.67 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 105.13 124.09 192.09 395.64 406.37 1086.79 -------------------------------------------------------------------------------- K point *** = 0.046875 0.109375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 91.48 100.03 163.94 398.25 402.76 1096.14 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 98.61 107.91 188.74 395.25 401.09 1092.06 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 88.23 106.38 176.13 393.33 403.21 1095.37 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 90.72 109.77 172.11 394.99 404.91 1094.24 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 104.44 115.96 178.83 399.49 405.58 1089.15 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 123.33 125.40 195.98 403.79 405.70 1081.01 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 135.98 146.19 221.16 402.81 409.08 1070.34 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 150.65 168.07 251.90 400.26 411.97 1057.21 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 167.42 189.39 286.34 397.17 413.76 1041.59 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.26 209.85 323.20 393.89 414.56 1023.42 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 203.28 229.29 361.27 390.83 414.60 1002.76 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 220.76 247.62 385.59 400.62 415.82 979.70 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.17 264.71 383.26 409.36 444.66 954.40 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.13 280.42 380.35 407.20 484.57 927.09 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.36 294.53 377.56 404.03 524.67 898.13 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.67 306.68 374.91 400.53 563.83 868.10 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.86 316.41 372.32 397.37 600.76 838.11 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.65 323.20 369.56 395.47 632.88 810.63 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.59 326.77 366.45 395.68 654.06 791.75 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.06 327.26 363.36 398.03 654.42 791.33 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.62 324.94 361.20 401.76 633.63 809.68 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.35 319.97 360.63 405.98 601.52 837.04 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.78 312.51 361.61 410.03 564.43 867.14 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.59 302.80 363.70 413.47 525.07 897.41 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.37 290.99 366.48 415.90 484.87 926.72 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 230.59 277.07 369.69 416.24 445.59 954.47 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.68 260.99 373.14 399.27 423.07 980.31 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.04 242.61 361.75 377.22 420.70 1003.98 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 175.16 221.78 324.86 380.93 418.91 1025.32 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 156.63 198.45 290.21 384.85 416.21 1044.18 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 139.27 172.95 258.79 388.77 412.39 1060.46 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 124.11 146.44 231.13 392.54 407.56 1074.04 -------------------------------------------------------------------------------- K point *** = 0.046875 0.140625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 112.09 121.58 207.57 395.69 402.46 1084.72 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 121.06 130.12 234.70 392.57 400.04 1078.69 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 110.72 128.94 220.79 390.62 402.93 1082.83 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 110.67 132.49 212.50 392.07 405.88 1082.51 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 120.14 138.70 212.17 396.79 408.04 1078.08 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 135.98 146.19 221.16 402.81 409.08 1070.34 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 154.95 155.49 238.57 407.78 409.49 1059.99 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 166.71 175.86 262.19 407.09 413.30 1047.32 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 180.63 196.89 290.15 404.89 416.56 1032.35 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.26 217.70 321.19 402.22 418.73 1015.03 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.57 237.92 354.37 399.52 419.97 995.31 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.68 257.26 387.16 398.47 420.90 973.22 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.91 275.45 392.85 414.91 432.18 948.88 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.80 292.22 390.75 415.85 467.22 922.44 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.10 307.25 388.52 414.32 504.99 894.18 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.63 320.21 386.12 412.58 542.83 864.56 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.27 330.74 383.23 411.45 579.54 834.38 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.86 338.53 379.57 411.60 613.15 805.39 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.13 343.44 375.18 413.28 639.17 781.99 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.63 345.65 370.57 416.18 648.00 773.69 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.83 345.52 366.46 419.71 633.62 786.51 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.38 343.25 363.57 423.24 604.57 811.97 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.43 338.69 362.34 426.26 569.28 841.76 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.55 331.63 362.70 428.38 531.49 872.38 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.41 321.96 364.23 429.20 493.17 902.38 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.60 309.47 366.58 427.33 456.70 931.06 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.64 293.78 369.51 410.86 434.97 957.99 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.01 274.42 372.65 379.18 429.80 982.90 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 191.25 251.18 347.81 376.79 425.64 1005.58 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 174.00 224.56 319.96 380.80 420.60 1025.87 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 158.05 196.06 295.07 384.99 414.55 1043.59 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 144.34 167.87 272.60 389.17 407.81 1058.55 -------------------------------------------------------------------------------- K point *** = 0.046875 0.171875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 133.61 142.96 252.35 392.74 401.54 1070.41 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 143.37 151.74 280.95 389.57 398.40 1062.45 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 133.22 150.80 266.31 387.60 401.94 1067.42 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 131.75 154.34 255.23 388.87 405.95 1067.97 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 138.28 160.68 249.76 393.61 409.44 1064.34 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 150.65 168.07 251.90 400.26 411.97 1057.21 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 166.71 175.86 262.19 407.09 413.30 1047.32 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 184.48 185.33 279.24 412.55 413.90 1035.13 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.03 204.39 301.04 412.12 418.11 1020.78 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.30 224.51 326.10 410.41 421.69 1004.26 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.79 244.96 353.54 408.38 424.24 985.51 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.45 265.27 382.49 406.65 426.11 964.48 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.45 284.90 402.16 413.83 429.63 941.20 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.26 303.21 401.55 423.23 452.52 915.78 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.58 319.67 399.87 424.00 486.23 888.40 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.25 333.86 397.66 424.40 521.57 859.39 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.18 345.52 394.53 425.56 557.03 829.32 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.29 354.53 390.29 427.83 591.06 799.41 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.43 360.93 385.16 431.05 620.46 772.57 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.34 364.78 379.74 434.71 637.41 756.50 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.63 366.01 374.98 438.28 631.29 761.74 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.84 364.81 371.55 441.25 606.15 784.28 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.74 362.75 368.36 443.24 572.74 813.54 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.55 360.33 364.76 443.93 536.44 844.51 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.84 353.96 363.64 442.89 499.95 875.28 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.26 342.90 364.62 438.62 466.46 904.96 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.42 326.88 366.65 422.69 446.06 933.08 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.89 305.13 369.43 397.17 438.20 959.30 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 208.26 278.13 371.96 374.58 431.43 983.37 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 192.19 247.97 352.83 376.92 423.94 1005.06 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 177.44 217.23 333.70 381.19 415.70 1024.15 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 164.88 188.32 315.33 385.63 407.23 1040.35 -------------------------------------------------------------------------------- K point *** = 0.046875 0.203125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 155.19 163.80 297.61 389.52 399.98 1053.27 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 165.12 172.54 327.18 386.28 396.16 1043.45 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 155.28 171.78 312.14 384.26 400.30 1049.24 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 153.07 175.27 299.10 385.44 405.23 1050.66 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 157.67 181.72 289.82 390.16 409.87 1047.92 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 167.42 189.39 286.34 397.17 413.76 1041.59 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 180.63 196.89 290.15 404.89 416.56 1032.35 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.03 204.39 301.04 412.12 418.11 1020.78 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.97 214.08 317.28 417.91 418.81 1007.15 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.56 231.33 337.05 417.72 423.36 991.51 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.15 250.45 359.12 416.58 427.21 973.82 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.38 270.62 382.79 415.36 430.20 953.98 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.21 291.26 406.35 415.36 433.20 931.95 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.98 311.37 411.83 427.78 443.47 907.76 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.35 329.86 410.78 432.23 470.17 881.50 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.15 345.96 408.80 434.93 501.41 853.38 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.31 359.31 405.63 438.33 534.34 823.78 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.79 369.92 401.18 442.60 567.58 793.49 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.52 378.00 395.72 447.32 598.86 764.32 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.40 383.12 390.33 451.91 622.73 741.43 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.20 380.84 390.20 455.82 627.03 736.75 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.58 375.03 392.14 458.62 607.50 754.53 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.18 369.92 392.46 459.95 576.20 782.85 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.86 366.31 390.39 459.53 541.15 814.16 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.89 364.36 385.02 456.92 506.21 845.76 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.83 363.92 374.72 450.71 475.49 876.54 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.31 357.19 364.78 436.28 456.54 905.90 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.98 331.73 366.67 418.10 446.33 933.44 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.48 300.88 369.46 402.41 436.87 958.87 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.49 268.22 372.92 388.18 426.77 981.91 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.77 236.48 372.70 378.23 416.23 1002.24 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.14 207.67 358.40 382.11 406.02 1019.55 -------------------------------------------------------------------------------- K point *** = 0.046875 0.234375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 176.28 183.85 342.90 386.16 397.79 1033.43 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.99 192.32 372.66 383.14 393.40 1021.83 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 176.60 191.72 357.85 380.63 398.11 1028.42 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 174.05 195.16 343.39 381.84 403.82 1030.69 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 177.41 201.74 331.22 386.61 409.46 1028.86 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.26 209.85 323.20 393.89 414.56 1023.42 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.26 217.70 321.19 402.22 418.73 1015.03 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.30 224.51 326.10 410.41 421.69 1004.26 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.56 231.33 337.05 417.72 423.36 991.51 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.58 240.85 352.16 423.73 424.06 976.92 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.96 256.27 369.75 423.70 428.90 960.46 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.79 274.26 388.77 423.21 432.95 942.03 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.57 294.19 408.47 422.92 436.55 921.52 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.42 315.23 421.01 429.07 441.98 898.86 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.92 335.87 420.78 438.39 458.94 874.07 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.91 354.59 419.16 443.33 484.23 847.24 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.31 370.44 416.19 448.64 512.97 818.59 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.10 383.30 411.84 454.53 543.94 788.58 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.28 393.45 406.32 460.47 575.53 758.22 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.84 398.34 402.94 465.85 604.32 730.34 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.70 391.79 408.50 470.19 620.64 714.17 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.70 384.39 412.92 473.14 610.44 723.54 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.54 377.42 415.31 474.43 582.14 750.11 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.96 371.58 415.05 473.79 548.38 781.73 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.89 367.34 410.91 470.76 514.81 814.23 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.59 364.88 400.41 463.96 486.67 846.15 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.62 364.06 380.48 451.49 469.77 876.76 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.63 351.76 364.73 438.57 458.95 905.60 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.30 318.86 366.62 427.67 448.14 932.31 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.35 285.45 369.59 417.56 436.07 956.55 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.54 253.86 373.39 407.66 422.67 978.00 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 204.66 225.83 377.64 398.16 408.39 996.29 -------------------------------------------------------------------------------- K point *** = 0.046875 0.265625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.46 202.98 380.58 389.46 395.53 1011.02 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 205.73 210.98 378.46 389.57 419.41 997.77 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.95 210.44 376.72 393.44 405.13 1005.11 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.33 213.87 377.51 387.34 402.68 1008.20 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.84 220.63 372.28 383.80 408.56 1007.27 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 203.28 229.29 361.27 390.83 414.60 1002.76 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.57 237.92 354.37 399.52 419.97 995.31 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.79 244.96 353.54 408.38 424.24 985.51 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.15 250.45 359.12 416.58 427.21 973.82 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.96 256.27 369.75 423.70 428.90 960.46 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.99 265.32 383.48 429.48 429.82 945.46 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.91 278.87 398.78 429.89 434.57 928.71 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.87 295.58 414.70 430.11 438.77 910.04 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.02 315.23 428.67 432.20 443.35 889.32 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.80 336.62 429.64 442.91 453.44 866.47 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.06 357.78 428.53 449.46 471.95 841.46 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.75 376.85 425.98 456.02 494.87 814.38 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.87 392.87 421.97 462.85 521.80 785.46 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.46 405.88 416.61 469.27 551.90 755.18 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.56 409.90 416.57 474.77 583.09 724.77 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.19 402.46 424.84 479.05 610.16 698.63 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.34 394.40 430.90 482.00 616.25 693.13 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.88 386.26 434.24 483.55 593.79 715.78 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.60 378.67 434.04 483.48 562.31 747.66 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.28 372.26 428.87 480.98 531.34 781.14 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.89 367.55 416.40 473.86 507.36 814.22 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.70 364.71 394.60 461.29 494.16 846.03 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.24 363.21 365.76 447.83 486.19 876.07 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.19 332.55 364.45 435.08 478.61 903.92 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.30 299.92 366.53 422.63 469.86 929.23 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.33 269.42 369.82 410.54 459.50 951.63 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.08 242.69 373.96 399.48 447.48 970.76 -------------------------------------------------------------------------------- K point *** = 0.046875 0.296875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.36 221.13 378.02 391.07 433.97 986.25 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.10 228.45 374.35 385.46 464.34 971.51 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.15 227.83 372.56 390.76 449.24 979.51 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.58 231.29 373.85 397.39 433.70 983.36 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.45 238.32 378.65 403.22 419.61 983.28 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 220.76 247.62 385.59 400.62 415.82 979.70 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.68 257.26 387.16 398.47 420.90 973.22 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.45 265.27 382.49 406.65 426.11 964.48 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.38 270.62 382.79 415.36 430.20 953.98 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.79 274.26 388.77 423.21 432.95 942.03 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.91 278.87 398.78 429.89 434.57 928.71 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.90 287.18 410.95 434.90 436.01 913.92 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.12 298.81 423.88 436.08 440.20 897.46 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.10 314.09 435.75 437.96 444.49 879.12 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.46 333.38 437.21 447.43 451.88 858.73 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.14 354.96 436.75 453.96 465.26 836.17 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.22 376.62 434.81 461.04 481.82 811.41 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.74 396.35 431.34 467.96 503.09 784.52 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.74 413.14 426.42 473.77 529.69 755.70 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.33 420.16 427.01 478.16 560.42 725.40 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.58 412.80 437.99 481.22 592.88 694.83 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.58 404.57 445.70 483.40 619.93 670.27 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.34 395.82 449.04 485.20 612.71 680.42 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.80 387.07 446.94 486.44 584.68 712.54 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.81 378.92 438.77 485.18 557.49 747.15 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.18 372.03 423.81 478.39 537.65 781.35 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.88 366.94 401.61 465.83 526.80 814.23 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.18 363.72 373.83 451.10 520.69 845.28 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.62 342.62 363.18 436.28 515.33 874.08 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.89 311.89 363.98 421.83 508.87 900.25 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.78 283.16 366.43 408.11 500.63 923.42 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.09 258.17 370.12 395.90 490.40 943.23 -------------------------------------------------------------------------------- K point *** = 0.046875 0.328125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.64 238.27 374.05 386.82 478.21 959.36 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.80 244.67 369.99 380.68 508.46 943.34 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.98 243.77 368.19 386.47 493.53 951.91 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.55 247.32 369.80 393.90 477.33 956.43 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.85 254.73 375.13 401.78 460.61 957.11 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.17 264.71 383.26 409.36 444.66 954.40 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.91 275.45 392.85 414.91 432.18 948.88 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.45 284.90 402.16 413.83 429.63 941.20 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.21 291.26 406.35 415.36 433.20 931.95 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.57 294.19 408.47 422.92 436.55 921.52 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.87 295.58 414.70 430.11 438.77 910.04 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.12 298.81 423.88 436.08 440.20 897.46 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.03 306.15 434.32 440.12 442.13 883.55 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.36 315.83 441.81 444.91 445.78 868.03 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.23 329.58 443.29 449.78 455.10 850.65 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.70 348.36 443.69 455.88 464.57 831.17 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.32 369.94 442.51 464.07 474.62 809.50 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.32 392.02 439.72 471.44 489.10 785.60 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.81 412.63 435.43 475.99 510.51 759.57 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.89 428.66 431.77 478.15 538.00 731.63 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.69 422.47 446.07 478.43 569.88 702.17 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.36 414.40 457.02 478.02 604.35 671.92 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.02 405.48 459.87 480.36 635.56 646.37 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.74 396.11 453.89 484.80 611.95 677.76 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.50 386.80 442.30 485.73 587.87 713.62 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.18 378.17 425.74 479.90 570.97 748.65 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.63 370.88 404.19 467.58 561.64 782.24 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.82 365.34 378.62 451.96 556.69 813.95 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.97 349.55 363.21 435.56 552.78 843.36 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.62 321.49 362.17 419.52 547.97 870.09 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.49 295.05 363.41 404.53 541.38 893.78 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.39 272.16 366.34 391.46 532.61 914.09 -------------------------------------------------------------------------------- K point *** = 0.046875 0.359375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.07 254.25 369.95 381.88 521.59 930.69 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.58 259.51 365.53 375.36 551.22 913.72 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.23 258.11 363.73 381.52 536.72 922.69 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.95 261.87 365.71 389.46 520.35 927.73 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.71 269.74 371.58 398.20 502.69 929.05 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.13 280.42 380.35 407.20 484.57 927.09 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.80 292.22 390.75 415.85 467.22 922.44 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.26 303.21 401.55 423.23 452.52 915.78 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.98 311.37 411.83 427.78 443.47 907.76 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.42 315.23 421.01 429.07 441.98 898.86 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.02 315.23 428.67 432.20 443.35 889.32 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.10 314.09 435.75 437.96 444.49 879.12 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.36 315.83 441.81 444.91 445.78 868.03 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.19 322.02 444.93 447.67 453.74 855.72 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.44 329.74 447.27 450.49 461.92 841.81 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.10 341.87 449.11 454.63 469.10 826.02 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.65 359.97 448.90 462.39 475.04 808.13 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.27 381.27 446.88 472.96 480.90 788.07 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.32 403.49 443.28 478.50 494.90 765.89 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.94 424.56 438.40 478.90 517.28 741.83 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.29 431.01 444.57 476.64 544.89 716.34 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.56 423.49 460.69 471.88 576.01 690.33 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.92 414.72 464.47 473.71 608.09 665.92 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.54 405.17 454.26 482.25 627.05 657.65 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.54 395.25 440.90 484.61 614.19 685.62 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.95 385.46 424.11 479.36 601.65 719.06 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.68 376.40 403.84 467.25 594.63 752.05 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.59 368.49 380.82 451.10 591.23 783.52 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.60 353.69 364.93 433.58 588.82 812.88 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.90 328.74 361.49 416.29 585.62 839.66 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.00 304.94 361.05 400.26 580.61 863.46 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.64 284.44 362.85 386.45 573.29 883.93 -------------------------------------------------------------------------------- K point *** = 0.046875 0.390625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.57 268.67 365.91 376.41 563.48 900.76 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.24 272.57 361.23 369.68 591.87 883.40 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.54 270.70 359.39 376.07 578.12 892.48 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.45 274.78 361.78 384.38 562.01 897.78 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.73 283.19 368.20 393.86 543.98 899.53 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.36 294.53 377.56 404.03 524.67 898.13 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.10 307.25 388.52 414.32 504.99 894.18 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.58 319.67 399.87 424.00 486.23 888.40 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.35 329.86 410.78 432.23 470.17 881.50 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.92 335.87 420.78 438.39 458.94 874.07 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.80 336.62 429.64 442.91 453.44 866.47 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.46 333.38 437.21 447.43 451.88 858.73 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.23 329.58 443.29 449.78 455.10 850.65 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.44 329.74 447.27 450.49 461.92 841.81 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.23 334.64 449.11 452.77 468.75 831.78 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.27 340.43 451.72 454.74 474.67 820.15 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.60 350.91 453.72 458.63 479.22 806.61 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.23 368.11 452.64 467.52 482.15 791.03 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.96 388.69 449.77 479.71 484.22 773.45 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.20 410.29 445.38 481.63 499.07 754.13 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.13 430.12 440.06 479.04 520.99 733.64 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.97 431.39 448.01 475.48 546.56 713.06 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.93 423.15 454.33 475.58 573.77 694.45 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.25 413.76 447.95 480.78 598.74 682.09 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.13 403.66 435.67 482.44 614.36 683.97 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.73 393.26 419.91 477.12 618.55 702.73 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.12 382.98 401.34 465.16 619.20 729.38 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.24 372.69 381.30 448.85 619.96 757.68 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.92 355.66 368.18 430.68 620.45 785.22 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.06 333.57 362.37 412.52 619.63 810.86 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.75 312.54 359.78 395.66 616.71 833.93 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.47 294.58 359.99 381.23 611.23 853.93 -------------------------------------------------------------------------------- K point *** = 0.046875 0.421875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.03 280.99 362.22 370.66 602.95 870.51 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.52 283.18 357.53 364.04 628.86 853.91 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.41 281.24 355.58 370.40 616.54 862.46 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.64 285.79 358.33 378.92 601.31 867.53 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.64 294.75 365.18 389.11 583.56 869.29 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.67 306.68 374.91 400.53 563.83 868.10 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.63 320.21 386.12 412.58 542.83 864.56 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.25 333.86 397.66 424.40 521.57 859.39 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.15 345.96 408.80 434.93 501.41 853.38 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.91 354.59 419.16 443.33 484.23 847.24 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.06 357.78 428.53 449.46 471.95 841.46 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.14 354.96 436.75 453.96 465.26 836.17 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.70 348.36 443.69 455.88 464.57 831.17 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.10 341.87 449.11 454.63 469.10 826.02 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.27 340.43 451.72 454.74 474.67 820.15 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.08 343.92 452.41 456.84 479.65 813.02 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.77 347.84 454.99 457.99 483.38 804.25 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.66 356.66 456.80 461.46 485.55 793.61 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.45 372.67 454.77 470.66 486.01 781.08 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.40 391.94 451.05 483.49 484.88 766.92 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.97 411.70 445.81 482.14 500.03 751.69 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.40 428.25 439.44 479.09 519.69 736.41 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.93 430.22 438.72 477.87 541.87 722.67 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.82 421.47 436.87 479.39 565.19 712.72 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.35 411.54 427.44 479.18 587.60 709.22 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.76 400.90 413.64 473.38 606.97 714.13 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.26 389.58 397.40 461.62 622.14 727.16 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.94 375.05 382.67 445.53 633.24 745.80 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.76 355.87 372.51 427.26 640.83 766.98 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.54 335.98 364.92 408.69 645.13 788.43 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.07 317.46 360.03 391.33 646.15 808.65 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.38 301.91 358.17 376.44 643.78 826.69 -------------------------------------------------------------------------------- K point *** = 0.046875 0.453125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.10 290.43 359.22 365.26 638.00 841.91 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.84 290.40 355.00 359.28 658.70 828.75 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.99 289.24 353.06 364.99 649.34 835.26 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.95 294.35 355.92 373.52 636.25 838.93 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.10 303.86 362.78 384.47 619.88 839.79 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.86 316.41 372.32 397.37 600.76 838.11 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.27 330.74 383.23 411.45 579.54 834.38 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.18 345.52 394.53 425.56 557.03 829.32 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.31 359.31 405.63 438.33 534.34 823.78 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.31 370.44 416.19 448.64 512.97 818.59 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.75 376.85 425.98 456.02 494.87 814.38 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.22 376.62 434.81 461.04 481.82 811.41 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.32 369.94 442.51 464.07 474.62 809.50 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.65 359.97 448.90 462.39 475.04 808.13 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.60 350.91 453.72 458.63 479.22 806.61 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.77 347.84 454.99 457.99 483.38 804.25 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.71 349.83 454.63 459.61 486.50 800.52 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.94 351.96 456.86 459.92 488.16 795.09 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.26 359.12 458.14 462.76 488.23 787.87 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.29 373.58 455.21 471.31 486.78 779.05 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.59 390.85 450.62 482.03 484.85 769.11 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.64 407.53 444.53 480.49 497.28 758.91 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.74 419.26 437.05 478.01 514.09 749.64 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.16 422.24 428.30 476.86 533.82 742.78 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.21 416.64 418.54 474.70 555.98 739.69 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.20 404.71 408.66 468.35 579.18 741.18 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.43 389.49 398.17 456.98 601.75 747.12 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.12 372.24 387.58 441.56 622.20 756.66 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.40 354.00 377.50 423.80 639.37 768.67 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.23 335.94 368.61 405.49 652.45 781.97 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.40 319.38 361.69 388.20 660.97 795.52 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.67 305.74 357.52 373.31 664.78 808.35 -------------------------------------------------------------------------------- K point *** = 0.046875 0.484375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.13 296.07 356.64 361.98 663.95 819.64 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.26 293.29 353.44 357.44 673.66 815.67 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.28 293.92 352.75 360.65 670.37 817.04 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.64 299.70 355.15 369.01 662.14 816.67 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.64 309.84 361.07 380.90 649.45 814.50 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.65 323.20 369.56 395.47 632.88 810.63 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.86 338.53 379.57 411.60 613.15 805.39 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.29 354.53 390.29 427.83 591.06 799.41 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.79 369.92 401.18 442.60 567.58 793.49 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.10 383.30 411.84 454.53 543.94 788.58 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.87 392.87 421.97 462.85 521.80 785.46 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.74 396.35 431.34 467.96 503.09 784.52 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.32 392.02 439.72 471.44 489.10 785.60 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.27 381.27 446.88 472.96 480.90 788.07 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.23 368.11 452.64 467.52 482.15 791.03 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.66 356.66 456.80 461.46 485.55 793.61 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.94 351.96 456.86 459.92 488.16 795.09 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.11 352.36 455.62 460.84 489.41 795.02 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.77 352.78 457.25 460.32 489.11 793.23 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.39 358.30 457.69 462.32 487.34 789.79 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.76 370.84 453.91 469.38 484.48 785.10 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.52 385.49 448.52 476.66 482.92 779.82 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.21 398.29 441.67 475.49 492.14 774.87 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.14 404.94 433.54 472.63 506.82 771.29 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.65 403.30 424.34 468.97 525.73 770.03 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.09 394.76 414.38 462.36 547.99 771.55 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.81 381.79 403.90 451.69 571.77 775.71 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.14 366.30 393.17 437.43 595.37 781.80 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.34 349.68 382.55 420.89 617.45 788.89 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.54 333.19 372.58 403.66 636.95 796.09 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.71 318.11 363.95 387.33 652.97 802.72 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.67 305.74 357.52 373.31 664.78 808.35 -------------------------------------------------------------------------------- K point *** = 0.046875 0.515625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.16 297.26 354.13 362.75 671.79 812.72 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.90 291.54 352.88 359.67 665.88 822.51 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.72 294.34 355.16 358.37 670.34 817.07 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.92 301.19 355.96 366.84 669.91 809.82 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.60 312.26 359.77 379.77 664.45 801.21 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.59 326.77 366.45 395.68 654.06 791.75 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.13 343.44 375.18 413.28 639.17 781.99 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.43 360.93 385.16 431.05 620.46 772.57 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.52 378.00 395.72 447.32 598.86 764.32 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.28 393.45 406.32 460.47 575.53 758.22 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.46 405.88 416.61 469.27 551.90 755.18 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.74 413.14 426.42 473.77 529.69 755.70 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.81 412.63 435.43 475.99 510.51 759.57 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.32 403.49 443.28 478.50 494.90 765.89 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.96 388.69 449.77 479.71 484.22 773.45 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.45 372.67 454.77 470.66 486.01 781.08 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.26 359.12 458.14 462.76 488.23 787.87 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.77 352.78 457.25 460.32 489.11 793.23 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.31 351.52 455.29 460.43 488.44 796.87 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.27 350.31 456.11 459.14 486.25 798.78 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.06 354.20 455.47 460.22 482.85 799.24 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.86 364.48 450.96 465.17 479.01 798.76 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.20 376.07 444.87 468.72 478.14 798.03 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.66 384.78 437.43 466.53 485.71 797.86 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.60 386.97 428.83 462.29 499.19 798.96 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.42 381.92 419.26 455.90 517.63 801.72 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.50 371.48 408.94 446.35 539.47 806.05 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.24 357.84 398.08 433.73 562.72 811.41 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.99 342.69 387.00 419.03 585.81 816.98 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.03 327.44 376.13 403.67 607.58 821.86 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.50 313.43 366.17 389.09 627.14 825.28 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.38 301.91 358.17 376.44 643.78 826.69 -------------------------------------------------------------------------------- K point *** = 0.046875 0.546875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.47 294.12 353.40 366.45 656.87 825.78 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.91 285.60 354.47 364.21 639.91 844.73 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.79 290.05 358.63 359.74 649.28 835.34 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.70 298.51 357.44 368.35 654.94 822.98 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.40 311.10 358.82 381.67 656.70 808.08 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.06 327.26 363.36 398.03 654.42 791.33 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.63 345.65 370.57 416.18 648.00 773.69 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.34 364.78 379.74 434.71 637.41 756.50 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.40 383.12 390.33 451.91 622.73 741.43 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.84 398.34 402.94 465.85 604.32 730.34 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.56 409.90 416.57 474.77 583.09 724.77 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.33 420.16 427.01 478.16 560.42 725.40 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.89 428.66 431.77 478.15 538.00 731.63 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.94 424.56 438.40 478.90 517.28 741.83 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.20 410.29 445.38 481.63 499.07 754.13 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.40 391.94 451.05 483.49 484.88 766.92 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.29 373.58 455.21 471.31 486.78 779.05 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.39 358.30 457.69 462.32 487.34 789.79 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.27 350.31 456.11 459.14 486.25 798.78 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.30 347.30 453.67 458.40 483.57 805.94 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.43 344.55 453.52 456.51 479.52 811.41 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.28 346.80 451.59 456.76 474.64 815.58 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.59 354.60 446.47 459.27 470.22 819.00 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.63 362.89 439.80 459.12 470.32 822.28 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.02 367.60 431.85 455.27 477.26 826.01 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.18 366.05 422.77 449.59 489.94 830.54 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.54 358.45 412.71 441.53 507.61 835.87 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.56 346.76 401.87 430.92 528.41 841.61 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.64 332.97 390.50 418.46 550.42 847.08 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.16 318.72 379.09 405.31 572.21 851.47 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.39 305.47 368.50 392.63 592.73 853.96 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.47 294.58 359.99 381.23 611.23 853.93 -------------------------------------------------------------------------------- K point *** = 0.046875 0.578125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.32 287.34 354.95 371.62 627.10 850.93 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.24 276.34 357.80 369.70 604.74 873.33 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.52 281.58 360.97 365.44 616.47 862.55 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.72 291.81 359.55 372.68 625.22 848.17 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.09 306.53 358.95 385.68 630.91 830.42 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.62 324.94 361.20 401.76 633.63 809.68 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.83 345.52 366.46 419.71 633.62 786.51 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.63 366.01 374.98 438.28 631.29 761.74 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.20 380.84 390.20 455.82 627.03 736.75 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.70 391.79 408.50 470.19 620.64 714.17 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.19 402.46 424.84 479.05 610.16 698.63 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.58 412.80 437.99 481.22 592.88 694.83 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.69 422.47 446.07 478.43 569.88 702.17 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.29 431.01 444.57 476.64 544.89 716.34 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.13 430.12 440.06 479.04 520.99 733.64 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.97 411.70 445.81 482.14 500.03 751.69 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.59 390.85 450.62 482.03 484.85 769.11 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.76 370.84 453.91 469.38 484.48 785.10 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.06 354.20 455.47 460.22 482.85 799.24 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.43 344.55 453.52 456.51 479.52 811.41 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.06 339.70 450.88 454.94 474.71 821.68 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.27 335.49 449.63 452.72 468.80 830.33 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.08 336.13 446.32 452.30 462.58 837.76 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.99 341.28 440.60 452.15 458.21 844.48 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.86 346.20 433.36 448.61 459.55 850.96 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.35 347.18 424.83 443.81 465.84 857.54 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.96 342.51 415.14 437.50 477.66 864.28 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.15 333.01 404.47 429.07 494.30 870.94 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.42 320.66 393.12 418.90 513.77 876.96 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.19 307.36 381.68 407.85 534.25 881.62 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.85 294.78 371.14 396.81 554.40 884.16 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.64 284.44 362.85 386.45 573.29 883.93 -------------------------------------------------------------------------------- K point *** = 0.046875 0.609375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.62 277.75 358.11 377.26 590.23 880.42 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.72 264.64 362.01 375.35 565.08 903.61 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.75 269.87 364.54 371.41 578.06 892.57 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.80 281.83 362.58 378.05 588.49 877.66 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.24 298.94 360.49 390.54 596.28 859.06 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.35 319.97 360.63 405.98 601.52 837.04 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.38 343.25 363.57 423.24 604.57 811.97 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.84 364.81 371.55 441.25 606.15 784.28 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.58 375.03 392.14 458.62 607.50 754.53 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.70 384.39 412.92 473.14 610.44 723.54 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.34 394.40 430.90 482.00 616.25 693.13 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.58 404.57 445.70 483.40 619.93 670.27 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.36 414.40 457.02 478.02 604.35 671.92 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.56 423.49 460.69 471.88 576.01 690.33 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.97 431.39 448.01 475.48 546.56 713.06 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.40 428.25 439.44 479.09 519.69 736.41 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.64 407.53 444.53 480.49 497.28 758.91 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.52 385.49 448.52 476.66 482.92 779.82 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.86 364.48 450.96 465.17 479.01 798.76 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.28 346.80 451.59 456.76 474.64 815.58 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.27 335.49 449.63 452.72 468.80 830.33 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.61 328.74 447.11 450.33 461.75 843.18 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.80 323.18 444.67 448.08 454.02 854.44 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.57 322.23 440.01 446.30 447.49 864.49 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.12 324.69 433.47 440.32 447.11 873.74 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.98 326.28 425.56 436.50 447.41 882.49 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.79 323.91 416.41 433.16 451.37 890.87 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.11 316.73 406.18 427.52 461.78 898.72 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.45 306.03 395.21 419.65 477.19 905.61 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.32 293.79 384.17 410.48 495.25 910.94 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.18 281.92 374.11 400.87 514.14 913.98 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.39 272.16 366.34 391.46 532.61 914.09 -------------------------------------------------------------------------------- K point *** = 0.046875 0.640625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.21 265.99 362.08 382.76 549.79 910.74 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 244.94 251.04 366.53 380.72 522.91 933.58 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.97 255.69 368.65 377.15 536.68 922.75 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.45 269.41 366.24 383.47 548.28 907.93 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.52 288.87 363.12 395.41 557.52 889.31 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.78 312.51 361.61 410.03 564.43 867.14 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.43 338.69 362.34 426.26 569.28 841.76 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.74 362.75 368.36 443.24 572.74 813.54 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.18 369.92 392.46 459.95 576.20 782.85 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.54 377.42 415.31 474.43 582.14 750.11 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.88 386.26 434.24 483.55 593.79 715.78 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.34 395.82 449.04 485.20 612.71 680.42 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.02 405.48 459.87 480.36 635.56 646.37 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.92 414.72 464.47 473.71 608.09 665.92 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.93 423.15 454.33 475.58 573.77 694.45 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.93 430.22 438.72 477.87 541.87 722.67 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.74 419.26 437.05 478.01 514.09 749.64 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.21 398.29 441.67 475.49 492.14 774.87 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.20 376.07 444.87 468.72 478.14 798.03 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.59 354.60 446.47 459.27 470.22 819.00 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.08 336.13 446.32 452.30 462.58 837.76 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.80 323.18 444.67 448.08 454.02 854.44 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.00 314.48 442.59 444.00 445.52 869.23 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.12 307.70 434.84 439.16 442.94 882.43 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.86 305.20 426.14 433.64 441.65 894.36 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.15 305.05 419.70 426.95 439.88 905.31 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.15 303.53 415.20 421.35 437.30 915.40 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.52 298.33 407.11 421.58 435.91 924.59 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.84 289.41 397.05 419.17 442.53 932.55 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.69 278.40 386.71 412.47 456.35 938.74 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.60 267.35 377.29 404.34 473.01 942.52 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.09 258.17 370.12 395.90 490.40 943.23 -------------------------------------------------------------------------------- K point *** = 0.046875 0.671875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.68 252.42 366.35 387.80 507.30 940.36 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.32 235.81 371.03 385.57 479.17 962.31 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.49 239.56 372.88 382.41 493.51 951.94 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.99 255.18 370.19 388.50 506.10 937.51 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.47 276.80 366.39 399.81 516.65 919.23 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.59 302.80 363.70 413.47 525.07 897.41 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.55 331.63 362.70 428.38 531.49 872.38 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.55 360.33 364.76 443.93 536.44 844.51 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.86 366.31 390.39 459.53 541.15 814.16 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.96 371.58 415.05 473.79 548.38 781.73 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.60 378.67 434.04 483.48 562.31 747.66 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.80 387.07 446.94 486.44 584.68 712.54 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.74 396.11 453.89 484.80 611.95 677.76 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.54 405.17 454.26 482.25 627.05 657.65 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.25 413.76 447.95 480.78 598.74 682.09 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.82 421.47 436.87 479.39 565.19 712.72 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.16 422.24 428.30 476.86 533.82 742.78 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.14 404.94 433.54 472.63 506.82 771.29 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.66 384.78 437.43 466.53 485.71 797.86 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.63 362.89 439.80 459.12 470.32 822.28 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.99 341.28 440.60 452.15 458.21 844.48 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.57 322.23 440.01 446.30 447.49 864.49 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.12 307.70 434.84 439.16 442.94 882.43 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.33 297.04 423.16 437.55 439.09 898.50 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.37 289.19 411.84 432.99 437.40 912.94 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.17 285.25 402.22 426.64 435.86 925.98 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.30 282.69 396.11 419.08 433.33 937.79 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.63 278.48 395.10 410.74 429.51 948.36 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.82 271.17 396.23 405.21 424.79 957.46 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.51 261.48 389.04 409.35 422.60 964.64 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.37 251.31 380.54 406.39 432.29 969.28 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.08 242.69 373.96 399.48 447.48 970.76 -------------------------------------------------------------------------------- K point *** = 0.046875 0.703125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.43 237.23 370.64 392.18 463.57 968.55 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.13 219.09 375.35 389.76 434.47 989.27 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 221.47 221.81 377.01 387.07 449.20 979.49 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.65 239.51 374.17 392.89 462.77 965.62 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.51 263.00 369.97 403.44 474.73 947.92 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.37 290.99 366.48 415.90 484.87 926.72 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.41 321.96 364.23 429.20 493.17 902.38 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.84 353.96 363.64 442.89 499.95 875.28 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.89 364.36 385.02 456.92 506.21 845.76 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.89 367.34 410.91 470.76 514.81 814.23 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.28 372.26 428.87 480.98 531.34 781.14 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.81 378.92 438.77 485.18 557.49 747.15 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.50 386.80 442.30 485.73 587.87 713.62 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.54 395.25 440.90 484.61 614.19 685.62 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.13 403.66 435.67 482.44 614.36 683.97 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.35 411.54 427.44 479.18 587.60 709.22 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.21 416.64 418.54 474.70 555.98 739.69 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.65 403.30 424.34 468.97 525.73 770.03 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.60 386.97 428.83 462.29 499.19 798.96 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.02 367.60 431.85 455.27 477.26 826.01 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.86 346.20 433.36 448.61 459.55 850.96 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.12 324.69 433.47 440.32 447.11 873.74 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.86 305.20 426.14 433.64 441.65 894.36 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.37 289.19 411.84 432.99 437.40 912.94 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.78 276.59 397.71 432.20 432.92 929.62 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.76 267.88 384.75 426.78 431.73 944.60 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.77 262.64 374.39 419.85 430.06 958.02 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.86 258.02 368.58 411.79 427.17 969.93 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.74 251.73 368.86 402.92 422.94 980.17 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.13 243.27 375.00 394.07 417.57 988.37 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 208.80 233.97 381.68 389.88 411.63 993.95 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 204.66 225.83 377.64 398.16 408.39 996.29 -------------------------------------------------------------------------------- K point *** = 0.046875 0.734375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 204.73 220.55 374.80 395.46 419.44 994.84 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 190.62 201.00 379.29 387.46 395.02 1014.11 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 202.68 204.06 380.68 391.06 404.38 1005.02 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.69 222.56 378.01 396.24 419.14 991.83 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 219.02 247.59 373.68 405.54 433.02 974.86 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 230.59 277.07 369.69 416.24 445.59 954.47 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.60 309.47 366.58 427.33 456.70 931.06 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.26 342.90 364.62 438.62 466.46 904.96 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.83 363.92 374.72 450.71 475.49 876.54 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.59 364.88 400.41 463.96 486.67 846.15 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.89 367.55 416.40 473.86 507.36 814.22 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.18 372.03 423.81 478.39 537.65 781.35 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.18 378.17 425.74 479.90 570.97 748.65 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.95 385.46 424.11 479.36 601.65 719.06 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.73 393.26 419.91 477.12 618.55 702.73 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.76 400.90 413.64 473.38 606.97 714.13 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.20 404.71 408.66 468.35 579.18 741.18 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.09 394.76 414.38 462.36 547.99 771.55 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.42 381.92 419.26 455.90 517.63 801.72 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.18 366.05 422.77 449.59 489.94 830.54 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.35 347.18 424.83 443.81 465.84 857.54 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.98 326.28 425.56 436.50 447.41 882.49 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.15 305.05 419.70 426.95 439.88 905.31 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.17 285.25 402.22 426.64 435.86 925.98 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.76 267.88 384.75 426.78 431.73 944.60 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.58 253.39 368.29 426.75 426.76 961.28 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.55 244.07 353.84 420.67 426.10 976.15 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.98 237.72 343.01 413.42 424.41 989.27 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.23 231.50 337.71 405.19 421.42 1000.58 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.04 223.93 339.11 396.50 417.18 1009.76 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 190.30 215.42 346.59 388.36 411.91 1016.30 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.14 207.67 358.40 382.11 406.02 1019.55 -------------------------------------------------------------------------------- K point *** = 0.046875 0.765625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 184.84 202.48 372.66 378.98 399.98 1018.93 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 169.96 181.66 342.53 383.26 396.78 1036.60 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.39 185.37 357.77 385.41 394.38 1028.25 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 190.40 204.45 372.15 383.09 400.48 1015.83 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 200.33 230.63 377.02 387.31 411.10 999.72 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.68 260.99 373.14 399.27 423.07 980.31 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.64 293.78 369.51 410.86 434.97 957.99 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.42 326.88 366.65 422.69 446.06 933.08 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.31 357.19 364.78 436.28 456.54 905.90 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.62 364.06 380.48 451.49 469.77 876.76 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.70 364.71 394.60 461.29 494.16 846.03 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.88 366.94 401.61 465.83 526.80 814.23 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.63 370.88 404.19 467.58 561.64 782.24 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.68 376.40 403.84 467.25 594.63 752.05 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.12 382.98 401.34 465.16 619.20 729.38 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.26 389.58 397.40 461.62 622.14 727.16 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.43 389.49 398.17 456.98 601.75 747.12 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.81 381.79 403.90 451.69 571.77 775.71 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.50 371.48 408.94 446.35 539.47 806.05 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.54 358.45 412.71 441.53 507.61 835.87 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.96 342.51 415.14 437.50 477.66 864.28 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.79 323.91 416.41 433.16 451.37 890.87 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.15 303.53 415.20 421.35 437.30 915.40 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.30 282.69 396.11 419.08 433.33 937.79 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.77 262.64 374.39 419.85 430.06 958.02 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.55 244.07 353.84 420.67 426.10 976.15 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.03 227.73 335.14 420.78 421.40 992.26 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.04 218.08 319.43 414.86 420.69 1006.43 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 195.17 210.88 308.45 407.56 419.07 1018.66 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 181.95 203.64 304.03 399.54 416.17 1028.73 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 171.41 195.75 306.73 391.75 412.12 1036.18 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 164.88 188.32 315.33 385.63 407.23 1040.35 -------------------------------------------------------------------------------- K point *** = 0.046875 0.796875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 163.96 183.16 327.88 382.59 401.91 1040.62 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 148.37 161.20 296.41 386.72 399.05 1056.53 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 161.18 165.55 312.09 388.68 397.03 1048.99 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 170.10 185.26 328.58 386.01 402.45 1037.42 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 180.79 212.18 345.22 381.58 411.26 1022.28 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.04 242.61 361.75 377.22 420.70 1003.98 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.01 274.42 372.65 379.18 429.80 982.90 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.89 305.13 369.43 397.17 438.20 959.30 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.98 331.73 366.67 418.10 446.33 933.44 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.63 351.76 364.73 438.57 458.95 905.60 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.24 363.21 365.76 447.83 486.19 876.07 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.18 363.72 373.83 451.10 520.69 845.28 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.82 365.34 378.62 451.96 556.69 813.95 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.59 368.49 380.82 451.10 591.23 783.52 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.24 372.69 381.30 448.85 619.96 757.68 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.94 375.05 382.67 445.53 633.24 745.80 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.12 372.24 387.58 441.56 622.20 756.66 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.14 366.30 393.17 437.43 595.37 781.80 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.24 357.84 398.08 433.73 562.72 811.41 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.56 346.76 401.87 430.92 528.41 841.61 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.15 333.01 404.47 429.07 494.30 870.94 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.11 316.73 406.18 427.52 461.78 898.72 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.52 298.33 407.11 421.58 435.91 924.59 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.63 278.48 395.10 410.74 429.51 948.36 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.86 258.02 368.58 411.79 427.17 969.93 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.98 237.72 343.01 413.42 424.41 989.27 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.04 218.08 319.43 414.86 420.69 1006.43 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 198.44 199.93 298.63 415.17 416.30 1021.47 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 181.57 190.30 281.93 409.53 415.64 1034.44 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 165.77 182.59 271.27 402.45 414.19 1045.24 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.80 175.03 268.21 395.17 411.51 1053.49 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 144.34 167.87 272.60 389.17 407.81 1058.55 -------------------------------------------------------------------------------- K point *** = 0.046875 0.828125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 142.36 162.71 282.69 386.09 403.46 1059.71 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 126.06 139.79 250.21 389.86 400.74 1073.75 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 139.32 144.77 266.11 391.90 399.04 1067.05 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 149.17 165.12 284.22 389.46 403.96 1056.41 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 160.83 192.27 303.84 385.26 411.44 1042.36 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 175.16 221.78 324.86 380.93 418.91 1025.32 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 191.25 251.18 347.81 376.79 425.64 1005.58 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 208.26 278.13 371.96 374.58 431.43 983.37 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.48 300.88 369.46 402.41 436.87 958.87 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.30 318.86 366.62 427.67 448.14 932.31 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.19 332.55 364.45 435.08 478.61 903.92 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.62 342.62 363.18 436.28 515.33 874.08 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.97 349.55 363.21 435.56 552.78 843.36 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.60 353.69 364.93 433.58 588.82 812.88 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.92 355.66 368.18 430.68 620.45 785.22 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.76 355.87 372.51 427.26 640.83 766.98 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.40 354.00 377.50 423.80 639.37 768.67 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.34 349.68 382.55 420.89 617.45 788.89 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.99 342.69 387.00 419.03 585.81 816.98 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.64 332.97 390.50 418.46 550.42 847.08 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.42 320.66 393.12 418.90 513.77 876.96 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.45 306.03 395.21 419.65 477.19 905.61 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.84 289.41 397.05 419.17 442.53 932.55 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.82 271.17 396.23 405.21 424.79 957.46 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.74 251.73 368.86 402.92 422.94 980.17 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.23 231.50 337.71 405.19 421.42 1000.58 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 195.17 210.88 308.45 407.56 419.07 1018.66 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 181.57 190.30 281.93 409.53 415.64 1034.44 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 170.15 170.32 259.19 410.08 411.62 1048.00 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 151.49 161.14 241.90 404.85 411.10 1059.32 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 135.39 153.40 232.16 398.35 409.91 1068.19 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 124.11 146.44 231.13 392.54 407.56 1074.04 -------------------------------------------------------------------------------- K point *** = 0.046875 0.859375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 120.37 141.28 237.88 389.34 404.32 1076.08 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 103.37 117.63 204.26 392.68 401.81 1088.15 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 117.21 123.23 220.26 394.86 400.43 1082.31 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 128.09 144.21 240.36 392.73 404.79 1072.68 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 140.99 170.92 263.72 388.91 410.78 1059.85 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 156.63 198.45 290.21 384.85 416.21 1044.18 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 174.00 224.56 319.96 380.80 420.60 1025.87 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 192.19 247.97 352.83 376.92 423.94 1005.06 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.49 268.22 372.92 388.18 426.77 981.91 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.35 285.45 369.59 417.56 436.07 956.55 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.30 299.92 366.53 422.63 469.86 929.23 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.89 311.89 363.98 421.83 508.87 900.25 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.62 321.49 362.17 419.52 547.97 870.09 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.90 328.74 361.49 416.29 585.62 839.66 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.06 333.57 362.37 412.52 619.63 810.86 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.54 335.98 364.92 408.69 645.13 788.43 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.23 335.94 368.61 405.49 652.45 781.97 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.54 333.19 372.58 403.66 636.95 796.09 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.03 327.44 376.13 403.67 607.58 821.86 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.16 318.72 379.09 405.31 572.21 851.47 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.19 307.36 381.68 407.85 534.25 881.62 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.32 293.79 384.17 410.48 495.25 910.94 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.69 278.40 386.71 412.47 456.35 938.74 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.51 261.48 389.04 409.35 422.60 964.64 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.13 243.27 375.00 394.07 417.57 988.37 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.04 223.93 339.11 396.50 417.18 1009.76 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 181.95 203.64 304.03 399.54 416.17 1028.73 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 165.77 182.59 271.27 402.45 414.19 1045.24 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 151.49 161.14 241.90 404.85 411.10 1059.32 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 139.26 140.55 217.46 405.68 407.51 1071.02 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 120.26 131.09 200.09 401.01 407.23 1080.31 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 105.13 124.09 192.09 395.64 406.37 1086.79 -------------------------------------------------------------------------------- K point *** = 0.046875 0.890625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 98.47 119.04 194.07 392.30 404.43 1089.64 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 80.79 94.97 159.09 395.15 402.24 1099.63 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 95.48 101.27 174.93 397.49 401.23 1094.65 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 107.57 122.74 197.69 395.72 404.88 1086.15 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 122.05 148.14 225.98 392.42 409.12 1074.67 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 139.27 172.95 258.79 388.77 412.39 1060.46 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 158.05 196.06 295.07 384.99 414.55 1043.59 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 177.44 217.23 333.70 381.19 415.70 1024.15 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.77 236.48 372.70 378.23 416.23 1002.24 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.54 253.86 373.39 407.66 422.67 978.00 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.33 269.42 369.82 410.54 459.50 951.63 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.78 283.16 366.43 408.11 500.63 923.42 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.49 295.05 363.41 404.53 541.38 893.78 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.00 304.94 361.05 400.26 580.61 863.46 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.75 312.54 359.78 395.66 616.71 833.93 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.07 317.46 360.03 391.33 646.15 808.65 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.40 319.38 361.69 388.20 660.97 795.52 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.71 318.11 363.95 387.33 652.97 802.72 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.50 313.43 366.17 389.09 627.14 825.28 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.39 305.47 368.50 392.63 592.73 853.96 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.85 294.78 371.14 396.81 554.40 884.16 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.18 281.92 374.11 400.87 514.14 913.98 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.60 267.35 377.29 404.34 473.01 942.52 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.37 251.31 380.54 406.39 432.29 969.28 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 208.80 233.97 381.68 389.88 411.63 993.95 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 190.30 215.42 346.59 388.36 411.91 1016.30 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 171.41 195.75 306.73 391.75 412.12 1036.18 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.80 175.03 268.21 395.17 411.51 1053.49 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 135.39 153.40 232.16 398.35 409.91 1068.19 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 120.26 131.09 200.09 401.01 407.23 1080.31 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 107.24 110.09 174.26 402.13 404.09 1089.89 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 88.72 100.91 157.56 398.29 404.13 1096.79 -------------------------------------------------------------------------------- K point *** = 0.046875 0.921875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 77.54 96.00 152.50 394.95 403.68 1100.34 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 59.37 72.02 116.01 397.24 401.92 1108.16 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 75.20 79.44 130.90 399.67 401.49 1104.04 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 88.72 100.91 157.56 398.29 404.13 1096.79 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 105.13 124.09 192.09 395.64 406.37 1086.79 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 124.11 146.44 231.13 392.54 407.56 1074.04 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 144.34 167.87 272.60 389.17 407.81 1058.55 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 164.88 188.32 315.33 385.63 407.23 1040.35 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.14 207.67 358.40 382.11 406.02 1019.55 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 204.66 225.83 377.64 398.16 408.39 996.29 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.08 242.69 373.96 399.48 447.48 970.76 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.09 258.17 370.12 395.90 490.40 943.23 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.39 272.16 366.34 391.46 532.61 914.09 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.64 284.44 362.85 386.45 573.29 883.93 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.47 294.58 359.99 381.23 611.23 853.93 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.38 301.91 358.17 376.44 643.78 826.69 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.67 305.74 357.52 373.31 664.78 808.35 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.67 305.74 357.52 373.31 664.78 808.35 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.38 301.91 358.17 376.44 643.78 826.69 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.47 294.58 359.99 381.23 611.23 853.93 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.64 284.44 362.85 386.45 573.29 883.93 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.39 272.16 366.34 391.46 532.61 914.09 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.09 258.17 370.12 395.90 490.40 943.23 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.08 242.69 373.96 399.48 447.48 970.76 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 204.66 225.83 377.64 398.16 408.39 996.29 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.14 207.67 358.40 382.11 406.02 1019.55 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 164.88 188.32 315.33 385.63 407.23 1040.35 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 144.34 167.87 272.60 389.17 407.81 1058.55 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 124.11 146.44 231.13 392.54 407.56 1074.04 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 105.13 124.09 192.09 395.64 406.37 1086.79 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 88.72 100.91 157.56 398.29 404.13 1096.79 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 75.20 79.44 130.90 399.67 401.49 1104.04 -------------------------------------------------------------------------------- K point *** = 0.046875 0.953125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 59.37 72.02 116.01 397.24 401.92 1108.16 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 41.71 48.61 79.31 398.90 400.67 1113.77 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 57.85 58.89 90.80 400.96 401.23 1110.55 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 73.07 78.87 123.15 400.19 402.40 1104.69 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 91.48 100.03 163.94 398.25 402.76 1096.14 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 112.09 121.58 207.57 395.69 402.46 1084.72 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 133.61 142.96 252.35 392.74 401.54 1070.41 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 155.19 163.80 297.61 389.52 399.98 1053.27 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 176.28 183.85 342.90 386.16 397.79 1033.43 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.46 202.98 380.58 389.46 395.53 1011.02 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.36 221.13 378.02 391.07 433.97 986.25 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.64 238.27 374.05 386.82 478.21 959.36 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.07 254.25 369.95 381.88 521.59 930.69 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.57 268.67 365.91 376.41 563.48 900.76 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.03 280.99 362.22 370.66 602.95 870.51 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.10 290.43 359.22 365.26 638.00 841.91 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.13 296.07 356.64 361.98 663.95 819.64 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.16 297.26 354.13 362.75 671.79 812.72 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.47 294.12 353.40 366.45 656.87 825.78 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.32 287.34 354.95 371.62 627.10 850.93 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.62 277.75 358.11 377.26 590.23 880.42 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.21 265.99 362.08 382.76 549.79 910.74 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.68 252.42 366.35 387.80 507.30 940.36 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.43 237.23 370.64 392.18 463.57 968.55 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 204.73 220.55 374.80 395.46 419.44 994.84 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 184.84 202.48 372.66 378.98 399.98 1018.93 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 163.96 183.16 327.88 382.59 401.91 1040.62 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 142.36 162.71 282.69 386.09 403.46 1059.71 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 120.37 141.28 237.88 389.34 404.32 1076.08 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 98.47 119.04 194.07 392.30 404.43 1089.64 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 77.54 96.00 152.50 394.95 403.68 1100.34 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 59.37 72.02 116.01 397.24 401.92 1108.16 -------------------------------------------------------------------------------- K point *** = 0.046875 0.984375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 46.72 50.20 89.83 398.81 399.78 1112.97 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 53.30 59.16 105.66 397.92 399.92 1110.92 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 56.95 63.44 100.85 399.35 401.41 1109.90 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 74.36 75.13 114.78 401.94 402.21 1105.29 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 89.36 94.50 145.73 401.34 403.61 1098.19 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 106.91 114.90 184.59 399.40 404.18 1088.53 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 126.56 135.64 226.58 396.71 404.04 1076.10 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 147.22 156.24 270.00 393.61 403.23 1060.85 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 168.02 176.36 314.07 390.31 401.75 1042.85 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 188.28 195.81 358.07 387.15 399.61 1022.19 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 207.45 214.54 381.86 395.89 404.91 999.04 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.10 232.49 378.71 392.72 447.95 973.60 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.01 249.47 375.02 388.34 491.38 946.13 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.14 265.08 371.32 383.29 533.90 917.02 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.42 278.86 367.82 377.75 574.79 886.90 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.68 290.18 364.70 372.21 612.86 856.91 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.53 298.25 361.61 368.09 645.50 829.66 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.25 302.29 357.82 367.52 666.57 811.29 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.91 302.04 354.82 370.19 666.66 811.17 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.93 297.93 354.05 374.78 645.71 829.40 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.67 290.70 355.51 380.21 613.08 856.61 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.05 281.00 358.46 385.72 574.96 886.63 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.88 269.28 362.17 390.86 534.01 916.83 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.72 255.78 366.19 395.37 491.46 946.05 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 218.96 240.64 370.28 398.97 448.10 973.66 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.90 223.97 374.29 397.60 408.40 999.28 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 179.80 205.85 358.21 378.29 405.64 1022.65 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 158.93 186.37 314.30 382.02 406.85 1043.56 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 137.63 165.62 270.74 385.60 407.42 1061.88 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 116.37 143.67 228.35 388.98 407.16 1077.49 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 95.90 120.48 188.27 392.11 405.95 1090.32 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 77.54 96.00 152.50 394.95 403.68 1100.34 -------------------------------------------------------------------------------- K point *** = 0.078125 0.015625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 63.58 71.63 123.99 397.40 400.61 1107.42 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 56.95 63.44 100.85 399.35 401.41 1109.90 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 47.96 59.13 96.59 397.68 401.17 1111.72 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 60.02 64.44 109.82 398.98 400.52 1109.20 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 73.45 86.15 136.51 397.51 402.91 1103.15 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 90.72 109.77 172.11 394.99 404.91 1094.24 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 110.67 132.49 212.50 392.07 405.88 1082.51 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 131.75 154.34 255.23 388.87 405.95 1067.97 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 153.07 175.27 299.10 385.44 405.23 1050.66 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 174.05 195.16 343.39 381.84 403.82 1030.69 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.33 213.87 377.51 387.34 402.68 1008.20 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.58 231.29 373.85 397.39 433.70 983.36 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.55 247.32 369.80 393.90 477.33 956.43 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.95 261.87 365.71 389.46 520.35 927.73 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.45 274.78 361.78 384.38 562.01 897.78 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.64 285.79 358.33 378.92 601.31 867.53 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.95 294.35 355.92 373.52 636.25 838.93 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.64 299.70 355.15 369.01 662.14 816.67 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.92 301.19 355.96 366.84 669.91 809.82 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.70 298.51 357.44 368.35 654.94 822.98 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.72 291.81 359.55 372.68 625.22 848.17 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.80 281.83 362.58 378.05 588.49 877.66 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.45 269.41 366.24 383.47 548.28 907.93 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.99 255.18 370.19 388.50 506.10 937.51 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.65 239.51 374.17 392.89 462.77 965.62 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.69 222.56 378.01 396.24 419.14 991.83 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 190.40 204.45 372.15 383.09 400.48 1015.83 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 170.10 185.26 328.58 386.01 402.45 1037.42 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 149.17 165.12 284.22 389.46 403.96 1056.41 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 128.09 144.21 240.36 392.73 404.79 1072.68 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 107.57 122.74 197.69 395.72 404.88 1086.15 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 88.72 100.91 157.56 398.29 404.13 1096.79 -------------------------------------------------------------------------------- K point *** = 0.078125 0.046875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 73.07 78.87 123.15 400.19 402.40 1104.69 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 74.36 75.13 114.78 401.94 402.21 1105.29 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 60.02 64.44 109.82 398.98 400.52 1109.20 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 62.59 62.59 120.01 398.41 398.41 1108.98 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 70.45 82.42 140.81 395.92 401.28 1104.26 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 85.31 107.64 169.96 393.11 404.69 1096.06 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 103.98 132.52 205.37 390.01 407.22 1084.95 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 124.42 155.89 244.81 386.68 408.67 1071.04 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 145.50 177.76 286.57 383.15 409.14 1054.41 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 166.55 198.19 329.55 379.44 408.75 1035.12 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 187.12 217.18 372.74 375.59 407.91 1013.30 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 206.88 234.65 371.64 402.26 420.07 989.10 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.57 250.56 367.62 400.85 462.12 962.75 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.89 264.82 363.63 397.18 505.03 934.53 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.52 277.35 359.83 392.62 546.96 904.88 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.00 288.00 356.54 387.45 587.02 874.55 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.60 296.54 354.32 381.94 623.64 845.06 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.39 302.53 354.01 376.59 653.28 819.90 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.62 305.30 356.23 372.15 668.10 806.89 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.41 304.12 360.79 369.43 660.16 813.97 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.62 298.69 366.72 368.84 634.23 836.35 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.14 289.41 370.08 373.10 599.41 864.97 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.56 277.06 372.50 379.30 560.34 895.17 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.20 262.32 375.56 385.00 519.00 925.02 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.27 245.67 378.89 390.03 476.36 953.59 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.90 227.47 382.19 394.29 433.09 980.37 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 206.22 208.04 382.03 392.87 397.77 1005.02 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 187.71 188.37 343.84 390.54 400.47 1027.31 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 166.85 169.53 300.22 393.71 402.42 1047.04 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 145.99 149.94 256.90 396.91 403.64 1064.09 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 125.83 129.95 214.56 399.83 404.18 1078.37 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 107.24 110.09 174.26 402.13 404.09 1089.89 -------------------------------------------------------------------------------- K point *** = 0.078125 0.078125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 90.71 91.28 138.65 403.15 403.41 1098.77 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 89.36 94.50 145.73 401.34 403.61 1098.19 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 73.45 86.15 136.51 397.51 402.91 1103.15 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 70.45 82.42 140.81 395.92 401.28 1104.26 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 81.88 87.41 155.59 397.11 400.07 1100.85 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 93.49 108.56 178.18 395.11 403.44 1093.57 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 108.39 134.08 207.03 391.92 407.43 1083.16 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 126.26 159.04 240.89 388.41 410.46 1069.94 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 145.71 182.31 278.38 384.73 412.38 1054.02 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 165.78 203.74 318.24 380.95 413.29 1035.47 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.79 223.38 359.29 377.19 413.42 1014.39 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 205.29 241.29 373.12 398.88 415.17 990.90 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.89 257.45 369.35 407.78 446.71 965.20 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.27 271.88 365.65 405.41 488.49 937.55 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.05 284.53 362.20 401.73 530.07 908.31 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.81 295.29 359.25 397.25 570.35 878.09 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.97 303.96 357.25 392.29 608.01 848.06 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.76 310.17 356.82 387.27 640.41 820.81 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.45 313.44 358.39 382.95 661.28 802.54 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.85 313.35 361.52 380.38 661.08 802.78 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.49 309.53 365.00 380.60 639.98 821.35 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.15 302.04 368.12 383.55 607.57 848.67 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.40 291.43 371.09 387.97 570.00 878.65 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.57 278.41 374.19 392.66 529.84 908.71 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.84 263.54 377.45 396.98 488.34 937.74 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 230.34 247.24 380.76 400.55 446.31 965.11 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.26 229.82 383.48 399.58 408.47 990.47 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.91 211.44 359.07 388.88 406.80 1013.55 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 175.72 192.24 317.57 391.99 408.04 1034.18 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 156.32 172.35 276.51 395.30 408.61 1052.21 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 137.50 151.90 236.94 398.39 408.37 1067.59 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 120.26 131.09 200.09 401.01 407.23 1080.31 -------------------------------------------------------------------------------- K point *** = 0.078125 0.109375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 105.58 110.17 168.33 402.75 405.04 1090.48 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 106.91 114.90 184.59 399.40 404.18 1088.53 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 90.72 109.77 172.11 394.99 404.91 1094.24 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 85.31 107.64 169.96 393.11 404.69 1096.06 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 93.49 108.56 178.18 395.11 403.44 1093.57 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 110.33 115.53 194.67 398.43 402.61 1087.14 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 122.38 137.25 217.34 396.84 406.52 1077.46 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 136.37 162.44 244.91 393.50 411.02 1064.95 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.94 187.04 276.56 389.79 414.52 1049.78 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 171.02 209.96 311.48 385.99 416.91 1032.01 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.69 230.87 348.68 382.27 418.33 1011.73 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 208.26 249.75 377.66 387.83 419.47 989.04 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.18 266.65 374.65 412.92 433.28 964.09 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.03 281.64 371.36 413.48 471.63 937.11 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.40 294.74 368.37 411.12 511.96 908.39 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.88 305.86 365.85 407.77 551.77 878.45 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.04 314.82 364.10 403.88 589.82 848.17 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.35 321.27 363.41 399.94 624.06 819.45 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.27 324.93 363.86 396.70 649.75 796.94 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.39 325.72 364.90 395.13 657.48 790.03 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.72 323.62 365.96 395.85 642.41 803.54 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.66 318.45 367.19 398.49 613.01 829.00 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.74 310.38 368.93 402.07 577.20 858.56 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.37 299.82 371.24 405.77 538.47 888.80 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.89 287.22 374.00 409.03 498.42 918.30 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 239.61 272.83 377.05 411.30 458.16 946.34 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.89 256.78 380.20 408.27 422.56 972.50 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 205.11 239.12 373.47 385.15 416.75 996.52 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 186.76 219.87 335.73 387.94 416.28 1018.20 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 168.46 199.07 298.53 391.52 415.19 1037.41 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 151.00 176.81 263.64 395.07 413.11 1054.09 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 135.39 153.40 232.16 398.35 409.91 1068.19 -------------------------------------------------------------------------------- K point *** = 0.078125 0.140625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 122.58 129.92 205.29 400.90 405.80 1079.71 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 126.56 135.64 226.58 396.71 404.04 1076.10 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 110.67 132.49 212.50 392.07 405.88 1082.51 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 103.98 132.52 205.37 390.01 407.22 1084.95 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 108.39 134.08 207.03 391.92 407.43 1083.16 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 122.38 137.25 217.34 396.84 406.52 1077.46 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 141.60 144.38 234.38 401.62 405.95 1068.45 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.66 166.58 256.31 400.31 410.41 1056.62 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 165.72 191.12 282.06 397.05 415.37 1042.18 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 181.12 215.15 311.09 393.46 419.31 1025.23 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.85 237.67 342.95 389.89 422.18 1005.80 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.00 258.14 376.27 387.18 424.28 983.99 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.84 276.42 382.57 410.52 428.53 959.89 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.80 292.52 379.84 420.50 455.88 933.68 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.41 306.47 377.37 420.14 493.54 905.62 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.27 318.26 375.33 418.34 531.97 876.10 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.05 327.75 373.80 416.00 569.63 845.81 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.39 334.71 372.80 413.68 604.83 816.12 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.95 338.99 372.14 412.06 634.08 790.37 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.34 340.76 371.37 411.77 649.32 776.53 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.27 340.31 370.27 412.99 641.58 783.52 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.74 337.61 369.27 415.34 615.94 806.29 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.98 332.42 369.06 418.12 582.14 835.18 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.46 324.69 369.86 420.72 544.96 865.57 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.62 314.53 371.52 422.64 506.54 895.58 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.94 302.01 373.84 423.23 468.40 924.37 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.85 287.06 376.62 417.97 435.79 951.46 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 217.81 269.52 379.34 389.52 427.12 976.54 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 200.36 249.25 354.69 383.80 424.38 999.42 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 183.15 226.28 322.93 387.49 421.13 1019.94 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 166.97 201.15 294.03 391.38 416.84 1038.00 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.80 175.03 268.21 395.17 411.51 1053.49 -------------------------------------------------------------------------------- K point *** = 0.078125 0.171875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 141.50 149.95 245.57 398.22 405.81 1066.28 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 147.22 156.24 270.00 393.61 403.23 1060.85 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 131.75 154.34 255.23 388.87 405.95 1067.97 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 124.42 155.89 244.81 386.68 408.67 1071.04 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 126.26 159.04 240.89 388.41 410.46 1069.94 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 136.37 162.44 244.91 393.50 411.02 1064.95 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.66 166.58 256.31 400.31 410.41 1056.62 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 172.84 173.10 273.19 406.12 409.97 1045.45 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.43 195.61 293.88 405.02 414.98 1031.75 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.79 219.16 317.46 402.04 420.34 1015.63 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.19 242.48 343.57 398.86 424.69 997.13 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.61 264.58 371.86 395.98 428.09 976.28 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.13 284.78 391.65 403.44 431.40 953.16 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.01 302.66 389.97 424.64 444.10 927.87 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.69 318.10 388.08 428.06 476.14 900.61 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.75 331.06 386.51 428.23 511.92 871.69 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.90 341.49 385.18 427.80 548.22 841.61 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.90 349.33 383.86 427.48 583.44 811.37 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.53 354.61 382.28 427.78 615.00 783.26 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.55 357.52 380.21 428.95 636.70 763.24 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.66 358.49 377.64 430.85 637.61 762.21 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.59 357.91 374.81 433.06 616.85 781.00 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.31 355.69 372.29 435.09 585.31 808.86 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.04 351.21 370.82 436.50 549.67 839.33 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.25 343.85 370.73 436.86 512.88 869.92 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.46 333.30 371.80 435.46 477.06 899.55 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.23 319.15 373.76 427.97 447.70 927.66 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.07 300.89 376.36 403.33 437.00 953.92 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.57 278.29 374.59 380.53 431.72 978.08 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.40 252.06 350.05 383.63 426.05 999.95 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 184.36 223.86 327.48 387.64 419.46 1019.38 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 171.41 195.75 306.73 391.75 412.12 1036.18 -------------------------------------------------------------------------------- K point *** = 0.078125 0.203125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 161.39 169.89 287.48 395.12 405.11 1050.11 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 168.02 176.36 314.07 390.31 401.75 1042.85 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 153.07 175.27 299.10 385.44 405.23 1050.66 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 145.50 177.76 286.57 383.15 409.14 1054.41 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 145.71 182.31 278.38 384.73 412.38 1054.02 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.94 187.04 276.56 389.79 414.52 1049.78 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 165.72 191.12 282.06 397.05 415.37 1042.18 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.43 195.61 293.88 405.02 414.98 1031.75 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 200.28 203.69 310.11 411.63 414.55 1018.84 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.77 223.72 329.21 410.63 420.12 1003.63 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.67 245.90 350.37 408.11 425.81 986.14 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.19 268.32 373.29 405.63 430.53 966.40 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.28 290.03 396.81 404.58 434.61 944.41 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.02 310.09 400.67 423.24 440.60 920.24 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.72 327.74 399.44 434.04 461.78 894.00 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.91 342.62 398.36 436.71 492.99 865.91 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.32 354.62 397.22 438.39 526.62 836.34 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.74 363.87 395.65 440.21 560.77 805.96 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.07 370.56 393.36 442.52 593.36 776.26 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.18 374.84 390.48 445.25 620.07 751.25 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.87 376.55 387.69 448.03 630.54 741.03 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.91 375.68 385.67 450.42 616.57 753.77 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.07 373.46 383.71 452.00 587.71 779.98 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.31 371.38 380.51 452.41 553.50 810.45 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.91 369.82 375.34 451.29 518.14 841.65 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.34 364.49 371.49 447.93 484.54 872.19 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.18 350.93 371.96 438.74 458.32 901.41 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.02 330.77 373.73 418.82 446.23 928.90 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.50 304.67 376.31 398.43 438.32 954.37 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.32 275.02 377.83 382.24 430.11 977.58 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 202.28 244.54 363.01 384.20 421.19 998.31 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 190.30 215.42 346.59 388.36 411.91 1016.30 -------------------------------------------------------------------------------- K point *** = 0.078125 0.234375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 181.30 189.47 330.17 391.89 403.70 1031.26 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 188.28 195.81 358.07 387.15 399.61 1022.19 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 174.05 195.16 343.39 381.84 403.82 1030.69 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 166.55 198.19 329.55 379.44 408.75 1035.12 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 165.78 203.74 318.24 380.95 413.29 1035.47 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 171.02 209.96 311.48 385.99 416.91 1032.01 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 181.12 215.15 311.09 393.46 419.31 1025.23 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.79 219.16 317.46 402.04 420.34 1015.63 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.77 223.72 329.21 410.63 420.12 1003.63 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.20 232.71 344.41 417.92 419.54 989.44 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.12 250.38 361.66 416.90 425.72 973.12 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.76 270.80 380.21 415.01 431.61 954.68 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.44 292.14 399.65 413.59 436.69 934.06 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.11 313.44 410.98 421.52 441.80 911.27 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.90 333.47 410.62 437.30 452.99 886.36 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.27 351.04 410.07 443.21 477.06 859.44 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.90 365.50 409.19 446.97 506.29 830.75 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.66 376.88 407.49 450.79 537.95 800.72 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.47 385.56 404.71 454.92 570.23 770.26 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.31 391.56 401.32 459.08 600.17 741.70 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.10 392.24 400.59 462.82 620.12 722.26 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.72 387.71 403.02 465.69 616.15 725.63 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.98 382.42 404.63 467.31 591.12 748.97 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.69 377.72 404.31 467.37 558.33 779.27 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.86 374.20 401.14 465.50 524.07 811.12 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.77 372.08 393.55 460.98 492.32 842.65 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.92 371.38 379.00 451.39 468.85 873.02 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.91 355.87 371.98 436.56 456.10 901.76 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.42 326.41 373.74 423.13 445.90 928.50 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.19 294.53 376.47 411.36 435.06 952.97 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 220.02 263.09 379.83 399.95 423.39 974.89 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 208.80 233.97 381.68 389.88 411.63 993.95 -------------------------------------------------------------------------------- K point *** = 0.078125 0.265625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 200.47 208.62 372.12 389.60 401.66 1009.83 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 207.45 214.54 381.86 395.89 404.91 999.04 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.33 213.87 377.51 387.34 402.68 1008.20 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 187.12 217.18 372.74 375.59 407.91 1013.30 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.79 223.38 359.29 377.19 413.42 1014.39 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.69 230.87 348.68 382.27 418.33 1011.73 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.85 237.67 342.95 389.89 422.18 1005.80 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.19 242.48 343.57 398.86 424.69 997.13 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.67 245.90 350.37 408.11 425.81 986.14 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.12 250.38 361.66 416.90 425.72 973.12 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.21 259.68 375.55 424.79 424.82 958.17 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.12 275.11 390.75 423.57 431.68 941.25 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.60 293.42 406.53 422.56 437.61 922.30 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.43 313.47 420.03 424.71 443.02 901.25 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.54 334.33 421.02 439.04 450.05 878.06 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.23 354.42 421.06 447.85 465.99 852.77 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.17 372.10 420.56 453.26 489.12 825.47 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.26 386.56 418.95 458.56 516.53 796.43 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.48 398.01 415.91 463.93 546.89 766.13 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.86 406.63 411.93 468.99 578.10 735.74 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.42 404.96 415.14 473.32 605.65 708.99 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.17 398.53 420.54 476.59 616.07 698.84 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.04 391.63 424.12 478.56 598.10 716.38 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.88 385.00 425.25 478.99 567.41 746.20 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.55 379.28 422.89 477.50 534.58 778.74 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.08 374.97 415.10 473.10 505.08 811.30 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.74 372.29 398.95 463.52 485.11 842.82 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.06 370.92 374.01 450.66 474.27 872.76 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.70 342.80 371.90 438.84 465.38 900.70 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.41 310.63 373.79 427.77 455.73 926.32 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.00 279.57 376.82 416.85 444.71 949.28 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.37 251.31 380.54 406.39 432.29 969.28 -------------------------------------------------------------------------------- K point *** = 0.078125 0.296875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 218.30 227.24 383.58 398.06 418.67 985.98 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.10 232.49 378.71 392.72 447.95 973.60 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.58 231.29 373.85 397.39 433.70 983.36 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 206.88 234.65 371.64 402.26 420.07 989.10 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 205.29 241.29 373.12 398.88 415.17 990.90 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 208.26 249.75 377.66 387.83 419.47 989.04 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.00 258.14 376.27 387.18 424.28 983.99 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.61 264.58 371.86 395.98 428.09 976.28 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.19 268.32 373.29 405.63 430.53 966.40 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.76 270.80 380.21 415.01 431.61 954.68 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.12 275.11 390.75 423.57 431.68 941.25 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.95 284.18 403.11 430.13 432.16 926.11 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.48 297.44 416.11 430.35 437.97 909.15 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.81 313.38 428.08 431.47 443.64 890.23 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.75 331.94 430.19 442.67 449.41 869.25 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.14 352.32 430.90 451.77 459.97 846.12 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.61 372.58 430.97 457.78 476.77 820.87 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.13 390.72 429.70 463.70 498.40 793.60 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.76 405.85 426.77 469.34 524.98 764.52 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.60 418.17 422.23 474.24 555.28 734.16 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.77 416.28 428.12 478.18 586.79 703.84 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.34 409.23 435.71 481.13 612.80 679.39 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.39 401.47 440.46 483.19 610.58 683.16 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.87 393.53 441.51 484.32 583.87 711.67 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.68 386.02 437.75 483.89 553.90 745.01 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.72 379.58 427.74 479.94 528.36 778.62 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.01 374.72 409.90 470.16 512.33 811.25 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.83 371.57 384.71 456.83 504.01 842.28 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.74 354.35 371.10 443.20 497.88 871.27 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.45 323.63 371.67 429.79 491.20 897.87 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.78 294.03 373.91 416.66 483.00 921.73 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.60 267.35 377.29 404.34 473.01 942.52 -------------------------------------------------------------------------------- K point *** = 0.078125 0.328125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.54 245.09 380.53 394.51 461.23 959.91 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.01 249.47 375.02 388.34 491.38 946.13 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.55 247.32 369.80 393.90 477.33 956.43 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.57 250.56 367.62 400.85 462.12 962.75 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.89 257.45 369.35 407.78 446.71 965.20 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.18 266.65 374.65 412.92 433.28 964.09 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.84 276.42 382.57 410.52 428.53 959.89 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.13 284.78 391.65 403.44 431.40 953.16 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.28 290.03 396.81 404.58 434.61 944.41 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.44 292.14 399.65 413.59 436.69 934.06 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.60 293.42 406.53 422.56 437.61 922.30 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.48 297.44 416.11 430.35 437.97 909.15 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.13 305.86 426.76 435.38 439.81 894.48 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.96 316.98 436.02 438.22 444.68 878.09 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.08 330.38 437.65 448.15 449.83 859.80 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.06 347.29 439.18 455.00 458.50 839.44 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.57 367.19 440.09 461.17 469.76 816.94 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.76 387.73 439.44 467.37 484.92 792.29 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.91 406.69 436.94 472.40 506.15 765.58 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.24 422.92 432.85 475.91 533.26 737.03 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.94 426.48 437.15 478.00 564.60 707.08 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.16 419.50 447.58 479.15 597.87 676.77 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.07 411.40 453.51 480.58 624.44 654.13 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.75 402.69 452.95 483.18 607.39 676.28 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.23 393.90 445.97 484.96 580.56 710.75 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.42 385.68 433.19 482.30 558.73 745.41 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.21 378.68 414.54 473.18 545.19 778.97 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.63 373.29 390.73 459.55 538.18 810.88 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.98 361.64 371.85 444.46 533.58 840.69 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.83 333.81 370.31 429.26 528.74 868.04 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.94 306.48 371.38 414.50 522.43 892.58 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.18 281.92 374.11 400.87 514.14 913.98 -------------------------------------------------------------------------------- K point *** = 0.078125 0.359375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.13 261.76 377.24 390.05 503.75 931.92 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.14 265.08 371.32 383.29 533.90 917.02 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.95 261.87 365.71 389.46 520.35 927.73 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.89 264.82 363.63 397.18 505.03 934.53 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.27 271.88 365.65 405.41 488.49 937.55 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.03 281.64 371.36 413.48 471.63 937.11 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.80 292.52 379.84 420.50 455.88 933.68 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.01 302.66 389.97 424.64 444.10 927.87 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.02 310.09 400.67 423.24 440.60 920.24 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.11 313.44 410.98 421.52 441.80 911.27 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.43 313.47 420.03 424.71 443.02 901.25 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.81 313.38 428.08 431.47 443.64 890.23 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.96 316.98 436.02 438.22 444.68 878.09 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.50 324.42 440.34 445.00 448.82 864.58 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.39 333.44 442.45 450.28 456.10 849.44 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.14 344.24 445.05 454.78 463.49 832.42 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.08 359.39 447.42 460.70 470.10 813.35 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.59 378.80 447.80 469.35 477.13 792.15 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.50 399.58 445.96 475.14 491.20 768.84 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.42 419.33 442.34 477.04 513.37 743.59 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.65 433.67 440.42 476.61 541.22 716.71 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.45 428.86 453.62 474.19 573.05 688.72 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.04 420.86 463.48 472.15 607.18 660.51 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.61 411.83 458.92 478.70 631.78 643.99 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.30 402.28 448.27 483.62 608.51 678.58 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.14 392.78 433.77 482.36 590.00 713.53 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.07 383.94 415.34 473.94 578.59 747.38 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.98 376.24 393.52 460.25 572.77 779.61 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.87 365.28 374.45 444.19 569.37 809.79 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.04 341.31 369.95 427.62 565.96 837.51 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.10 316.81 369.39 411.55 561.20 862.42 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.85 294.78 371.14 396.81 554.40 884.16 -------------------------------------------------------------------------------- K point *** = 0.078125 0.390625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.01 276.81 374.05 384.96 545.31 902.45 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.42 278.86 367.82 377.75 574.79 886.90 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.45 274.78 361.78 384.38 562.01 897.78 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.52 277.35 359.83 392.62 546.96 904.88 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.05 284.53 362.20 401.73 530.07 908.31 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.40 294.74 368.37 411.12 511.96 908.39 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.41 306.47 377.37 420.14 493.54 905.62 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.69 318.10 388.08 428.06 476.14 900.61 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.72 327.74 399.44 434.04 461.78 894.00 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.90 333.47 410.62 437.30 452.99 886.36 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.54 334.33 421.02 439.04 450.05 878.06 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.75 331.94 430.19 442.67 449.41 869.25 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.08 330.38 437.65 448.15 449.83 859.80 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.39 333.44 442.45 450.28 456.10 849.44 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.87 339.65 444.79 453.47 463.16 837.83 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.63 346.59 447.39 456.65 469.48 824.63 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.83 354.84 451.38 459.53 474.62 809.57 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.58 368.23 454.22 465.35 478.39 792.51 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.00 387.02 453.43 476.23 481.66 773.44 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.73 407.66 450.33 479.56 496.21 752.51 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.59 427.21 445.87 478.00 518.81 730.12 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.97 436.09 448.20 474.40 545.79 706.99 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.15 429.34 459.56 470.76 575.25 684.56 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.41 420.40 456.27 476.39 603.44 666.57 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.98 410.53 445.29 481.81 617.96 666.13 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.01 400.24 430.91 480.92 613.26 689.94 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.57 390.01 413.59 472.91 607.15 720.35 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.59 380.10 394.15 459.37 604.04 751.04 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.94 367.01 377.71 442.84 602.58 780.41 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.59 346.21 370.76 425.37 600.95 807.68 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.85 324.77 368.14 408.29 597.91 832.33 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.39 305.47 368.50 392.63 592.73 853.96 -------------------------------------------------------------------------------- K point *** = 0.078125 0.421875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.10 289.73 371.03 379.64 585.06 872.24 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.68 290.18 364.70 372.21 612.86 856.91 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.64 285.79 358.33 378.92 601.31 867.53 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.00 288.00 356.54 387.45 587.02 874.55 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.81 295.29 359.25 397.25 570.35 878.09 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.88 305.86 365.85 407.77 551.77 878.45 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.27 318.26 375.33 418.34 531.97 876.10 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.75 331.06 386.51 428.23 511.92 871.69 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.91 342.62 398.36 436.71 492.99 865.91 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.27 351.04 410.07 443.21 477.06 859.44 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.23 354.42 421.06 447.85 465.99 852.77 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.14 352.32 430.90 451.77 459.97 846.12 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.06 347.29 439.18 455.00 458.50 839.44 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.14 344.24 445.05 454.78 463.49 832.42 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.63 346.59 447.39 456.65 469.48 824.63 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.14 351.40 448.50 459.67 474.92 815.63 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.62 356.32 451.19 461.86 479.24 805.04 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.00 362.17 456.12 463.24 482.16 792.65 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.37 373.82 458.89 468.68 483.49 778.38 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.71 391.69 456.67 480.96 483.57 762.40 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.41 411.29 452.29 481.03 498.86 745.10 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.43 428.87 446.69 477.95 520.06 727.29 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.19 435.39 445.20 475.46 544.17 710.31 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.04 427.91 445.83 476.94 569.23 696.48 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.28 418.13 438.09 479.79 592.07 689.49 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.16 407.43 425.48 478.24 608.81 693.73 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.87 396.15 410.03 470.42 618.49 709.70 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.49 383.82 393.71 457.25 624.19 732.47 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.93 367.76 380.83 440.79 627.98 757.38 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.03 348.77 372.55 422.98 630.04 781.94 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.76 330.08 367.70 405.35 629.90 804.84 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.50 313.43 366.17 389.09 627.14 825.28 -------------------------------------------------------------------------------- K point *** = 0.078125 0.453125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.17 299.87 367.79 375.23 621.49 842.76 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.53 298.25 361.61 368.09 645.50 829.66 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.95 294.35 355.92 373.52 636.25 838.93 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.60 296.54 354.32 381.94 623.64 845.06 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.97 303.96 357.25 392.29 608.01 848.06 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.04 314.82 364.10 403.88 589.82 848.17 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.05 327.75 373.80 416.00 569.63 845.81 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.90 341.49 385.18 427.80 548.22 841.61 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.32 354.62 397.22 438.39 526.62 836.34 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.90 365.50 409.19 446.97 506.29 830.75 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.17 372.10 420.56 453.26 489.12 825.47 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.61 372.58 430.97 457.78 476.77 820.87 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.57 367.19 440.09 461.17 469.76 816.94 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.08 359.39 447.42 460.70 470.10 813.35 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.83 354.84 451.38 459.53 474.62 809.57 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.62 356.32 451.19 461.86 479.24 805.04 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.25 359.58 451.25 464.34 482.96 799.26 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.34 362.55 453.72 465.51 485.35 791.90 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.57 366.24 458.86 465.52 486.26 782.81 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.31 376.21 460.97 470.22 485.62 772.10 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.65 392.63 457.32 482.18 483.70 760.12 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.52 410.06 451.63 480.58 497.93 747.60 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.92 423.98 444.37 477.82 516.47 735.64 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.33 429.71 435.94 476.94 537.42 725.77 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.12 424.54 427.91 477.09 559.82 719.82 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.62 413.69 418.11 474.46 582.19 719.36 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.14 400.51 406.21 466.76 602.91 725.04 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.87 384.66 394.52 454.26 620.69 736.22 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.89 367.16 383.81 438.44 634.77 751.35 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.11 349.38 374.62 421.02 644.85 768.54 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.37 332.65 367.76 403.54 650.90 786.10 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.71 318.11 363.95 387.33 652.97 802.72 -------------------------------------------------------------------------------- K point *** = 0.078125 0.484375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.78 306.51 363.38 373.73 651.13 817.46 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.25 302.29 357.82 367.52 666.57 811.29 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.64 299.70 355.15 369.01 662.14 816.67 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.39 302.53 354.01 376.59 653.28 819.90 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.76 310.17 356.82 387.27 640.41 820.81 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.35 321.27 363.41 399.94 624.06 819.45 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.39 334.71 372.80 413.68 604.83 816.12 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.90 349.33 383.86 427.48 583.44 811.37 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.74 363.87 395.65 440.21 560.77 805.96 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.66 376.88 407.49 450.79 537.95 800.72 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.26 386.56 418.95 458.56 516.53 796.43 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.13 390.72 429.70 463.70 498.40 793.60 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.76 387.73 439.44 467.37 484.92 792.29 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.59 378.80 447.80 469.35 477.13 792.15 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.58 368.23 454.22 465.35 478.39 792.51 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.00 362.17 456.12 463.24 482.16 792.65 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.34 362.55 453.72 465.51 485.35 791.90 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.19 364.15 452.85 467.12 487.36 789.79 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.79 365.23 454.83 467.16 487.94 786.09 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.49 367.05 459.41 466.00 487.07 780.80 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.33 375.42 460.27 469.70 484.92 774.21 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.82 389.81 455.37 478.92 482.92 766.87 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.06 404.13 448.42 477.79 493.89 759.66 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.08 413.50 439.86 475.29 509.84 753.68 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.38 414.74 429.97 473.34 529.07 750.08 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.39 408.22 419.32 469.70 551.02 749.70 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.47 396.22 408.48 462.29 574.23 752.77 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.95 381.14 397.47 450.83 597.07 758.84 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.06 364.68 386.55 436.27 618.17 767.02 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.89 348.11 376.36 420.02 636.42 776.38 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.37 332.65 367.76 403.54 650.90 786.10 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.40 319.38 361.69 388.20 660.97 795.52 -------------------------------------------------------------------------------- K point *** = 0.078125 0.515625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.18 309.11 358.75 375.37 666.22 804.08 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.91 302.04 354.82 370.19 666.66 811.17 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.92 301.19 355.96 366.84 669.91 809.82 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.62 305.30 356.23 372.15 668.10 806.89 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.45 313.44 358.39 382.95 661.28 802.54 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.27 324.93 363.86 396.70 649.75 796.94 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.95 338.99 372.14 412.06 634.08 790.37 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.53 354.61 382.28 427.78 615.00 783.26 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.07 370.56 393.36 442.52 593.36 776.26 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.47 385.56 404.71 454.92 570.23 770.26 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.48 398.01 415.91 463.93 546.89 766.13 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.76 405.85 426.77 469.34 524.98 764.52 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.91 406.69 436.94 472.40 506.15 765.58 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.50 399.58 445.96 475.14 491.20 768.84 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.00 387.02 453.43 476.23 481.66 773.44 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.37 373.82 458.89 468.68 483.49 778.38 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.57 366.24 458.86 465.52 486.26 782.81 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.79 365.23 454.83 467.16 487.94 786.09 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.98 365.06 453.17 467.69 488.23 787.86 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.97 364.34 454.46 466.60 487.08 788.04 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.74 364.61 457.75 464.59 484.63 786.78 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.45 371.43 456.86 467.21 481.33 784.53 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.25 383.34 450.90 473.00 479.74 781.93 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.07 394.09 442.95 471.61 488.23 779.80 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.92 399.06 433.56 468.45 502.37 778.98 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.38 396.43 423.11 464.26 520.87 780.06 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.90 387.57 411.97 457.46 542.62 783.20 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.89 374.78 400.42 447.41 565.81 788.04 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.71 359.97 388.80 434.62 588.86 793.83 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.63 344.63 377.64 420.19 610.54 799.70 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.76 330.08 367.70 405.35 629.90 804.84 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.07 317.46 360.03 391.33 646.15 808.65 -------------------------------------------------------------------------------- K point *** = 0.078125 0.546875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.50 307.80 355.61 379.20 658.60 810.80 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.93 297.93 354.05 374.78 645.71 829.40 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.70 298.51 357.44 368.35 654.94 822.98 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.41 304.12 360.79 369.43 660.16 813.97 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.85 313.35 361.52 380.38 661.08 802.78 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.39 325.72 364.90 395.13 657.48 790.03 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.34 340.76 371.37 411.77 649.32 776.53 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.55 357.52 380.21 428.95 636.70 763.24 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.18 374.84 390.48 445.25 620.07 751.25 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.31 391.56 401.32 459.08 600.17 741.70 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.86 406.63 411.93 468.99 578.10 735.74 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.60 418.17 422.23 474.24 555.28 734.16 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.24 422.92 432.85 475.91 533.26 737.03 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.42 419.33 442.34 477.04 513.37 743.59 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.73 407.66 450.33 479.56 496.21 752.51 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.71 391.69 456.67 480.96 483.57 762.40 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.31 376.21 460.97 470.22 485.62 772.10 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.49 367.05 459.41 466.00 487.07 780.80 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.97 364.34 454.46 466.60 487.08 788.04 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.62 362.32 452.20 465.99 485.60 793.61 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.89 359.88 452.63 463.91 482.75 797.60 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.36 358.91 453.98 461.54 478.83 800.29 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.78 364.22 451.04 463.17 474.66 802.18 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.02 373.41 444.18 465.38 473.80 803.89 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.60 380.54 435.43 462.68 481.15 806.06 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.53 381.72 425.35 458.53 494.05 809.17 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.43 376.26 414.28 452.68 511.74 813.39 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.78 365.91 402.53 444.35 532.66 818.48 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.07 352.79 390.49 433.63 554.93 823.86 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.66 338.60 378.74 421.27 577.05 828.75 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.85 324.77 368.14 408.29 597.91 832.33 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.75 312.54 359.78 395.66 616.71 833.93 -------------------------------------------------------------------------------- K point *** = 0.078125 0.578125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.29 303.12 354.80 384.23 632.82 833.04 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.67 290.70 355.51 380.21 613.08 856.61 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.72 291.81 359.55 372.68 625.22 848.17 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.62 298.69 366.72 368.84 634.23 836.35 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.49 309.53 365.00 380.60 639.98 821.35 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.72 323.62 365.96 395.85 642.41 803.54 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.27 340.31 370.27 412.99 641.58 783.52 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.66 358.49 377.64 430.85 637.61 762.21 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.87 376.55 387.69 448.03 630.54 741.03 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.10 392.24 400.59 462.82 620.12 722.26 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.42 404.96 415.14 473.32 605.65 708.99 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.77 416.28 428.12 478.18 586.79 703.84 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.94 426.48 437.15 478.00 564.60 707.08 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.65 433.67 440.42 476.61 541.22 716.71 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.59 427.21 445.87 478.00 518.81 730.12 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.41 411.29 452.29 481.03 498.86 745.10 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.65 392.63 457.32 482.18 483.70 760.12 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.33 375.42 460.27 469.70 484.92 774.21 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.74 364.61 457.75 464.59 484.63 786.78 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.89 359.88 452.63 463.91 482.75 797.60 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.09 355.94 450.01 462.22 479.40 806.64 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.54 351.89 449.44 459.42 474.82 814.10 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.42 349.95 448.38 457.26 469.52 820.34 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.50 353.75 443.43 457.99 464.69 825.84 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.27 360.16 435.64 456.69 465.08 831.09 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.81 363.86 426.15 452.82 471.72 836.51 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.07 361.86 415.42 448.12 483.49 842.29 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.71 354.28 403.82 441.62 500.07 848.31 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.29 343.00 391.80 433.02 519.72 854.12 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.28 329.96 380.02 422.74 540.57 859.07 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.10 316.81 369.39 411.55 561.20 862.42 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.00 304.94 361.05 400.26 580.61 863.46 -------------------------------------------------------------------------------- K point *** = 0.078125 0.609375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.02 295.71 356.13 389.60 598.08 861.65 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.05 281.00 358.46 385.72 574.96 886.63 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.80 281.83 362.58 378.05 588.49 877.66 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.14 289.41 370.08 373.10 599.41 864.97 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.15 302.04 368.12 383.55 607.57 848.67 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.66 318.45 367.19 398.49 613.01 829.00 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.74 337.61 369.27 415.34 615.94 806.29 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.59 357.91 374.81 433.06 616.85 781.00 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.91 375.68 385.67 450.42 616.57 753.77 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.72 387.71 403.02 465.69 616.15 725.63 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.17 398.53 420.54 476.59 616.07 698.84 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.34 409.23 435.71 481.13 612.80 679.39 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.16 419.50 447.58 479.15 597.87 676.77 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.45 428.86 453.62 474.19 573.05 688.72 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.97 436.09 448.20 474.40 545.79 706.99 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.43 428.87 446.69 477.95 520.06 727.29 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.52 410.06 451.63 480.58 497.93 747.60 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.82 389.81 455.37 478.92 482.92 766.87 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.45 371.43 456.86 467.21 481.33 784.53 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.36 358.91 453.98 461.54 478.83 800.29 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.54 351.89 449.44 459.42 474.82 814.10 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.40 345.97 446.75 456.74 469.50 826.08 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.91 340.44 445.05 453.61 463.21 836.47 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.02 337.71 441.46 452.08 456.57 845.64 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.80 340.01 434.75 450.44 452.84 853.98 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.22 343.70 426.00 446.01 454.82 861.85 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.91 344.27 415.84 442.77 459.66 869.44 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.80 339.65 404.69 438.55 469.81 876.73 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.55 330.54 393.05 432.20 485.01 883.39 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.76 318.85 381.63 423.97 503.19 888.90 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.94 306.48 371.38 414.50 522.43 892.58 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.49 295.05 363.41 404.53 541.38 893.78 -------------------------------------------------------------------------------- K point *** = 0.078125 0.640625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.59 286.04 358.84 394.74 559.10 891.93 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.88 269.28 362.17 390.86 534.01 916.83 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.45 269.41 366.24 383.47 548.28 907.93 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.56 277.06 372.50 379.30 560.34 895.17 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.40 291.43 371.09 387.97 570.00 878.65 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.74 310.38 368.93 402.07 577.20 858.56 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.98 332.42 369.06 418.12 582.14 835.18 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.31 355.69 372.29 435.09 585.31 808.86 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.07 373.46 383.71 452.00 587.71 779.98 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.98 382.42 404.63 467.31 591.12 748.97 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.04 391.63 424.12 478.56 598.10 716.38 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.39 401.47 440.46 483.19 610.58 683.16 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.07 411.40 453.51 480.58 624.44 654.13 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.04 420.86 463.48 472.15 607.18 660.51 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.15 429.34 459.56 470.76 575.25 684.56 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.19 435.39 445.20 475.46 544.17 710.31 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.92 423.98 444.37 477.82 516.47 735.64 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.06 404.13 448.42 477.79 493.89 759.66 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.25 383.34 450.90 473.00 479.74 781.93 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.78 364.22 451.04 463.17 474.66 802.18 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.42 349.95 448.38 457.26 469.52 820.34 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.91 340.44 445.05 453.61 463.21 836.47 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.57 332.47 442.64 449.81 455.99 850.73 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.07 325.61 439.58 445.86 449.05 863.38 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.33 322.27 433.58 439.75 446.63 874.72 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.95 323.08 425.47 433.79 446.21 885.06 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.15 324.23 416.02 430.80 445.75 894.60 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.25 322.05 405.54 430.98 446.45 903.34 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.10 315.39 394.50 429.52 453.10 911.10 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.40 305.40 383.63 424.18 466.40 917.42 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.78 294.03 373.91 416.66 483.00 921.73 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.78 283.16 366.43 408.11 500.63 923.42 -------------------------------------------------------------------------------- K point *** = 0.078125 0.671875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.77 274.42 362.28 399.29 517.93 921.92 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.72 255.78 366.19 395.37 491.46 946.05 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.99 255.18 370.19 388.50 506.10 937.51 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.20 262.32 375.56 385.00 519.00 925.02 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.57 278.41 374.19 392.66 529.84 908.71 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.37 299.82 371.24 405.77 538.47 888.80 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.46 324.69 369.86 420.72 544.96 865.57 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.04 351.21 370.82 436.50 549.67 839.33 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.31 371.38 380.51 452.41 553.50 810.45 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.69 377.72 404.31 467.37 558.33 779.27 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.88 385.00 425.25 478.99 567.41 746.20 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.87 393.53 441.51 484.32 583.87 711.67 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.75 402.69 452.95 483.18 607.39 676.28 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.61 411.83 458.92 478.70 631.78 643.99 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.41 420.40 456.27 476.39 603.44 666.57 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.04 427.91 445.83 476.94 569.23 696.48 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.33 429.71 435.94 476.94 537.42 725.77 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.08 413.50 439.86 475.29 509.84 753.68 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.07 394.09 442.95 471.61 488.23 779.80 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.02 373.41 444.18 465.38 473.80 803.89 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.50 353.75 443.43 457.99 464.69 825.84 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.02 337.71 441.46 452.08 456.57 845.64 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.07 325.61 439.58 445.86 449.05 863.38 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.68 315.55 436.90 437.91 443.83 879.23 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.09 307.58 427.23 433.73 441.25 893.41 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.56 303.75 418.19 426.58 440.63 906.15 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.25 303.14 411.18 418.20 439.84 917.64 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.46 302.03 405.39 411.92 438.11 927.93 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.28 297.64 396.07 413.95 435.64 936.89 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.55 289.64 385.97 418.67 435.54 944.18 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.00 279.57 376.82 416.85 444.71 949.28 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.33 269.42 369.82 410.54 459.50 951.63 -------------------------------------------------------------------------------- K point *** = 0.078125 0.703125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.10 260.99 366.05 403.00 475.63 950.69 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 218.96 240.64 370.28 398.97 448.10 973.66 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.65 239.51 374.17 392.89 462.77 965.62 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.27 245.67 378.89 390.03 476.36 953.59 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.84 263.54 377.45 396.98 488.34 937.74 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.89 287.22 374.00 409.03 498.42 918.30 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.62 314.53 371.52 422.64 506.54 895.58 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.25 343.85 370.73 436.86 512.88 869.92 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.91 369.82 375.34 451.29 518.14 841.65 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.86 374.20 401.14 465.50 524.07 811.12 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.55 379.28 422.89 477.50 534.58 778.74 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.68 386.02 437.75 483.89 553.90 745.01 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.23 393.90 445.97 484.96 580.56 710.75 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.30 402.28 448.27 483.62 608.51 678.58 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.98 410.53 445.29 481.81 617.96 666.13 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.28 418.13 438.09 479.79 592.07 689.49 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.12 424.54 427.91 477.09 559.82 719.82 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.38 414.74 429.97 473.34 529.07 750.08 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.92 399.06 433.56 468.45 502.37 778.98 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.60 380.54 435.43 462.68 481.15 806.06 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.27 360.16 435.64 456.69 465.08 831.09 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.80 340.01 434.75 450.44 452.84 853.98 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.33 322.27 433.58 439.75 446.63 874.72 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.09 307.58 427.23 433.73 441.25 893.41 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.88 295.39 415.45 432.77 435.95 910.16 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.15 286.60 403.92 426.96 434.79 925.15 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.99 282.42 393.84 418.71 434.60 938.53 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.06 280.52 386.93 409.46 433.58 950.37 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.63 277.53 385.03 399.83 431.28 960.58 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.66 271.58 386.39 393.09 427.66 968.90 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 220.02 263.09 379.83 399.95 423.39 974.89 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.54 253.86 373.39 407.66 422.67 978.00 -------------------------------------------------------------------------------- K point *** = 0.078125 0.734375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 214.98 245.84 369.96 405.12 433.43 977.72 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.90 223.97 374.29 397.60 408.40 999.28 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.69 222.56 378.01 396.24 419.14 991.83 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.90 227.47 382.19 394.29 433.09 980.37 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 230.34 247.24 380.76 400.55 446.31 965.11 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 239.61 272.83 377.05 411.30 458.16 946.34 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.94 302.01 373.84 423.23 468.40 924.37 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.46 333.30 371.80 435.46 477.06 899.55 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.34 364.49 371.49 447.93 484.54 872.19 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.77 372.08 393.55 460.98 492.32 842.65 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.08 374.97 415.10 473.10 505.08 811.30 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.72 379.58 427.74 479.94 528.36 778.62 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.42 385.68 433.19 482.30 558.73 745.41 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.14 392.78 433.77 482.36 590.00 713.53 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.01 400.24 430.91 480.92 613.26 689.94 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.16 407.43 425.48 478.24 608.81 693.73 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.62 413.69 418.11 474.46 582.19 719.36 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.39 408.22 419.32 469.70 551.02 749.70 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.38 396.43 423.11 464.26 520.87 780.06 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.53 381.72 425.35 458.53 494.05 809.17 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.81 363.86 426.15 452.82 471.72 836.51 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.22 343.70 426.00 446.01 454.82 861.85 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.95 323.08 425.47 433.79 446.21 885.06 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.56 303.75 418.19 426.58 440.63 906.15 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.15 286.60 403.92 426.96 434.79 925.15 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.38 272.26 389.80 427.46 428.45 942.17 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.43 263.02 376.65 420.20 428.66 957.29 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 235.97 258.61 365.70 411.47 428.68 970.59 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.87 255.62 358.81 402.09 427.56 982.03 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.31 251.27 357.78 392.68 425.06 991.40 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 202.28 244.54 363.01 384.20 421.19 998.31 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.77 236.48 372.70 378.23 416.23 1002.24 -------------------------------------------------------------------------------- K point *** = 0.078125 0.765625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 195.72 229.02 373.85 386.61 410.84 1002.69 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 179.80 205.85 358.21 378.29 405.64 1022.65 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 190.40 204.45 372.15 383.09 400.48 1015.83 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 206.22 208.04 382.03 392.87 397.77 1005.02 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.26 229.82 383.48 399.58 408.47 990.47 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.89 256.78 380.20 408.27 422.56 972.50 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.85 287.06 376.62 417.97 435.79 951.46 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.23 319.15 373.76 427.97 447.70 927.66 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.18 350.93 371.96 438.74 458.32 901.41 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.92 371.38 379.00 451.39 468.85 873.02 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.74 372.29 398.95 463.52 485.11 842.82 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.01 374.72 409.90 470.16 512.33 811.25 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.21 378.68 414.54 473.18 545.19 778.97 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.07 383.94 415.34 473.94 578.59 747.38 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.57 390.01 413.59 472.91 607.15 720.35 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.87 396.15 410.03 470.42 618.49 709.70 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.14 400.51 406.21 466.76 602.91 725.04 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.47 396.22 408.48 462.29 574.23 752.77 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.90 387.57 411.97 457.46 542.62 783.20 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.43 376.26 414.28 452.68 511.74 813.39 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.07 361.86 415.42 448.12 483.49 842.29 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.91 344.27 415.84 442.77 459.66 869.44 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.15 324.23 416.02 430.80 445.75 894.60 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.25 303.14 411.18 418.20 439.84 917.64 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.99 282.42 393.84 418.71 434.60 938.53 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.43 263.02 376.65 420.20 428.66 957.29 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.46 246.48 360.40 421.31 422.14 973.97 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.22 237.27 345.83 413.70 422.86 988.61 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 208.92 232.73 334.27 404.96 423.02 1001.20 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 195.24 228.96 327.63 395.97 421.93 1011.57 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 184.36 223.86 327.48 387.64 419.46 1019.38 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 177.44 217.23 333.70 381.19 415.70 1024.15 -------------------------------------------------------------------------------- K point *** = 0.078125 0.796875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 175.61 210.58 344.63 377.80 410.94 1025.37 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 158.93 186.37 314.30 382.02 406.85 1043.56 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 170.10 185.26 328.58 386.01 402.45 1037.42 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 187.71 188.37 343.84 390.54 400.47 1027.31 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.91 211.44 359.07 388.88 406.80 1013.55 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 205.11 239.12 373.47 385.15 416.75 996.52 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 217.81 269.52 379.34 389.52 427.12 976.54 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.07 300.89 376.36 403.33 437.00 953.92 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.02 330.77 373.73 418.82 446.23 928.90 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.91 355.87 371.98 436.56 456.10 901.76 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.06 370.92 374.01 450.66 474.27 872.76 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.83 371.57 384.71 456.83 504.01 842.28 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.63 373.29 390.73 459.55 538.18 810.88 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.98 376.24 393.52 460.25 572.77 779.61 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.59 380.10 394.15 459.37 604.04 751.04 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.49 383.82 393.71 457.25 624.19 732.47 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.87 384.66 394.52 454.26 620.69 736.22 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.95 381.14 397.47 450.83 597.07 758.84 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.89 374.78 400.42 447.41 565.81 788.04 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.78 365.91 402.53 444.35 532.66 818.48 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.71 354.28 403.82 441.62 500.07 848.31 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.80 339.65 404.69 438.55 469.81 876.73 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.25 322.05 405.54 430.98 446.45 903.34 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.46 302.03 405.39 411.92 438.11 927.93 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.06 280.52 386.93 409.46 433.58 950.37 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 235.97 258.61 365.70 411.47 428.68 970.59 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.22 237.27 345.83 413.70 422.86 988.61 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.45 218.43 327.63 414.69 417.00 1004.43 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.82 209.82 311.87 407.73 417.48 1018.04 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 180.36 205.26 300.03 399.39 417.79 1029.33 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 166.97 201.15 294.03 391.38 416.84 1038.00 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 158.05 196.06 295.07 384.99 414.55 1043.59 -------------------------------------------------------------------------------- K point *** = 0.078125 0.828125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 155.01 190.53 302.47 381.59 411.10 1045.58 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 137.63 165.62 270.74 385.60 407.42 1061.88 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 149.17 165.12 284.22 389.46 403.96 1056.41 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 166.85 169.53 300.22 393.71 402.42 1047.04 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 175.72 192.24 317.57 391.99 408.04 1034.18 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 186.76 219.87 335.73 387.94 416.28 1018.20 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 200.36 249.25 354.69 383.80 424.38 999.42 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.57 278.29 374.59 380.53 431.72 978.08 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.50 304.67 376.31 398.43 438.32 954.37 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.42 326.41 373.74 423.13 445.90 928.50 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.70 342.80 371.90 438.84 465.38 900.70 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.74 354.35 371.10 443.20 497.88 871.27 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.98 361.64 371.85 444.46 533.58 840.69 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.87 365.28 374.45 444.19 569.37 809.79 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.94 367.01 377.71 442.84 602.58 780.41 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.93 367.76 380.83 440.79 627.98 757.38 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.89 367.16 383.81 438.44 634.77 751.35 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.06 364.68 386.55 436.27 618.17 767.02 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.71 359.97 388.80 434.62 588.86 793.83 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.07 352.79 390.49 433.63 554.93 823.86 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.29 343.00 391.80 433.02 519.72 854.12 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.55 330.54 393.05 432.20 485.01 883.39 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.10 315.39 394.50 429.52 453.10 911.10 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.28 297.64 396.07 413.95 435.64 936.89 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.63 277.53 385.03 399.83 431.28 960.58 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.87 255.62 358.81 402.09 427.56 982.03 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 208.92 232.73 334.27 404.96 423.02 1001.20 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.82 209.82 311.87 407.73 417.48 1018.04 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 186.72 188.56 291.94 408.76 412.20 1032.55 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 167.68 181.18 275.33 402.53 412.61 1044.64 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 151.00 176.81 263.64 395.07 413.11 1054.09 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 139.27 172.95 258.79 388.77 412.39 1060.46 -------------------------------------------------------------------------------- K point *** = 0.078125 0.859375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 134.36 168.85 261.56 385.27 410.42 1063.20 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 116.37 143.67 228.35 388.98 407.16 1077.49 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 128.09 144.21 240.36 392.73 404.79 1072.68 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 145.99 149.94 256.90 396.91 403.64 1064.09 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 156.32 172.35 276.51 395.30 408.61 1052.21 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 168.46 199.07 298.53 391.52 415.19 1037.41 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 183.15 226.28 322.93 387.49 421.13 1019.94 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.40 252.06 350.05 383.63 426.05 999.95 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.32 275.02 377.83 382.24 430.11 977.58 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.19 294.53 376.47 411.36 435.06 952.97 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.41 310.63 373.79 427.77 455.73 926.32 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.45 323.63 371.67 429.79 491.20 897.87 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.83 333.81 370.31 429.26 528.74 868.04 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.04 341.31 369.95 427.62 565.96 837.51 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.59 346.21 370.76 425.37 600.95 807.68 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.03 348.77 372.55 422.98 630.04 781.94 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.11 349.38 374.62 421.02 644.85 768.54 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.89 348.11 376.36 420.02 636.42 776.38 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.63 344.63 377.64 420.19 610.54 799.70 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.66 338.60 378.74 421.27 577.05 828.75 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.28 329.96 380.02 422.74 540.57 859.07 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.76 318.85 381.63 423.97 503.19 888.90 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.40 305.40 383.63 424.18 466.40 917.42 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.55 289.64 385.97 418.67 435.54 944.18 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.66 271.58 386.39 393.09 427.66 968.90 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.31 251.27 357.78 392.68 425.06 991.40 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 195.24 228.96 327.63 395.97 421.93 1011.57 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 180.36 205.26 300.03 399.39 417.79 1029.33 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 167.68 181.18 275.33 402.53 412.61 1044.64 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 157.41 158.71 253.97 403.72 407.88 1057.45 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 137.50 151.90 236.94 398.39 408.37 1067.59 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 122.05 148.14 225.98 392.42 409.12 1074.67 -------------------------------------------------------------------------------- K point *** = 0.078125 0.890625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 114.31 145.48 223.00 388.79 408.73 1078.13 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 95.90 120.48 188.27 392.11 405.95 1090.32 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 107.57 122.74 197.69 395.72 404.88 1086.15 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 125.83 129.95 214.56 399.83 404.18 1078.37 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 137.50 151.90 236.94 398.39 408.37 1067.59 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 151.00 176.81 263.64 395.07 413.11 1054.09 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 166.97 201.15 294.03 391.38 416.84 1038.00 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 184.36 223.86 327.48 387.64 419.46 1019.38 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 202.28 244.54 363.01 384.20 421.19 998.31 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 220.02 263.09 379.83 399.95 423.39 974.89 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.00 279.57 376.82 416.85 444.71 949.28 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.78 294.03 373.91 416.66 483.00 921.73 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.94 306.48 371.38 414.50 522.43 892.58 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.10 316.81 369.39 411.55 561.20 862.42 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.85 324.77 368.14 408.29 597.91 832.33 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.76 330.08 367.70 405.35 629.90 804.84 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.37 332.65 367.76 403.54 650.90 786.10 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.37 332.65 367.76 403.54 650.90 786.10 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.76 330.08 367.70 405.35 629.90 804.84 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.85 324.77 368.14 408.29 597.91 832.33 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.10 316.81 369.39 411.55 561.20 862.42 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.94 306.48 371.38 414.50 522.43 892.58 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.78 294.03 373.91 416.66 483.00 921.73 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.00 279.57 376.82 416.85 444.71 949.28 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 220.02 263.09 379.83 399.95 423.39 974.89 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 202.28 244.54 363.01 384.20 421.19 998.31 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 184.36 223.86 327.48 387.64 419.46 1019.38 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 166.97 201.15 294.03 391.38 416.84 1038.00 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 151.00 176.81 263.64 395.07 413.11 1054.09 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 137.50 151.90 236.94 398.39 408.37 1067.59 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 125.83 129.95 214.56 399.83 404.18 1078.37 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 107.57 122.74 197.69 395.72 404.88 1086.15 -------------------------------------------------------------------------------- K point *** = 0.078125 0.921875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 95.90 120.48 188.27 392.11 405.95 1090.32 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 77.54 96.00 152.50 394.95 403.68 1100.34 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 88.72 100.91 157.56 398.29 404.13 1096.79 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 107.24 110.09 174.26 402.13 404.09 1089.89 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 120.26 131.09 200.09 401.01 407.23 1080.31 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 135.39 153.40 232.16 398.35 409.91 1068.19 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.80 175.03 268.21 395.17 411.51 1053.49 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 171.41 195.75 306.73 391.75 412.12 1036.18 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 190.30 215.42 346.59 388.36 411.91 1016.30 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 208.80 233.97 381.68 389.88 411.63 993.95 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.37 251.31 380.54 406.39 432.29 969.28 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.60 267.35 377.29 404.34 473.01 942.52 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.18 281.92 374.11 400.87 514.14 913.98 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.85 294.78 371.14 396.81 554.40 884.16 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.39 305.47 368.50 392.63 592.73 853.96 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.50 313.43 366.17 389.09 627.14 825.28 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.71 318.11 363.95 387.33 652.97 802.72 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.40 319.38 361.69 388.20 660.97 795.52 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.07 317.46 360.03 391.33 646.15 808.65 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.75 312.54 359.78 395.66 616.71 833.93 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.00 304.94 361.05 400.26 580.61 863.46 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.49 295.05 363.41 404.53 541.38 893.78 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.78 283.16 366.43 408.11 500.63 923.42 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.33 269.42 369.82 410.54 459.50 951.63 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.54 253.86 373.39 407.66 422.67 978.00 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.77 236.48 372.70 378.23 416.23 1002.24 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 177.44 217.23 333.70 381.19 415.70 1024.15 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 158.05 196.06 295.07 384.99 414.55 1043.59 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 139.27 172.95 258.79 388.77 412.39 1060.46 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 122.05 148.14 225.98 392.42 409.12 1074.67 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 107.57 122.74 197.69 395.72 404.88 1086.15 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 95.48 101.27 174.93 397.49 401.23 1094.65 -------------------------------------------------------------------------------- K point *** = 0.078125 0.953125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 80.79 94.97 159.09 395.15 402.24 1099.63 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 63.58 71.63 123.99 397.40 400.61 1107.42 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 73.07 78.87 123.15 400.19 402.40 1104.69 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 90.71 91.28 138.65 403.15 403.41 1098.77 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 105.58 110.17 168.33 402.75 405.04 1090.48 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 122.58 129.92 205.29 400.90 405.80 1079.71 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 141.50 149.95 245.57 398.22 405.81 1066.28 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 161.39 169.89 287.48 395.12 405.11 1050.11 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 181.30 189.47 330.17 391.89 403.70 1031.26 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 200.47 208.62 372.12 389.60 401.66 1009.83 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 218.30 227.24 383.58 398.06 418.67 985.98 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.54 245.09 380.53 394.51 461.23 959.91 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.13 261.76 377.24 390.05 503.75 931.92 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.01 276.81 374.05 384.96 545.31 902.45 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.10 289.73 371.03 379.64 585.06 872.24 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.17 299.87 367.79 375.23 621.49 842.76 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.78 306.51 363.38 373.73 651.13 817.46 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.18 309.11 358.75 375.37 666.22 804.08 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.50 307.80 355.61 379.20 658.60 810.80 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.29 303.12 354.80 384.23 632.82 833.04 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.02 295.71 356.13 389.60 598.08 861.65 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.59 286.04 358.84 394.74 559.10 891.93 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.77 274.42 362.28 399.29 517.93 921.92 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.10 260.99 366.05 403.00 475.63 950.69 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 214.98 245.84 369.96 405.12 433.43 977.72 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 195.72 229.02 373.85 386.61 410.84 1002.69 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 175.61 210.58 344.63 377.80 410.94 1025.37 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 155.01 190.53 302.47 381.59 411.10 1045.58 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 134.36 168.85 261.56 385.27 410.42 1063.20 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 114.31 145.48 223.00 388.79 408.73 1078.13 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 95.90 120.48 188.27 392.11 405.95 1090.32 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 80.79 94.97 159.09 395.15 402.24 1099.63 -------------------------------------------------------------------------------- K point *** = 0.078125 0.984375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 70.49 74.31 137.06 397.40 399.12 1105.64 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 77.53 83.13 152.94 396.38 399.14 1102.55 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 76.76 85.49 143.62 397.54 401.57 1102.47 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 89.36 94.50 145.73 401.34 403.61 1098.19 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 106.86 107.27 162.24 404.59 404.84 1091.04 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 121.60 125.74 190.73 404.40 406.68 1081.59 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 138.23 144.94 225.87 402.72 407.63 1069.75 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 156.56 164.42 264.36 400.16 407.77 1055.34 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 175.64 183.90 304.63 397.18 407.17 1038.28 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.49 203.26 345.73 394.22 405.82 1018.62 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.32 222.38 383.30 394.90 404.13 996.45 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.76 240.96 386.16 400.15 432.07 971.93 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.66 258.58 383.43 396.48 473.75 945.28 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.99 274.78 380.61 392.02 515.26 916.82 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.68 289.10 377.86 387.17 555.75 887.07 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.58 301.01 374.71 382.89 594.22 856.90 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.44 309.90 370.15 380.94 628.72 828.23 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.80 315.18 364.65 381.79 654.63 805.64 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.91 316.66 359.68 384.85 662.75 798.30 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.93 314.67 356.48 389.33 648.05 811.25 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.59 309.74 355.62 394.41 618.59 836.45 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.42 302.35 356.77 399.43 582.34 865.98 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.29 292.79 359.22 403.95 542.85 896.34 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.94 281.26 362.39 407.66 501.77 926.04 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.90 267.81 365.95 410.17 460.20 954.35 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.56 252.46 369.69 407.38 422.77 980.83 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 192.26 235.19 372.68 374.13 415.97 1005.20 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 172.38 215.92 332.75 377.44 415.41 1027.24 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.33 194.57 293.40 381.30 414.23 1046.82 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 132.69 171.03 256.45 385.10 412.04 1063.82 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 114.31 145.48 223.00 388.79 408.73 1078.13 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 98.47 119.04 194.07 392.30 404.43 1089.64 -------------------------------------------------------------------------------- K point *** = 0.109375 0.015625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 86.82 94.92 170.39 395.48 399.96 1098.02 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 76.76 85.49 143.62 397.54 401.57 1102.47 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 66.61 83.20 133.60 395.69 402.68 1105.00 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 73.45 86.15 136.51 397.51 402.91 1103.15 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 91.11 94.73 152.49 400.74 402.68 1097.59 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 104.44 115.96 178.83 399.49 405.58 1089.15 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 120.14 138.70 212.17 396.79 408.04 1078.08 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 138.28 160.68 249.76 393.61 409.44 1064.34 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 157.67 181.72 289.82 390.16 409.87 1047.92 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 177.41 201.74 331.22 386.61 409.46 1028.86 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.84 220.63 372.28 383.80 408.56 1007.27 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.45 238.32 378.65 403.22 419.61 983.28 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.85 254.73 375.13 401.78 460.61 957.11 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.71 269.74 371.58 398.20 502.69 929.05 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.73 283.19 368.20 393.86 543.98 899.53 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.64 294.75 365.18 389.11 583.56 869.29 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.10 303.86 362.78 384.47 619.88 839.79 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.64 309.84 361.07 380.90 649.45 814.50 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.60 312.26 359.77 379.77 664.45 801.21 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.40 311.10 358.82 381.67 656.70 808.08 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.09 306.53 358.95 385.68 630.91 830.42 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.24 298.94 360.49 390.54 596.28 859.06 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.52 288.87 363.12 395.41 557.52 889.31 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.47 276.80 366.39 399.81 516.65 919.23 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.51 263.00 369.97 403.44 474.73 947.92 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 219.02 247.59 373.68 405.54 433.02 974.86 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 200.33 230.63 377.02 387.31 411.10 999.72 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 180.79 212.18 345.22 381.58 411.26 1022.28 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 160.83 192.27 303.84 385.26 411.44 1042.36 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 140.99 170.92 263.72 388.91 410.78 1059.85 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 122.05 148.14 225.98 392.42 409.12 1074.67 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 105.13 124.09 192.09 395.64 406.37 1086.79 -------------------------------------------------------------------------------- K point *** = 0.109375 0.046875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 91.48 100.03 163.94 398.25 402.76 1096.14 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 89.36 94.50 145.73 401.34 403.61 1098.19 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 73.45 86.15 136.51 397.51 402.91 1103.15 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 70.45 82.42 140.81 395.92 401.28 1104.26 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 81.88 87.41 155.59 397.11 400.07 1100.85 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 93.49 108.56 178.18 395.11 403.44 1093.57 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 108.39 134.08 207.03 391.92 407.43 1083.16 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 126.26 159.04 240.89 388.41 410.46 1069.94 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 145.71 182.31 278.38 384.73 412.38 1054.02 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 165.78 203.74 318.24 380.95 413.29 1035.47 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.79 223.38 359.29 377.19 413.42 1014.39 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 205.29 241.29 373.12 398.88 415.17 990.90 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.89 257.45 369.35 407.78 446.71 965.20 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.27 271.88 365.65 405.41 488.49 937.55 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.05 284.53 362.20 401.73 530.07 908.31 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.81 295.29 359.25 397.25 570.35 878.09 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.97 303.96 357.25 392.29 608.01 848.06 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.76 310.17 356.82 387.27 640.41 820.81 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.45 313.44 358.39 382.95 661.28 802.54 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.85 313.35 361.52 380.38 661.08 802.78 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.49 309.53 365.00 380.60 639.98 821.35 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.15 302.04 368.12 383.55 607.57 848.67 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.40 291.43 371.09 387.97 570.00 878.65 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.57 278.41 374.19 392.66 529.84 908.71 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.84 263.54 377.45 396.98 488.34 937.74 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 230.34 247.24 380.76 400.55 446.31 965.11 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.26 229.82 383.48 399.58 408.47 990.47 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.91 211.44 359.07 388.88 406.80 1013.55 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 175.72 192.24 317.57 391.99 408.04 1034.18 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 156.32 172.35 276.51 395.30 408.61 1052.21 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 137.50 151.90 236.94 398.39 408.37 1067.59 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 120.26 131.09 200.09 401.01 407.23 1080.31 -------------------------------------------------------------------------------- K point *** = 0.109375 0.078125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 105.58 110.17 168.33 402.75 405.04 1090.48 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 106.86 107.27 162.24 404.59 404.84 1091.04 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 91.11 94.73 152.49 400.74 402.68 1097.59 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 81.88 87.41 155.59 397.11 400.07 1100.85 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 87.02 87.02 167.93 397.07 397.07 1099.60 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 93.78 105.53 186.85 393.76 400.70 1093.80 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 106.28 130.88 210.93 390.22 405.67 1084.28 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 122.57 157.90 239.58 386.50 410.27 1071.68 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 141.05 183.81 272.35 382.66 413.85 1056.29 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 160.58 207.45 308.55 378.77 416.32 1038.26 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 180.41 228.62 347.17 374.87 417.80 1017.71 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.99 247.43 371.01 386.61 419.03 994.75 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 218.91 264.04 367.24 412.31 433.88 969.56 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.81 278.55 363.64 412.74 473.29 942.35 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.31 291.03 360.34 410.17 514.44 913.46 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.96 301.50 357.59 406.47 554.88 883.39 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.14 309.90 355.82 401.97 593.38 853.05 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.99 316.09 355.69 396.99 627.84 824.40 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.73 319.74 357.86 391.99 653.45 802.16 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.17 320.36 362.35 387.61 660.87 795.65 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.92 317.47 368.42 384.48 645.57 809.38 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.84 310.87 375.12 382.97 616.03 834.87 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.57 300.84 381.75 382.94 580.03 864.37 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.46 287.94 384.02 387.88 540.97 894.51 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.74 272.71 385.82 393.29 500.38 923.85 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.55 255.61 388.00 397.88 459.12 951.69 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.01 237.04 389.73 401.59 418.37 977.59 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.25 217.42 372.82 396.58 404.42 1001.27 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.45 197.20 332.97 398.29 406.38 1022.56 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 176.82 176.97 292.84 401.08 407.52 1041.30 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 157.41 158.71 253.97 403.72 407.88 1057.45 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 139.26 140.55 217.46 405.68 407.51 1071.02 -------------------------------------------------------------------------------- K point *** = 0.109375 0.109375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 122.78 123.06 185.45 406.24 406.47 1082.15 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 121.60 125.74 190.73 404.40 406.68 1081.59 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 104.44 115.96 178.83 399.49 405.58 1089.15 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 93.49 108.56 178.18 395.11 403.44 1093.57 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 93.78 105.53 186.85 393.76 400.70 1093.80 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 104.73 110.36 202.15 394.83 399.10 1089.48 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 115.03 130.63 222.19 392.34 403.19 1081.08 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 128.12 157.10 246.02 388.57 408.86 1069.32 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 144.18 184.61 273.38 384.57 414.02 1054.62 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 162.05 210.77 304.28 380.55 418.15 1037.23 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 180.80 234.32 338.43 376.59 421.18 1017.30 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.71 254.92 372.22 375.45 423.44 994.95 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 218.27 272.69 369.01 409.63 428.33 970.34 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.00 287.89 365.63 419.27 458.19 943.67 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.52 300.70 362.62 418.55 497.72 915.21 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.34 311.28 360.20 416.08 537.62 885.39 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.90 319.65 358.72 412.59 576.34 854.94 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.49 325.73 358.71 408.42 612.15 825.32 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.37 329.38 360.64 403.99 641.39 800.04 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.21 330.42 364.45 399.89 655.94 787.15 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.37 328.54 369.36 396.87 647.54 794.89 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.53 323.43 374.32 395.67 621.62 817.81 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.30 315.06 378.52 396.60 587.53 846.59 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.03 303.80 381.79 399.21 549.85 876.74 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.92 290.15 384.53 402.53 510.51 906.42 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.09 274.59 387.11 405.70 470.59 934.76 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 235.64 257.55 389.52 407.75 431.43 961.29 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 219.74 239.41 384.83 396.47 412.47 985.71 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 202.70 220.48 349.04 396.94 412.91 1007.82 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.08 201.01 311.42 399.75 413.17 1027.48 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 167.68 181.18 275.33 402.53 412.61 1044.64 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 151.49 161.14 241.90 404.85 411.10 1059.32 -------------------------------------------------------------------------------- K point *** = 0.109375 0.140625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 137.37 141.14 212.81 406.25 408.52 1071.60 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 138.23 144.94 225.87 402.72 407.63 1069.75 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 120.14 138.70 212.17 396.79 408.04 1078.08 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 108.39 134.08 207.03 391.92 407.43 1083.16 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 106.28 130.88 210.93 390.22 405.67 1084.28 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 115.03 130.63 222.19 392.34 403.19 1081.08 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 131.15 136.49 238.58 395.58 401.94 1073.82 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 141.99 158.16 258.52 393.74 406.60 1063.03 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 154.54 184.96 281.27 389.93 412.89 1049.18 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 169.71 212.39 306.77 385.85 418.58 1032.58 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 186.53 238.37 335.26 381.85 423.24 1013.41 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 204.10 261.57 366.56 378.26 426.92 991.79 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 221.71 281.47 374.26 400.34 430.58 967.87 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.79 298.13 371.20 423.20 445.63 941.84 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.84 311.88 368.56 426.12 480.90 913.93 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.37 322.96 366.56 425.39 519.23 884.49 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.89 331.54 365.46 423.35 557.43 854.09 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.81 337.61 365.60 420.53 593.84 823.86 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.57 341.23 367.14 417.34 625.65 796.31 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.79 342.58 369.75 414.36 646.39 777.78 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.48 341.76 372.67 412.26 645.81 778.46 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.01 338.48 375.31 411.58 624.45 797.81 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.80 332.45 377.55 412.38 592.62 825.54 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.20 323.67 379.57 414.15 556.48 855.62 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.46 312.41 381.63 416.21 518.60 885.65 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.79 298.98 383.87 417.88 480.37 914.58 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.46 283.60 386.31 417.81 443.61 941.85 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.80 266.42 388.28 401.46 423.94 967.14 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.27 247.53 365.29 393.16 421.92 990.23 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.52 227.07 331.67 396.15 420.29 1010.98 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 180.36 205.26 300.03 399.39 417.79 1029.33 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 165.77 182.59 271.27 402.45 414.19 1045.24 -------------------------------------------------------------------------------- K point *** = 0.109375 0.171875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 153.69 159.90 246.17 404.79 409.63 1058.72 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 156.56 164.42 264.36 400.16 407.77 1055.34 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 138.28 160.68 249.76 393.61 409.44 1064.34 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 126.26 159.04 240.89 388.41 410.46 1069.94 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 122.57 157.90 239.58 386.50 410.27 1071.68 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 128.12 157.10 246.02 388.57 408.86 1069.32 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 141.99 158.16 258.52 393.74 406.60 1063.03 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 161.36 163.42 275.03 398.77 405.51 1053.22 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 170.76 186.66 294.19 397.32 410.80 1040.33 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.51 213.14 315.36 393.61 417.67 1024.64 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.74 240.02 338.59 389.72 423.84 1006.37 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.42 265.51 364.20 386.13 429.03 985.63 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.68 288.19 381.98 393.36 433.54 962.56 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 244.76 307.31 379.51 420.83 440.52 937.32 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.04 322.83 377.31 431.97 465.60 910.10 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.99 335.06 375.79 433.69 500.71 881.18 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.14 344.30 375.10 433.48 537.39 851.04 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.02 350.74 375.39 432.38 573.54 820.48 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.22 354.61 376.58 430.88 606.89 791.31 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.41 356.39 378.09 429.44 632.56 768.12 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.44 356.57 379.22 428.53 640.34 761.01 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.32 355.16 379.64 428.42 624.82 775.34 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.25 351.77 379.65 429.01 595.66 801.52 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.49 345.95 379.79 429.95 561.13 831.43 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.34 337.52 380.43 430.73 524.76 861.84 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.12 326.41 381.65 430.75 488.41 891.42 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.21 312.55 383.46 428.47 454.45 919.54 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.05 295.78 385.70 412.29 435.26 945.82 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.20 276.02 381.39 390.00 430.60 970.01 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.32 253.49 353.65 392.46 426.69 991.96 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 195.24 228.96 327.63 395.97 421.93 1011.57 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 181.95 203.64 304.03 399.54 416.17 1028.73 -------------------------------------------------------------------------------- K point *** = 0.109375 0.203125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 171.43 178.99 282.82 402.44 409.90 1043.37 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 175.64 183.90 304.63 397.18 407.17 1038.28 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 157.67 181.72 289.82 390.16 409.87 1047.92 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 145.71 182.31 278.38 384.73 412.38 1054.02 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 141.05 183.81 272.35 382.66 413.85 1056.29 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 144.18 184.61 273.38 384.57 414.02 1054.62 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 154.54 184.96 281.27 389.93 412.89 1049.18 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 170.76 186.66 294.19 397.32 410.80 1040.33 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 190.05 192.61 310.21 403.80 409.67 1028.43 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.11 215.34 328.11 402.53 415.70 1013.77 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.34 240.76 347.36 399.08 423.07 996.54 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.76 266.62 368.00 395.70 429.67 976.86 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.37 291.33 388.94 394.32 435.42 954.83 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.24 313.34 389.55 415.68 441.22 930.58 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.59 331.62 387.85 434.69 454.64 904.26 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.82 345.96 386.82 440.30 483.52 876.09 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.41 356.65 386.53 442.24 517.22 846.42 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.97 364.11 386.92 443.08 552.07 815.85 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.18 368.83 387.74 443.47 585.88 785.63 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.80 371.39 388.44 443.80 615.08 758.84 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.67 372.44 388.43 444.28 631.09 743.81 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.66 372.37 387.41 444.93 623.22 751.11 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.75 371.27 385.49 445.55 597.37 774.90 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.04 368.70 383.25 445.84 564.45 804.47 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.78 363.66 381.59 445.40 529.46 835.27 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.31 355.23 381.10 443.74 494.94 865.59 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.09 342.79 381.71 439.25 463.94 894.63 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.62 325.79 383.24 423.96 445.72 921.98 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.51 304.09 385.40 400.54 438.52 947.35 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.46 278.64 377.51 389.39 432.16 970.55 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.31 251.27 357.78 392.68 425.06 991.40 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.04 223.93 339.11 396.50 417.18 1009.76 -------------------------------------------------------------------------------- K point *** = 0.109375 0.234375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.61 198.30 321.33 399.72 409.39 1025.47 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.49 203.26 345.73 394.22 405.82 1018.62 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 177.41 201.74 331.22 386.61 409.46 1028.86 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 165.78 203.74 318.24 380.95 413.29 1035.47 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 160.58 207.45 308.55 378.77 416.32 1038.26 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 162.05 210.77 304.28 380.55 418.15 1037.23 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 169.71 212.39 306.77 385.85 418.58 1032.58 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.51 213.14 315.36 393.61 417.67 1024.64 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.11 215.34 328.11 402.53 415.70 1013.77 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.69 223.43 343.18 410.29 414.32 1000.23 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.86 243.56 359.48 408.92 421.24 984.19 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.97 267.15 376.52 405.95 429.02 965.77 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.80 291.52 394.03 403.72 435.97 945.03 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.39 315.13 400.27 414.69 442.33 922.04 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.81 336.31 399.20 433.88 450.40 896.90 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.28 353.72 398.69 444.76 469.74 869.77 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.26 366.94 398.79 449.07 498.41 840.91 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.34 376.40 399.25 451.83 530.50 810.72 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.27 382.80 399.64 454.08 563.56 780.02 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.88 386.78 399.64 456.15 594.80 750.75 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.05 388.62 399.24 458.08 618.03 728.57 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.68 388.43 398.66 459.70 620.17 726.31 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.71 386.75 397.73 460.74 599.02 746.14 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.09 384.47 395.74 460.86 567.78 775.08 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.94 382.34 391.85 459.70 533.87 806.27 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.50 380.40 385.32 456.78 500.87 837.37 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.21 371.97 381.44 450.69 472.59 867.40 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.59 353.96 381.72 437.13 455.51 895.87 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.29 329.42 383.20 420.06 446.10 922.44 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.03 301.00 385.51 404.93 437.23 946.85 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.66 271.58 386.39 393.09 427.66 968.90 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.13 243.27 375.00 394.07 417.57 988.37 -------------------------------------------------------------------------------- K point *** = 0.109375 0.265625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 207.23 217.70 360.58 397.27 408.14 1005.03 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.32 222.38 383.30 394.90 404.13 996.45 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.84 220.63 372.28 383.80 408.56 1007.27 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.79 223.38 359.29 377.19 413.42 1014.39 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 180.41 228.62 347.17 374.87 417.80 1017.71 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 180.80 234.32 338.43 376.59 421.18 1017.30 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 186.53 238.37 335.26 381.85 423.24 1013.41 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.74 240.02 338.59 389.72 423.84 1006.37 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.34 240.76 347.36 399.08 423.07 996.54 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.86 243.56 359.48 408.92 421.24 984.19 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 239.82 252.89 373.26 417.98 419.30 969.51 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.43 270.60 387.67 416.09 427.48 952.56 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.71 291.75 402.13 414.07 435.45 933.37 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.14 314.13 410.75 418.96 442.60 911.96 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.77 336.31 410.51 434.14 449.66 888.38 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.65 356.53 410.57 447.33 461.23 862.70 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.10 373.17 411.14 453.90 482.83 835.08 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.70 385.72 411.75 458.21 510.35 805.79 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.22 394.82 411.78 461.91 541.13 775.31 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.53 401.25 410.93 465.34 572.79 744.75 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.60 404.27 410.49 468.45 601.29 717.22 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.42 402.09 412.71 471.02 615.57 703.27 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.97 397.75 414.90 472.76 602.40 715.92 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.23 392.94 415.60 473.33 573.45 743.63 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.18 388.45 413.90 472.38 540.57 775.18 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.94 384.83 408.41 469.39 508.80 807.10 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.78 382.42 396.76 463.01 482.91 838.15 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.18 376.73 381.40 451.39 467.57 867.74 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.76 349.76 381.72 439.12 457.47 895.47 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.27 319.71 383.33 428.52 447.16 921.04 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.55 289.64 385.97 418.67 435.54 944.18 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.51 261.48 389.04 409.35 422.60 964.64 -------------------------------------------------------------------------------- K point *** = 0.109375 0.296875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.71 236.87 389.85 402.84 408.79 982.15 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.76 240.96 386.16 400.15 432.07 971.93 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.45 238.32 378.65 403.22 419.61 983.28 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 205.29 241.29 373.12 398.88 415.17 990.90 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.99 247.43 371.01 386.61 419.03 994.75 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.71 254.92 372.22 375.45 423.44 994.95 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 204.10 261.57 366.56 378.26 426.92 991.79 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.42 265.51 364.20 386.13 429.03 985.63 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.76 266.62 368.00 395.70 429.67 976.86 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.97 267.15 376.52 405.95 429.02 965.77 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.43 270.60 387.67 416.09 427.48 952.56 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.01 280.34 399.84 424.45 426.76 937.28 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.53 295.76 412.02 423.64 434.68 919.92 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.05 314.07 420.47 426.34 442.42 900.46 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.24 333.99 421.03 437.89 449.45 878.86 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.94 354.45 421.72 449.86 457.34 855.12 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.18 373.67 422.92 457.55 471.95 829.31 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.48 389.90 423.94 462.55 493.41 801.57 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.61 402.63 423.97 466.86 520.11 772.16 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.52 412.51 422.45 470.78 550.34 741.64 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.26 418.67 420.93 474.28 581.43 711.38 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.92 414.24 426.80 477.22 607.23 686.57 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.60 408.36 431.16 479.43 608.94 685.59 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.34 401.88 433.18 480.70 584.47 710.54 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.16 395.45 431.95 480.69 553.52 742.40 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.06 389.70 425.99 478.53 524.06 775.17 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.13 385.17 413.11 472.11 501.82 807.24 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.69 382.06 392.08 460.63 489.73 837.90 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.26 364.24 381.32 448.14 482.24 866.70 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.55 334.63 381.69 436.11 474.92 893.31 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.40 305.40 383.63 424.18 466.40 917.42 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.69 278.40 386.71 412.47 456.35 938.74 -------------------------------------------------------------------------------- K point *** = 0.109375 0.328125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.83 255.34 389.57 402.36 444.78 957.00 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.66 258.58 383.43 396.48 473.75 945.28 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.85 254.73 375.13 401.78 460.61 957.11 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.89 257.45 369.35 407.78 446.71 965.20 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 218.91 264.04 367.24 412.31 433.88 969.56 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 218.27 272.69 369.01 409.63 428.33 970.34 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 221.71 281.47 374.26 400.34 430.58 967.87 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.68 288.19 381.98 393.36 433.54 962.56 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.37 291.33 388.94 394.32 435.42 954.83 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.80 291.52 394.03 403.72 435.97 945.03 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.71 291.75 402.13 414.07 435.45 933.37 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.53 295.76 412.02 423.64 434.68 919.92 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.90 305.25 422.30 429.62 436.72 904.66 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.93 318.42 429.27 433.47 443.52 887.50 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.58 333.69 430.03 443.03 450.45 868.32 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.65 350.78 431.36 453.13 456.63 847.06 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.43 369.28 433.39 461.46 465.38 823.69 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.92 387.65 435.20 466.07 480.90 798.26 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.91 404.06 435.72 469.94 502.11 770.88 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.48 417.81 434.33 473.16 528.92 741.81 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.82 428.49 431.61 475.74 559.61 711.58 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.13 425.40 438.63 477.76 591.44 681.61 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.62 418.87 444.87 479.54 615.17 660.39 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.48 411.37 447.18 481.40 602.32 676.28 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.78 403.50 444.51 482.90 574.53 708.46 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.55 395.92 436.18 482.12 548.67 742.15 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.77 389.30 421.53 476.29 530.16 775.18 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.54 384.05 400.59 465.11 520.15 806.78 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.20 373.15 382.55 451.68 514.47 836.51 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.34 346.09 380.79 437.83 509.38 863.99 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.76 318.85 381.63 423.97 503.19 888.90 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.32 293.79 384.17 410.48 495.25 910.94 -------------------------------------------------------------------------------- K point *** = 0.109375 0.359375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.48 272.61 387.26 398.70 485.40 929.82 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.99 274.78 380.61 392.02 515.26 916.82 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.71 269.74 371.58 398.20 502.69 929.05 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.27 271.88 365.65 405.41 488.49 937.55 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.81 278.55 363.64 412.74 473.29 942.35 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.00 287.89 365.63 419.27 458.19 943.67 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.79 298.13 371.20 423.20 445.63 941.84 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 244.76 307.31 379.51 420.83 440.52 937.32 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.24 313.34 389.55 415.68 441.22 930.58 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.39 315.13 400.27 414.69 442.33 922.04 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.14 314.13 410.75 418.96 442.60 911.96 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.05 314.07 420.47 426.34 442.42 900.46 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.93 318.42 429.27 433.47 443.52 887.50 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.20 327.16 434.62 439.57 448.44 872.93 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.43 338.09 436.26 447.02 455.04 856.60 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.00 350.28 438.33 454.31 461.14 838.35 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.01 364.29 441.46 461.93 466.33 818.06 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.83 380.76 444.64 469.54 472.94 795.70 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.38 398.54 446.20 472.82 488.01 771.31 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.90 415.61 445.37 474.67 509.83 745.03 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.92 430.42 442.74 475.30 537.38 717.14 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.82 434.92 446.25 474.78 568.93 688.08 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.97 428.76 455.36 474.04 602.60 658.70 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.64 420.77 457.50 476.39 625.47 641.67 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.05 411.95 451.52 480.93 600.69 674.49 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.30 402.97 440.35 482.36 578.03 709.14 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.39 394.48 424.61 477.75 562.23 742.88 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.29 387.02 404.75 467.19 553.51 775.15 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.11 377.29 385.76 453.24 548.86 805.51 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.21 354.40 380.73 438.09 545.15 833.60 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.28 329.96 380.02 422.74 540.57 859.07 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.19 307.36 381.68 407.85 534.25 881.62 -------------------------------------------------------------------------------- K point *** = 0.109375 0.390625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.60 288.21 384.87 394.49 525.83 900.95 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.68 289.10 377.86 387.17 555.75 887.07 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.73 283.19 368.20 393.86 543.98 899.53 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.05 284.53 362.20 401.73 530.07 908.31 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.31 291.03 360.34 410.17 514.44 913.46 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.52 300.70 362.62 418.55 497.72 915.21 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.84 311.88 368.56 426.12 480.90 913.93 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.04 322.83 377.31 431.97 465.60 910.10 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.59 331.62 387.85 434.69 454.64 904.26 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.81 336.31 399.20 433.88 450.40 896.90 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.77 336.31 410.51 434.14 449.66 888.38 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.24 333.99 421.03 437.89 449.45 878.86 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.58 333.69 430.03 443.03 450.45 868.32 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.43 338.09 436.26 447.02 455.04 856.60 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.68 345.73 439.24 451.88 461.24 843.47 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.89 354.43 441.63 457.27 466.91 828.69 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.13 363.64 445.42 462.30 471.47 812.06 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.97 374.52 450.52 467.78 474.83 793.47 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.72 389.00 454.37 475.62 478.40 772.92 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.08 406.39 454.68 477.14 493.72 750.51 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.08 423.97 452.18 476.33 516.28 726.51 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.66 438.08 449.68 473.72 543.89 701.41 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.40 437.18 458.41 469.11 574.74 676.06 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.73 429.43 462.06 470.00 606.35 652.54 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.97 420.14 452.48 478.20 620.37 649.61 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.32 410.19 439.94 481.17 605.28 679.94 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.90 400.19 424.33 477.50 592.94 712.74 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.67 390.60 406.17 467.59 586.02 744.68 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.58 379.21 389.19 453.58 582.59 774.98 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.75 359.87 381.46 437.67 580.18 803.14 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.66 338.60 378.74 421.27 577.05 828.75 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.16 318.72 379.09 405.31 572.21 851.47 -------------------------------------------------------------------------------- K point *** = 0.109375 0.421875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.10 301.69 381.98 390.62 565.17 870.99 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.58 301.01 374.71 382.89 594.22 856.90 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.64 294.75 365.18 389.11 583.56 869.29 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.81 295.29 359.25 397.25 570.35 878.09 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.96 301.50 357.59 406.47 554.88 883.39 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.34 311.28 360.20 416.08 537.62 885.39 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.37 322.96 366.56 425.39 519.23 884.49 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.99 335.06 375.79 433.69 500.71 881.18 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.82 345.96 386.82 440.30 483.52 876.09 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.28 353.72 398.69 444.76 469.74 869.77 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.65 356.53 410.57 447.33 461.23 862.70 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.94 354.45 421.72 449.86 457.34 855.12 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.65 350.78 431.36 453.13 456.63 847.06 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.00 350.28 438.33 454.31 461.14 838.35 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.89 354.43 441.63 457.27 466.91 828.69 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.19 360.70 443.26 461.75 472.09 817.76 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.22 367.20 445.93 465.87 476.16 805.27 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.81 373.61 450.89 469.04 478.94 791.03 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.24 381.52 457.60 472.30 480.41 774.97 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.61 394.17 461.33 479.87 481.52 757.18 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.61 410.97 459.72 479.06 497.58 737.97 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.19 427.93 455.43 476.32 519.66 717.91 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.61 439.56 451.74 472.79 545.42 698.02 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.54 436.43 453.17 472.17 572.62 680.25 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.43 427.42 447.33 476.80 597.12 668.94 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.61 416.94 436.06 479.29 610.81 672.82 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.29 405.78 421.80 475.98 612.59 693.37 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.56 394.12 405.93 466.71 611.79 720.34 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.36 380.37 391.70 453.09 611.66 748.19 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.64 362.95 382.59 437.05 611.62 774.95 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.63 344.63 377.64 420.19 610.54 799.70 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.03 327.44 376.13 403.67 607.58 821.86 -------------------------------------------------------------------------------- K point *** = 0.109375 0.453125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.81 312.52 377.59 388.64 602.22 841.03 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.44 309.90 370.15 380.94 628.72 828.23 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.10 303.86 362.78 384.47 619.88 839.79 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.97 303.96 357.25 392.29 608.01 848.06 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.14 309.90 355.82 401.97 593.38 853.05 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.90 319.65 358.72 412.59 576.34 854.94 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.89 331.54 365.46 423.35 557.43 854.09 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.14 344.30 375.10 433.48 537.39 851.04 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.41 356.65 386.53 442.24 517.22 846.42 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.26 366.94 398.79 449.07 498.41 840.91 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.10 373.17 411.14 453.90 482.83 835.08 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.18 373.67 422.92 457.55 471.95 829.31 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.43 369.28 433.39 461.46 465.38 823.69 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.01 364.29 441.46 461.93 466.33 818.06 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.13 363.64 445.42 462.30 471.47 812.06 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.22 367.20 445.93 465.87 476.16 805.27 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.65 371.90 446.45 469.79 479.86 797.29 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.37 376.20 449.05 472.60 482.31 787.82 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.99 380.06 454.49 473.97 483.47 776.73 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.50 385.39 461.83 475.09 483.34 764.07 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.09 396.37 464.52 481.89 482.69 750.09 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 364.73 411.91 460.76 479.38 498.44 735.37 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.15 426.58 454.31 476.39 518.49 720.82 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.76 435.02 446.44 474.80 541.07 707.92 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.24 432.55 438.68 476.03 564.39 698.76 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.07 422.66 429.59 476.87 586.18 695.91 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.58 410.42 417.79 473.49 604.17 701.44 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.99 396.43 405.07 464.92 617.46 715.11 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.37 380.75 393.26 452.10 626.76 734.10 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.65 364.26 383.43 436.62 632.99 755.27 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.89 348.11 376.36 420.02 636.42 776.38 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.54 333.19 372.58 403.66 636.95 796.09 -------------------------------------------------------------------------------- K point *** = 0.109375 0.484375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.47 320.18 371.81 389.08 634.41 813.56 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.80 315.18 364.65 381.79 654.63 805.64 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.64 309.84 361.07 380.90 649.45 814.50 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.76 310.17 356.82 387.27 640.41 820.81 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.99 316.09 355.69 396.99 627.84 824.40 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.49 325.73 358.71 408.42 612.15 825.32 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.81 337.61 365.60 420.53 593.84 823.86 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.02 350.74 375.39 432.38 573.54 820.48 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.97 364.11 386.92 443.08 552.07 815.85 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.34 376.40 399.25 451.83 530.50 810.72 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.70 385.72 411.75 458.21 510.35 805.79 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.48 389.90 423.94 462.55 493.41 801.57 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.92 387.65 435.20 466.07 480.90 798.26 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.83 380.76 444.64 469.54 472.94 795.70 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.97 374.52 450.52 467.78 474.83 793.47 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.81 373.61 450.89 469.04 478.94 791.03 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.37 376.20 449.05 472.60 482.31 787.82 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.03 379.14 448.59 475.44 484.56 783.44 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.33 381.28 450.85 476.69 485.57 777.63 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.65 382.85 456.06 476.27 485.34 770.36 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.57 386.16 462.70 475.68 483.91 761.83 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.92 395.63 463.44 481.19 482.32 752.48 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.39 409.11 457.67 478.35 495.95 743.08 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.99 420.26 449.17 475.84 513.31 734.69 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.15 424.55 438.74 474.80 533.24 728.59 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.57 421.03 426.94 473.92 554.90 726.01 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.74 410.48 415.73 470.30 577.05 727.73 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.02 395.80 405.01 462.52 598.25 733.72 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.63 380.01 393.95 450.91 617.23 743.27 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.65 364.26 383.43 436.62 632.99 755.27 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.11 349.38 374.62 421.02 644.85 768.54 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.23 335.94 368.61 405.49 652.45 781.97 -------------------------------------------------------------------------------- K point *** = 0.109375 0.515625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.59 324.32 365.79 391.53 655.69 794.60 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.91 316.66 359.68 384.85 662.75 798.30 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.60 312.26 359.77 379.77 664.45 801.21 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.45 313.44 358.39 382.95 661.28 802.54 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.73 319.74 357.86 391.99 653.45 802.16 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.37 329.38 360.64 403.99 641.39 800.04 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.57 341.23 367.14 417.34 625.65 796.31 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.22 354.61 376.58 430.88 606.89 791.31 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.18 368.83 387.74 443.47 585.88 785.63 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.27 382.80 399.64 454.08 563.56 780.02 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.22 394.82 411.78 461.91 541.13 775.31 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.61 402.63 423.97 466.86 520.11 772.16 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.91 404.06 435.72 469.94 502.11 770.88 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.38 398.54 446.20 472.82 488.01 771.31 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.72 389.00 454.37 475.62 478.40 772.92 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.24 381.52 457.60 472.30 480.41 774.97 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.99 380.06 454.49 473.97 483.47 776.73 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.33 381.28 450.85 476.69 485.57 777.63 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.34 382.28 449.54 478.03 486.49 777.29 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.13 382.30 451.21 477.54 486.20 775.55 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.76 381.92 455.53 475.49 484.72 772.50 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.38 383.84 460.12 473.95 482.18 768.48 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.19 391.96 458.27 477.99 480.23 764.06 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.72 402.86 450.82 475.31 491.04 760.00 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.86 410.18 440.86 472.71 506.07 757.21 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.95 410.45 429.42 470.44 524.56 756.45 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.72 403.74 417.41 466.66 545.81 758.16 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.69 392.02 405.56 459.81 568.37 762.24 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.24 377.77 393.88 449.70 590.73 768.11 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.64 362.95 382.59 437.05 611.62 774.95 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.03 348.77 372.55 422.98 630.04 781.94 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.54 335.98 364.92 408.69 645.13 788.43 -------------------------------------------------------------------------------- K point *** = 0.109375 0.546875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.42 325.04 360.67 395.44 656.21 793.98 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.93 314.67 356.48 389.33 648.05 811.25 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.40 311.10 358.82 381.67 656.70 808.08 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.85 313.35 361.52 380.38 661.08 802.78 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.17 320.36 362.35 387.61 660.87 795.65 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.21 330.42 364.45 399.89 655.94 787.15 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.79 342.58 369.75 414.36 646.39 777.78 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.41 356.39 378.09 429.44 632.56 768.12 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.80 371.39 388.44 443.80 615.08 758.84 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.88 386.78 399.64 456.15 594.80 750.75 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.53 401.25 410.93 465.34 572.79 744.75 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.52 412.51 422.45 470.78 550.34 741.64 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.48 417.81 434.33 473.16 528.92 741.81 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.90 415.61 445.37 474.67 509.83 745.03 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.08 406.39 454.68 477.14 493.72 750.51 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.61 394.17 461.33 479.87 481.52 757.18 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.50 385.39 461.83 475.09 483.34 764.07 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.65 382.85 456.06 476.27 485.34 770.36 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.13 382.30 451.21 477.54 486.20 775.55 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.57 381.23 449.22 477.16 485.85 779.35 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.75 379.24 450.12 475.02 484.28 781.75 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.34 377.28 452.93 471.79 481.56 782.95 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.09 378.42 454.37 470.23 477.97 783.36 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.24 385.27 449.77 472.79 475.97 783.54 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.09 393.47 440.94 469.71 484.65 784.15 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.09 397.30 430.04 466.49 497.93 785.75 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.50 394.39 418.04 462.69 515.43 788.69 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.07 385.73 405.67 456.88 536.09 792.90 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.34 373.54 393.34 448.44 558.17 797.95 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.75 359.87 381.46 437.67 580.18 803.14 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.59 346.21 370.76 425.37 600.95 807.68 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.06 333.57 362.37 412.52 619.63 810.86 -------------------------------------------------------------------------------- K point *** = 0.109375 0.578125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.22 322.72 357.43 400.13 635.52 812.16 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.59 309.74 355.62 394.41 618.59 836.45 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.09 306.53 358.95 385.68 630.91 830.42 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.49 309.53 365.00 380.60 639.98 821.35 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.92 317.47 368.42 384.48 645.57 809.38 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.37 328.54 369.36 396.87 647.54 794.89 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.48 341.76 372.67 412.26 645.81 778.46 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.44 356.57 379.22 428.53 640.34 761.01 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.67 372.44 388.43 444.28 631.09 743.81 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.05 388.62 399.24 458.08 618.03 728.57 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.60 404.27 410.49 468.45 601.29 717.22 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.26 418.67 420.93 474.28 581.43 711.38 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.82 428.49 431.61 475.74 559.61 711.58 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.92 430.42 442.74 475.30 537.38 717.14 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.08 423.97 452.18 476.33 516.28 726.51 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.61 410.97 459.72 479.06 497.58 737.97 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.09 396.37 464.52 481.89 482.69 750.09 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.57 386.16 462.70 475.68 483.91 761.83 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.76 381.92 455.53 475.49 484.72 772.50 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.75 379.24 450.12 475.02 484.28 781.75 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.73 376.02 447.66 472.96 482.57 789.46 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.19 372.18 447.64 469.51 479.62 795.71 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.40 369.06 448.38 465.84 475.58 800.79 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.93 369.82 446.18 465.01 470.95 805.11 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.54 375.43 439.13 465.82 469.35 809.16 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.93 381.05 429.14 461.99 476.68 813.39 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.13 381.87 417.59 458.31 488.41 818.08 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.26 376.59 405.26 453.62 504.72 823.25 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.10 366.73 392.77 446.92 524.25 828.61 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.21 354.40 380.73 438.09 545.15 833.60 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.04 341.31 369.95 427.62 565.96 837.51 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.90 328.74 361.49 416.29 585.62 839.66 -------------------------------------------------------------------------------- K point *** = 0.109375 0.609375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.85 317.77 356.47 404.93 603.35 839.45 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.42 302.35 356.77 399.43 582.34 865.98 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.24 298.94 360.49 390.54 596.28 859.06 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.15 302.04 368.12 383.55 607.57 848.67 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.84 310.87 375.12 382.97 616.03 834.87 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.53 323.43 374.32 395.67 621.62 817.81 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.01 338.48 375.31 411.58 624.45 797.81 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.32 355.16 379.64 428.42 624.82 775.34 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.66 372.37 387.41 444.93 623.22 751.11 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.68 388.43 398.66 459.70 620.17 726.31 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.42 402.09 412.71 471.02 615.57 703.27 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.92 414.24 426.80 477.22 607.23 686.57 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.13 425.40 438.63 477.76 591.44 681.61 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.82 434.92 446.25 474.78 568.93 688.08 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.66 438.08 449.68 473.72 543.89 701.41 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.19 427.93 455.43 476.32 519.66 717.91 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 364.73 411.91 460.76 479.38 498.44 735.37 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.92 395.63 463.44 481.19 482.32 752.48 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.38 383.84 460.12 473.95 482.18 768.48 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.34 377.28 452.93 471.79 481.56 782.95 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.19 372.18 447.64 469.51 479.62 795.71 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.81 366.78 444.97 466.03 476.37 806.78 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.45 361.27 443.92 461.77 471.92 816.32 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.99 357.38 442.05 458.48 466.61 824.65 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.23 357.95 436.48 458.33 461.19 832.11 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.54 362.28 427.54 456.18 461.32 839.08 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.74 365.50 416.68 452.70 466.75 845.81 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.46 363.79 404.79 449.38 476.61 852.37 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.75 356.74 392.58 444.62 491.36 858.57 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.34 346.09 380.79 437.83 509.38 863.99 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.83 333.81 370.31 429.26 528.74 868.04 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.62 321.49 362.17 419.52 547.97 870.09 -------------------------------------------------------------------------------- K point *** = 0.109375 0.640625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.89 310.51 357.41 409.33 566.07 869.56 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.29 292.79 359.22 403.95 542.85 896.34 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.52 288.87 363.12 395.41 557.52 889.31 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.40 291.43 371.09 387.97 570.00 878.65 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.57 300.84 381.75 382.94 580.03 864.37 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.30 315.06 378.52 396.60 587.53 846.59 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.80 332.45 377.55 412.38 592.62 825.54 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.25 351.77 379.65 429.01 595.66 801.52 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.75 371.27 385.49 445.55 597.37 774.90 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.71 386.75 397.73 460.74 599.02 746.14 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.97 397.75 414.90 472.76 602.40 715.92 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.60 408.36 431.16 479.43 608.94 685.59 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.62 418.87 444.87 479.54 615.17 660.39 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.97 428.76 455.36 474.04 602.60 658.70 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.40 437.18 458.41 469.11 574.74 676.06 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.61 439.56 451.74 472.79 545.42 698.02 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.15 426.58 454.31 476.39 518.49 720.82 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.39 409.11 457.67 478.35 495.95 743.08 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.19 391.96 458.27 477.99 480.23 764.06 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.09 378.42 454.37 470.23 477.97 783.36 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.40 369.06 448.38 465.84 475.58 800.79 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.45 361.27 443.92 461.77 471.92 816.32 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.81 353.68 441.34 457.04 467.03 830.05 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.55 346.70 439.08 452.40 461.20 842.18 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.19 342.38 434.30 449.41 455.49 852.97 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.31 342.79 426.19 446.08 452.94 862.71 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.66 345.78 416.02 442.50 453.45 871.61 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.98 346.79 404.71 441.15 455.68 879.78 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.63 342.98 393.01 439.95 462.33 887.12 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.55 334.63 381.69 436.11 474.92 893.31 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.45 323.63 371.67 429.79 491.20 897.87 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.89 311.89 363.98 421.83 508.87 900.25 -------------------------------------------------------------------------------- K point *** = 0.109375 0.671875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.18 301.08 359.59 412.97 526.42 899.88 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.94 281.26 362.39 407.66 501.77 926.04 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.47 276.80 366.39 399.81 516.65 919.23 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.57 278.41 374.19 392.66 529.84 908.71 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.46 287.94 384.02 387.88 540.97 894.51 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.03 303.80 381.79 399.21 549.85 876.74 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.20 323.67 379.57 414.15 556.48 855.62 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.49 345.95 379.79 429.95 561.13 831.43 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.04 368.70 383.25 445.84 564.45 804.47 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.09 384.47 395.74 460.86 567.78 775.08 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.23 392.94 415.60 473.33 573.45 743.63 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.34 401.88 433.18 480.70 584.47 710.54 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.48 411.37 447.18 481.40 602.32 676.28 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.64 420.77 457.50 476.39 625.47 641.67 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.73 429.43 462.06 470.00 606.35 652.54 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.54 436.43 453.17 472.17 572.62 680.25 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.76 435.02 446.44 474.80 541.07 707.92 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.99 420.26 449.17 475.84 513.31 734.69 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.72 402.86 450.82 475.31 491.04 760.00 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.24 385.27 449.77 472.79 475.97 783.54 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.93 369.82 446.18 465.01 470.95 805.11 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.99 357.38 442.05 458.48 466.61 824.65 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.55 346.70 439.08 452.40 461.20 842.18 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.80 336.88 436.99 446.17 454.91 857.83 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.55 328.66 433.11 440.75 448.95 871.77 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.18 324.24 425.52 435.09 446.22 884.21 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.50 324.43 415.93 428.77 446.00 895.33 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.32 326.08 405.26 424.85 445.94 905.24 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.20 325.14 394.13 425.37 445.59 913.88 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.27 319.71 383.33 428.52 447.16 921.04 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.41 310.63 373.79 427.77 455.73 926.32 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.30 299.92 366.53 422.63 469.86 929.23 -------------------------------------------------------------------------------- K point *** = 0.109375 0.703125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 244.42 289.55 362.51 415.53 485.83 929.28 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.90 267.81 365.95 410.17 460.20 954.35 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.51 263.00 369.97 403.44 474.73 947.92 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.84 263.54 377.45 396.98 488.34 937.74 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.74 272.71 385.82 393.29 500.38 923.85 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.92 290.15 384.53 402.53 510.51 906.42 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.46 312.41 381.63 416.21 518.60 885.65 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.34 337.52 380.43 430.73 524.76 861.84 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.78 363.66 381.59 445.40 529.46 835.27 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.94 382.34 391.85 459.70 533.87 806.27 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.18 388.45 413.90 472.38 540.57 775.18 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.16 395.45 431.95 480.69 553.52 742.40 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.78 403.50 444.51 482.90 574.53 708.46 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.05 411.95 451.52 480.93 600.69 674.49 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.97 420.14 452.48 478.20 620.37 649.61 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.43 427.42 447.33 476.80 597.12 668.94 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.24 432.55 438.68 476.03 564.39 698.76 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.15 424.55 438.74 474.80 533.24 728.59 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.86 410.18 440.86 472.71 506.07 757.21 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.09 393.47 440.94 469.71 484.65 784.15 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.54 375.43 439.13 465.82 469.35 809.16 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.23 357.95 436.48 458.33 461.19 832.11 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.19 342.38 434.30 449.41 455.49 852.97 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.55 328.66 433.11 440.75 448.95 871.77 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.89 316.60 431.66 432.15 442.31 888.60 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.58 307.44 422.27 427.65 438.83 903.60 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.21 303.22 412.93 419.02 438.86 916.90 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.22 303.14 404.36 409.68 439.25 928.58 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.04 303.52 395.42 403.90 438.82 938.62 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.03 301.00 385.51 404.93 437.23 946.85 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.19 294.53 376.47 411.36 435.06 952.97 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.35 285.45 369.59 417.56 436.07 956.55 -------------------------------------------------------------------------------- K point *** = 0.109375 0.734375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.14 275.88 365.87 415.93 446.07 957.14 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.56 252.46 369.69 407.38 422.77 980.83 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 219.02 247.59 373.68 405.54 433.02 974.86 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 230.34 247.24 380.76 400.55 446.31 965.11 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.55 255.61 388.00 397.88 459.12 951.69 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.09 274.59 387.11 405.70 470.59 934.76 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.79 298.98 383.87 417.88 480.37 914.58 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.12 326.41 381.65 430.75 488.41 891.42 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.31 355.23 381.10 443.74 494.94 865.59 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.50 380.40 385.32 456.78 500.87 837.37 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.94 384.83 408.41 469.39 508.80 807.10 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.06 389.70 425.99 478.53 524.06 775.17 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.55 395.92 436.18 482.12 548.67 742.15 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.30 402.97 440.35 482.36 578.03 709.14 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.32 410.19 439.94 481.17 605.28 679.94 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.61 416.94 436.06 479.29 610.81 672.82 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.07 422.66 429.59 476.87 586.18 695.91 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.57 421.03 426.94 473.92 554.90 726.01 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.95 410.45 429.42 470.44 524.56 756.45 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.09 397.30 430.04 466.49 497.93 785.75 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.93 381.05 429.14 461.99 476.68 813.39 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.54 362.28 427.54 456.18 461.32 839.08 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.31 342.79 426.19 446.08 452.94 862.71 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.18 324.24 425.52 435.09 446.22 884.21 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.58 307.44 422.27 427.65 438.83 903.60 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.26 293.15 411.64 427.05 431.57 920.94 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.81 283.46 400.38 419.84 430.93 936.29 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.61 279.71 389.83 409.84 432.18 949.71 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.95 279.32 381.53 399.41 432.77 961.17 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.46 278.64 377.51 389.39 432.16 970.55 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.32 275.02 377.83 382.24 430.11 977.58 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.49 268.22 372.92 388.18 426.77 981.91 -------------------------------------------------------------------------------- K point *** = 0.109375 0.765625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 208.74 259.98 369.48 399.01 422.92 983.11 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 192.26 235.19 372.68 374.13 415.97 1005.20 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 200.33 230.63 377.02 387.31 411.10 999.72 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.26 229.82 383.48 399.58 408.47 990.47 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.01 237.04 389.73 401.59 418.37 977.59 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 235.64 257.55 389.52 407.75 431.43 961.29 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.46 283.60 386.31 417.81 443.61 941.85 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.21 312.55 383.46 428.47 454.45 919.54 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.09 342.79 381.71 439.25 463.94 894.63 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.21 371.97 381.44 450.69 472.59 867.40 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.78 382.42 396.76 463.01 482.91 838.15 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.13 385.17 413.11 472.11 501.82 807.24 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.77 389.30 421.53 476.29 530.16 775.18 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.39 394.48 424.61 477.75 562.23 742.88 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.90 400.19 424.33 477.50 592.94 712.74 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.29 405.78 421.80 475.98 612.59 693.37 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.58 410.42 417.79 473.49 604.17 701.44 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.74 410.48 415.73 470.30 577.05 727.73 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.72 403.74 417.41 466.66 545.81 758.16 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.50 394.39 418.04 462.69 515.43 788.69 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.13 381.87 417.59 458.31 488.41 818.08 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.74 365.50 416.68 452.70 466.75 845.81 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.66 345.78 416.02 442.50 453.45 871.61 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.50 324.43 415.93 428.77 446.00 895.33 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.21 303.22 412.93 419.02 438.86 916.90 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.81 283.46 400.38 419.84 430.93 936.29 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.18 266.90 387.02 421.86 422.24 953.51 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.44 257.27 374.01 412.43 424.26 968.57 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.85 254.15 362.34 402.36 425.98 981.43 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.32 253.49 353.65 392.46 426.69 991.96 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.40 252.06 350.05 383.63 426.05 999.95 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 192.19 247.97 352.83 376.92 423.94 1005.06 -------------------------------------------------------------------------------- K point *** = 0.109375 0.796875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.61 241.67 361.26 373.32 420.47 1006.92 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 172.38 215.92 332.75 377.44 415.41 1027.24 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 180.79 212.18 345.22 381.58 411.26 1022.28 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.91 211.44 359.07 388.88 406.80 1013.55 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.25 217.42 372.82 396.58 404.42 1001.27 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 219.74 239.41 384.83 396.47 412.47 985.71 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.80 266.42 388.28 401.46 423.94 967.14 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.05 295.78 385.70 412.29 435.26 945.82 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.62 325.79 383.24 423.96 445.72 921.98 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.59 353.96 381.72 437.13 455.51 895.87 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.18 376.73 381.40 451.39 467.57 867.74 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.69 382.06 392.08 460.63 489.73 837.90 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.54 384.05 400.59 465.11 520.15 806.78 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.29 387.02 404.75 467.19 553.51 775.15 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.67 390.60 406.17 467.59 586.02 744.68 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.56 394.12 405.93 466.71 611.79 720.34 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.99 396.43 405.07 464.92 617.46 715.11 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.02 395.80 405.01 462.52 598.25 733.72 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.69 392.02 405.56 459.81 568.37 762.24 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.07 385.73 405.67 456.88 536.09 792.90 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.26 376.59 405.26 453.62 504.72 823.25 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.46 363.79 404.79 449.38 476.61 852.37 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.98 346.79 404.71 441.15 455.68 879.78 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.32 326.08 405.26 424.85 445.94 905.24 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.22 303.14 404.36 409.68 439.25 928.58 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.61 279.71 389.83 409.84 432.18 949.71 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.44 257.27 374.01 412.43 424.26 968.57 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.97 238.37 358.62 413.99 416.77 985.12 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.73 229.55 344.16 405.60 418.39 999.30 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.52 227.07 331.67 396.15 420.29 1010.98 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 183.15 226.28 322.93 387.49 421.13 1019.94 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 174.00 224.56 319.96 380.80 420.60 1025.87 -------------------------------------------------------------------------------- K point *** = 0.109375 0.828125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 170.17 220.76 323.62 377.20 418.64 1028.40 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.33 194.57 293.40 381.30 414.23 1046.82 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 160.83 192.27 303.84 385.26 411.44 1042.36 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 175.72 192.24 317.57 391.99 408.04 1034.18 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.45 197.20 332.97 398.29 406.38 1022.56 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 202.70 220.48 349.04 396.94 412.91 1007.82 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.27 247.53 365.29 393.16 421.92 990.23 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.20 276.02 381.39 390.00 430.60 970.01 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.51 304.09 385.40 400.54 438.52 947.35 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.29 329.42 383.20 420.06 446.10 922.44 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.76 349.76 381.72 439.12 457.47 895.47 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.26 364.24 381.32 448.14 482.24 866.70 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.20 373.15 382.55 451.68 514.47 836.51 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.11 377.29 385.76 453.24 548.86 805.51 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.58 379.21 389.19 453.58 582.59 774.98 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.36 380.37 391.70 453.09 611.66 748.19 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.37 380.75 393.26 452.10 626.76 734.10 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.63 380.01 393.95 450.91 617.23 743.27 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.24 377.77 393.88 449.70 590.73 768.11 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.34 373.54 393.34 448.44 558.17 797.95 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.10 366.73 392.77 446.92 524.25 828.61 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.75 356.74 392.58 444.62 491.36 858.57 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.63 342.98 393.01 439.95 462.33 887.12 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.20 325.14 394.13 425.37 445.59 913.88 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.04 303.52 395.42 403.90 438.82 938.62 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.95 279.32 381.53 399.41 432.77 961.17 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.85 254.15 362.34 402.36 425.98 981.43 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.73 229.55 344.16 405.60 418.39 999.30 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 203.03 208.14 327.02 406.88 411.94 1014.70 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.08 201.01 311.42 399.75 413.17 1027.48 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 168.46 199.07 298.53 391.52 415.19 1037.41 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 156.63 198.45 290.21 384.85 416.21 1044.18 -------------------------------------------------------------------------------- K point *** = 0.109375 0.859375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 150.96 197.12 288.36 381.15 415.89 1047.40 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 132.69 171.03 256.45 385.10 412.04 1063.82 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 140.99 170.92 263.72 388.91 410.78 1059.85 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 156.32 172.35 276.51 395.30 408.61 1052.21 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 176.82 176.97 292.84 401.08 407.52 1041.30 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.08 201.01 311.42 399.75 413.17 1027.48 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.52 227.07 331.67 396.15 420.29 1010.98 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.32 253.49 353.65 392.46 426.69 991.96 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.46 278.64 377.51 389.39 432.16 970.55 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.03 301.00 385.51 404.93 437.23 946.85 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.27 319.71 383.33 428.52 447.16 921.04 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.55 334.63 381.69 436.11 474.92 893.31 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.34 346.09 380.79 437.83 509.38 863.99 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.21 354.40 380.73 438.09 545.15 833.60 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.75 359.87 381.46 437.67 580.18 803.14 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.64 362.95 382.59 437.05 611.62 774.95 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.65 364.26 383.43 436.62 632.99 755.27 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.65 364.26 383.43 436.62 632.99 755.27 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.64 362.95 382.59 437.05 611.62 774.95 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.75 359.87 381.46 437.67 580.18 803.14 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.21 354.40 380.73 438.09 545.15 833.60 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.34 346.09 380.79 437.83 509.38 863.99 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.55 334.63 381.69 436.11 474.92 893.31 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.27 319.71 383.33 428.52 447.16 921.04 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.03 301.00 385.51 404.93 437.23 946.85 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.46 278.64 377.51 389.39 432.16 970.55 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.32 253.49 353.65 392.46 426.69 991.96 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.52 227.07 331.67 396.15 420.29 1010.98 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.08 201.01 311.42 399.75 413.17 1027.48 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 176.82 176.97 292.84 401.08 407.52 1041.30 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 156.32 172.35 276.51 395.30 408.61 1052.21 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 140.99 170.92 263.72 388.91 410.78 1059.85 -------------------------------------------------------------------------------- K point *** = 0.109375 0.890625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 132.69 171.03 256.45 385.10 412.04 1063.82 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 114.31 145.48 223.00 388.79 408.73 1078.13 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 122.05 148.14 225.98 392.42 409.12 1074.67 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 137.50 151.90 236.94 398.39 408.37 1067.59 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 157.41 158.71 253.97 403.72 407.88 1057.45 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 167.68 181.18 275.33 402.53 412.61 1044.64 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 180.36 205.26 300.03 399.39 417.79 1029.33 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 195.24 228.96 327.63 395.97 421.93 1011.57 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.31 251.27 357.78 392.68 425.06 991.40 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.66 271.58 386.39 393.09 427.66 968.90 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.55 289.64 385.97 418.67 435.54 944.18 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.40 305.40 383.63 424.18 466.40 917.42 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.76 318.85 381.63 423.97 503.19 888.90 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.28 329.96 380.02 422.74 540.57 859.07 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.66 338.60 378.74 421.27 577.05 828.75 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.63 344.63 377.64 420.19 610.54 799.70 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.89 348.11 376.36 420.02 636.42 776.38 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.11 349.38 374.62 421.02 644.85 768.54 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.03 348.77 372.55 422.98 630.04 781.94 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.59 346.21 370.76 425.37 600.95 807.68 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.04 341.31 369.95 427.62 565.96 837.51 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.83 333.81 370.31 429.26 528.74 868.04 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.45 323.63 371.67 429.79 491.20 897.87 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.41 310.63 373.79 427.77 455.73 926.32 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.19 294.53 376.47 411.36 435.06 952.97 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.32 275.02 377.83 382.24 430.11 977.58 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.40 252.06 350.05 383.63 426.05 999.95 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 183.15 226.28 322.93 387.49 421.13 1019.94 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 168.46 199.07 298.53 391.52 415.19 1037.41 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 156.32 172.35 276.51 395.30 408.61 1052.21 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 145.99 149.94 256.90 396.91 403.64 1064.09 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 128.09 144.21 240.36 392.73 404.79 1072.68 -------------------------------------------------------------------------------- K point *** = 0.109375 0.921875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 116.37 143.67 228.35 388.98 407.16 1077.49 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 98.47 119.04 194.07 392.30 404.43 1089.64 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 105.13 124.09 192.09 395.64 406.37 1086.79 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 120.26 131.09 200.09 401.01 407.23 1080.31 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 139.26 140.55 217.46 405.68 407.51 1071.02 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 151.49 161.14 241.90 404.85 411.10 1059.32 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 165.77 182.59 271.27 402.45 414.19 1045.24 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 181.95 203.64 304.03 399.54 416.17 1028.73 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.04 223.93 339.11 396.50 417.18 1009.76 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.13 243.27 375.00 394.07 417.57 988.37 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.51 261.48 389.04 409.35 422.60 964.64 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.69 278.40 386.71 412.47 456.35 938.74 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.32 293.79 384.17 410.48 495.25 910.94 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.19 307.36 381.68 407.85 534.25 881.62 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.16 318.72 379.09 405.31 572.21 851.47 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.03 327.44 376.13 403.67 607.58 821.86 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.54 333.19 372.58 403.66 636.95 796.09 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.23 335.94 368.61 405.49 652.45 781.97 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.54 335.98 364.92 408.69 645.13 788.43 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.06 333.57 362.37 412.52 619.63 810.86 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.90 328.74 361.49 416.29 585.62 839.66 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.62 321.49 362.17 419.52 547.97 870.09 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.89 311.89 363.98 421.83 508.87 900.25 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.30 299.92 366.53 422.63 469.86 929.23 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.35 285.45 369.59 417.56 436.07 956.55 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.49 268.22 372.92 388.18 426.77 981.91 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 192.19 247.97 352.83 376.92 423.94 1005.06 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 174.00 224.56 319.96 380.80 420.60 1025.87 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 156.63 198.45 290.21 384.85 416.21 1044.18 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 140.99 170.92 263.72 388.91 410.78 1059.85 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 128.09 144.21 240.36 392.73 404.79 1072.68 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 117.21 123.23 220.26 394.86 400.43 1082.31 -------------------------------------------------------------------------------- K point *** = 0.109375 0.953125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 103.37 117.63 204.26 392.68 401.81 1088.15 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 86.82 94.92 170.39 395.48 399.96 1098.02 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 91.48 100.03 163.94 398.25 402.76 1096.14 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 105.58 110.17 168.33 402.75 405.04 1090.48 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 122.78 123.06 185.45 406.24 406.47 1082.15 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 137.37 141.14 212.81 406.25 408.52 1071.60 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 153.69 159.90 246.17 404.79 409.63 1058.72 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 171.43 178.99 282.82 402.44 409.90 1043.37 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.61 198.30 321.33 399.72 409.39 1025.47 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 207.23 217.70 360.58 397.27 408.14 1005.03 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.71 236.87 389.85 402.84 408.79 982.15 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.83 255.34 389.57 402.36 444.78 957.00 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.48 272.61 387.26 398.70 485.40 929.82 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.60 288.21 384.87 394.49 525.83 900.95 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.10 301.69 381.98 390.62 565.17 870.99 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.81 312.52 377.59 388.64 602.22 841.03 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.47 320.18 371.81 389.08 634.41 813.56 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.59 324.32 365.79 391.53 655.69 794.60 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.42 325.04 360.67 395.44 656.21 793.98 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.22 322.72 357.43 400.13 635.52 812.16 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.85 317.77 356.47 404.93 603.35 839.45 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.89 310.51 357.41 409.33 566.07 869.56 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.18 301.08 359.59 412.97 526.42 899.88 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 244.42 289.55 362.51 415.53 485.83 929.28 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.14 275.88 365.87 415.93 446.07 957.14 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 208.74 259.98 369.48 399.01 422.92 983.11 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.61 241.67 361.26 373.32 420.47 1006.92 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 170.17 220.76 323.62 377.20 418.64 1028.40 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 150.96 197.12 288.36 381.15 415.89 1047.40 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 132.69 171.03 256.45 385.10 412.04 1063.82 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 116.37 143.67 228.35 388.98 407.16 1077.49 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 103.37 117.63 204.26 392.68 401.81 1088.15 -------------------------------------------------------------------------------- K point *** = 0.109375 0.984375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 94.40 98.15 184.56 395.57 397.98 1095.25 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 101.48 106.74 200.43 394.42 397.86 1091.15 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 98.61 107.91 188.74 395.25 401.09 1092.06 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 106.91 114.90 184.59 399.40 404.18 1088.53 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 121.60 125.74 190.73 404.40 406.68 1081.59 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 138.44 138.61 208.18 408.08 408.30 1072.17 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.83 156.31 234.43 408.30 410.53 1060.57 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 168.82 174.71 266.05 407.09 411.80 1046.72 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.92 193.63 300.82 405.04 412.19 1030.48 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 203.07 213.01 337.46 402.69 411.78 1011.76 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 219.45 232.57 374.49 401.04 410.69 990.59 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.67 251.79 394.60 406.95 419.17 967.05 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.55 270.07 393.70 404.78 456.68 941.32 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.99 286.90 391.78 401.37 496.15 913.64 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.92 301.83 389.28 398.10 535.42 884.42 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.23 314.39 385.27 396.37 573.54 854.33 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.76 324.13 379.63 396.74 608.99 824.76 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.22 330.70 373.22 398.88 638.43 798.98 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.12 334.02 366.93 402.37 654.06 784.73 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.72 334.31 361.71 406.69 646.95 790.93 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.39 331.92 358.42 411.23 621.51 813.20 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.11 327.12 357.32 415.45 587.38 841.96 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.48 320.02 358.02 418.96 549.51 872.42 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.31 310.66 359.94 421.44 510.07 902.64 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.27 298.94 362.63 422.34 470.62 931.73 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.88 284.68 365.81 417.37 436.25 959.18 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 206.58 267.60 369.32 387.65 426.61 984.67 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 187.80 247.35 351.97 373.13 423.72 1007.98 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 169.05 223.73 318.53 377.08 420.33 1028.94 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 150.96 197.12 288.36 381.15 415.89 1047.40 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 134.36 168.85 261.56 385.27 410.42 1063.20 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 120.37 141.28 237.88 389.34 404.32 1076.08 -------------------------------------------------------------------------------- K point *** = 0.140625 0.015625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 110.18 117.91 217.29 393.16 398.78 1085.62 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 98.61 107.91 188.74 395.25 401.09 1092.06 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 88.23 106.38 176.13 393.33 403.21 1095.37 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 90.72 109.77 172.11 394.99 404.91 1094.24 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 104.44 115.96 178.83 399.49 405.58 1089.15 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 123.33 125.40 195.98 403.79 405.70 1081.01 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 135.98 146.19 221.16 402.81 409.08 1070.34 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 150.65 168.07 251.90 400.26 411.97 1057.21 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 167.42 189.39 286.34 397.17 413.76 1041.59 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.26 209.85 323.20 393.89 414.56 1023.42 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 203.28 229.29 361.27 390.83 414.60 1002.76 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 220.76 247.62 385.59 400.62 415.82 979.70 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.17 264.71 383.26 409.36 444.66 954.40 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.13 280.42 380.35 407.20 484.57 927.09 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.36 294.53 377.56 404.03 524.67 898.13 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.67 306.68 374.91 400.53 563.83 868.10 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.86 316.41 372.32 397.37 600.76 838.11 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.65 323.20 369.56 395.47 632.88 810.63 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.59 326.77 366.45 395.68 654.06 791.75 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.06 327.26 363.36 398.03 654.42 791.33 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.62 324.94 361.20 401.76 633.63 809.68 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.35 319.97 360.63 405.98 601.52 837.04 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.78 312.51 361.61 410.03 564.43 867.14 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.59 302.80 363.70 413.47 525.07 897.41 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.37 290.99 366.48 415.90 484.87 926.72 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 230.59 277.07 369.69 416.24 445.59 954.47 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.68 260.99 373.14 399.27 423.07 980.31 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.04 242.61 361.75 377.22 420.70 1003.98 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 175.16 221.78 324.86 380.93 418.91 1025.32 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 156.63 198.45 290.21 384.85 416.21 1044.18 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 139.27 172.95 258.79 388.77 412.39 1060.46 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 124.11 146.44 231.13 392.54 407.56 1074.04 -------------------------------------------------------------------------------- K point *** = 0.140625 0.046875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 112.09 121.58 207.57 395.69 402.46 1084.72 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 106.91 114.90 184.59 399.40 404.18 1088.53 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 90.72 109.77 172.11 394.99 404.91 1094.24 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 85.31 107.64 169.96 393.11 404.69 1096.06 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 93.49 108.56 178.18 395.11 403.44 1093.57 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 110.33 115.53 194.67 398.43 402.61 1087.14 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 122.38 137.25 217.34 396.84 406.52 1077.46 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 136.37 162.44 244.91 393.50 411.02 1064.95 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.94 187.04 276.56 389.79 414.52 1049.78 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 171.02 209.96 311.48 385.99 416.91 1032.01 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.69 230.87 348.68 382.27 418.33 1011.73 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 208.26 249.75 377.66 387.83 419.47 989.04 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.18 266.65 374.65 412.92 433.28 964.09 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.03 281.64 371.36 413.48 471.63 937.11 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.40 294.74 368.37 411.12 511.96 908.39 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.88 305.86 365.85 407.77 551.77 878.45 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.04 314.82 364.10 403.88 589.82 848.17 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.35 321.27 363.41 399.94 624.06 819.45 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.27 324.93 363.86 396.70 649.75 796.94 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.39 325.72 364.90 395.13 657.48 790.03 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.72 323.62 365.96 395.85 642.41 803.54 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.66 318.45 367.19 398.49 613.01 829.00 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.74 310.38 368.93 402.07 577.20 858.56 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.37 299.82 371.24 405.77 538.47 888.80 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.89 287.22 374.00 409.03 498.42 918.30 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 239.61 272.83 377.05 411.30 458.16 946.34 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.89 256.78 380.20 408.27 422.56 972.50 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 205.11 239.12 373.47 385.15 416.75 996.52 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 186.76 219.87 335.73 387.94 416.28 1018.20 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 168.46 199.07 298.53 391.52 415.19 1037.41 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 151.00 176.81 263.64 395.07 413.11 1054.09 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 135.39 153.40 232.16 398.35 409.91 1068.19 -------------------------------------------------------------------------------- K point *** = 0.140625 0.078125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 122.58 129.92 205.29 400.90 405.80 1079.71 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 121.60 125.74 190.73 404.40 406.68 1081.59 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 104.44 115.96 178.83 399.49 405.58 1089.15 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 93.49 108.56 178.18 395.11 403.44 1093.57 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 93.78 105.53 186.85 393.76 400.70 1093.80 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 104.73 110.36 202.15 394.83 399.10 1089.48 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 115.03 130.63 222.19 392.34 403.19 1081.08 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 128.12 157.10 246.02 388.57 408.86 1069.32 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 144.18 184.61 273.38 384.57 414.02 1054.62 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 162.05 210.77 304.28 380.55 418.15 1037.23 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 180.80 234.32 338.43 376.59 421.18 1017.30 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.71 254.92 372.22 375.45 423.44 994.95 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 218.27 272.69 369.01 409.63 428.33 970.34 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.00 287.89 365.63 419.27 458.19 943.67 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.52 300.70 362.62 418.55 497.72 915.21 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.34 311.28 360.20 416.08 537.62 885.39 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.90 319.65 358.72 412.59 576.34 854.94 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.49 325.73 358.71 408.42 612.15 825.32 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.37 329.38 360.64 403.99 641.39 800.04 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.21 330.42 364.45 399.89 655.94 787.15 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.37 328.54 369.36 396.87 647.54 794.89 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.53 323.43 374.32 395.67 621.62 817.81 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.30 315.06 378.52 396.60 587.53 846.59 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.03 303.80 381.79 399.21 549.85 876.74 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.92 290.15 384.53 402.53 510.51 906.42 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.09 274.59 387.11 405.70 470.59 934.76 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 235.64 257.55 389.52 407.75 431.43 961.29 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 219.74 239.41 384.83 396.47 412.47 985.71 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 202.70 220.48 349.04 396.94 412.91 1007.82 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.08 201.01 311.42 399.75 413.17 1027.48 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 167.68 181.18 275.33 402.53 412.61 1044.64 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 151.49 161.14 241.90 404.85 411.10 1059.32 -------------------------------------------------------------------------------- K point *** = 0.140625 0.109375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 137.37 141.14 212.81 406.25 408.52 1071.60 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 138.44 138.61 208.18 408.08 408.30 1072.17 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 123.33 125.40 195.98 403.79 405.70 1081.01 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 110.33 115.53 194.67 398.43 402.61 1087.14 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 104.73 110.36 202.15 394.83 399.10 1089.48 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 110.84 110.84 215.74 395.28 395.28 1087.20 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 117.03 128.22 233.46 391.23 399.54 1080.39 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 128.03 153.05 254.17 387.05 405.74 1069.68 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 142.55 181.43 277.44 382.83 412.21 1055.69 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 159.35 210.23 303.47 378.64 418.00 1038.83 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 177.41 237.13 332.74 374.56 422.76 1019.34 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 195.97 260.68 365.29 370.66 426.54 997.41 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 214.45 280.49 367.01 399.66 430.35 973.19 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.35 296.81 363.68 422.78 446.34 946.87 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.22 310.09 360.81 425.54 482.67 918.71 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.59 320.70 358.57 424.58 521.82 889.08 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.87 328.87 357.30 422.14 560.65 858.57 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.30 334.73 357.53 418.67 597.45 828.32 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.12 338.28 359.80 414.47 629.37 800.93 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.96 339.37 364.29 409.96 649.83 782.86 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.18 337.75 370.46 405.62 648.82 784.05 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.50 333.11 377.42 401.98 627.25 803.57 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.57 325.31 384.42 399.39 595.30 831.29 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.77 314.47 390.97 397.94 558.96 861.26 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.33 300.92 396.79 397.49 520.72 891.13 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.39 285.08 397.82 401.74 481.79 919.82 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.05 267.37 398.42 405.73 443.18 946.80 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.44 248.26 394.49 408.75 410.02 971.74 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 218.70 228.30 363.27 405.28 410.81 994.41 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 203.03 208.14 327.02 406.88 411.94 1014.70 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 186.72 188.56 291.94 408.76 412.20 1032.55 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 170.15 170.32 259.19 410.08 411.62 1048.00 -------------------------------------------------------------------------------- K point *** = 0.140625 0.140625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 153.80 153.86 230.36 410.10 410.30 1061.15 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.83 156.31 234.43 408.30 410.53 1060.57 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 135.98 146.19 221.16 402.81 409.08 1070.34 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 122.38 137.25 217.34 396.84 406.52 1077.46 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 115.03 130.63 222.19 392.34 403.19 1081.08 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 117.03 128.22 233.46 391.23 399.54 1080.39 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 127.59 132.81 248.97 392.19 397.60 1075.15 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 136.95 152.17 267.21 389.26 402.24 1065.74 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 148.71 178.75 287.36 385.02 409.32 1052.75 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 163.31 208.08 309.27 380.68 416.47 1036.67 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 179.78 237.43 333.35 376.47 422.88 1017.83 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.25 264.49 360.36 372.55 428.32 996.47 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.01 287.60 368.82 390.68 433.08 972.76 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.49 306.26 365.63 420.10 440.79 946.91 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.17 320.89 362.98 431.13 468.11 919.15 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.54 332.09 361.03 432.50 505.10 889.79 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.04 340.37 360.11 431.63 543.23 859.34 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.98 346.00 360.65 429.43 580.37 828.67 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.65 349.23 363.03 426.26 614.13 799.72 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.66 350.31 367.19 422.45 639.40 777.36 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.16 349.15 372.66 418.47 646.10 771.57 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.72 345.44 378.70 414.87 629.95 786.58 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.92 338.93 384.52 412.24 600.57 812.81 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.11 329.56 389.44 411.01 565.79 842.51 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.51 317.46 393.12 411.30 528.86 872.57 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.23 302.95 395.73 412.65 491.32 901.68 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.36 286.42 397.68 414.08 454.30 929.21 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.01 268.34 398.41 411.34 423.03 954.79 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.34 249.20 377.53 403.86 418.69 978.20 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.73 229.55 344.16 405.60 418.39 999.30 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.82 209.82 311.87 407.73 417.48 1018.04 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 181.57 190.30 281.93 409.53 415.64 1034.44 -------------------------------------------------------------------------------- K point *** = 0.140625 0.171875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 167.94 171.20 255.50 410.52 412.70 1048.59 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 168.82 174.71 266.05 407.09 411.80 1046.72 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 150.65 168.07 251.90 400.26 411.97 1057.21 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 136.37 162.44 244.91 393.50 411.02 1064.95 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 128.12 157.10 246.02 388.57 408.86 1069.32 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 128.03 153.05 254.17 387.05 405.74 1069.68 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 136.95 152.17 267.21 389.26 402.24 1065.74 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.56 157.06 283.25 392.42 400.65 1057.65 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 162.23 178.51 301.06 390.39 405.90 1045.86 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 173.61 206.01 320.01 386.25 413.76 1030.81 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 187.59 235.55 340.05 381.99 421.55 1012.87 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 203.25 264.84 361.71 378.04 428.58 992.29 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 219.74 291.57 374.04 386.49 434.76 969.30 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.33 313.86 371.11 413.29 441.11 944.08 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.42 331.09 368.72 433.69 456.58 916.86 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.42 343.75 367.16 439.09 488.56 887.92 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.79 352.55 366.76 440.28 524.83 857.67 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.93 357.89 368.03 439.76 561.49 826.80 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.25 360.56 370.84 438.06 596.24 796.73 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.34 361.71 374.33 435.54 625.15 770.97 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.19 361.40 378.19 432.62 639.35 758.20 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.07 359.11 382.21 429.79 629.86 767.30 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.39 354.46 385.92 427.58 603.60 791.39 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.44 347.26 388.94 426.32 570.50 820.68 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.42 337.43 391.24 425.94 534.98 850.95 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.47 325.06 393.08 425.99 499.02 880.55 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.73 310.31 394.81 425.56 464.09 908.73 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.44 293.37 396.51 419.80 435.50 935.08 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.96 274.53 390.96 401.11 428.45 959.36 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.85 254.15 362.34 402.36 425.98 981.43 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 208.92 232.73 334.27 404.96 423.02 1001.20 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 195.17 210.88 308.45 407.56 419.07 1018.66 -------------------------------------------------------------------------------- K point *** = 0.140625 0.203125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 183.56 189.33 285.42 409.59 414.12 1033.83 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.92 193.63 300.82 405.04 412.19 1030.48 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 167.42 189.39 286.34 397.17 413.76 1041.59 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.94 187.04 276.56 389.79 414.52 1049.78 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 144.18 184.61 273.38 384.57 414.02 1054.62 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 142.55 181.43 277.44 382.83 412.21 1055.69 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 148.71 178.75 287.36 385.02 409.32 1052.75 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 162.23 178.51 301.06 390.39 405.90 1045.86 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 181.83 182.03 316.84 395.68 404.34 1035.31 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.30 206.26 333.61 394.20 410.38 1021.46 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 200.05 233.74 350.87 390.25 419.00 1004.63 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.29 262.77 368.61 386.39 427.40 985.10 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.03 291.40 381.69 388.87 435.03 963.06 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.40 317.32 379.37 409.65 442.09 938.71 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.61 338.41 377.29 431.76 451.36 912.25 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.02 353.89 376.12 443.59 474.02 883.94 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.03 364.17 376.26 447.41 506.52 854.09 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.11 369.76 378.37 448.80 541.59 823.26 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.77 372.21 381.75 448.82 576.39 792.47 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.66 373.54 384.81 447.88 607.74 764.14 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.64 374.06 387.21 446.35 628.62 744.92 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.76 373.34 389.09 444.61 627.23 746.46 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.18 370.88 390.43 442.99 604.94 767.41 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.09 366.32 391.25 441.68 573.60 796.04 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.67 359.32 391.75 440.59 539.40 826.50 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.09 349.54 392.24 439.34 505.02 856.64 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.61 336.72 393.03 437.09 472.40 885.56 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.57 320.64 394.27 429.46 446.69 912.79 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.47 301.33 395.69 407.56 437.59 938.05 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.95 279.32 381.53 399.41 432.77 961.17 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.87 255.62 358.81 402.09 427.56 982.03 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.23 231.50 337.71 405.19 421.42 1000.58 -------------------------------------------------------------------------------- K point *** = 0.140625 0.234375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.91 208.26 318.28 407.89 414.63 1016.75 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 203.07 213.01 337.46 402.69 411.78 1011.76 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.26 209.85 323.20 393.89 414.56 1023.42 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 171.02 209.96 311.48 385.99 416.91 1032.01 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 162.05 210.77 304.28 380.55 418.15 1037.23 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 159.35 210.23 303.47 378.64 418.00 1038.83 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 163.31 208.08 309.27 380.68 416.47 1036.67 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 173.61 206.01 320.01 386.25 413.76 1030.81 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.30 206.26 333.61 394.20 410.38 1021.46 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 206.70 212.75 348.49 401.50 408.55 1008.89 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.75 234.84 363.73 400.18 415.67 993.36 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.28 261.16 378.80 396.68 425.06 975.10 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.96 288.90 390.58 396.93 433.99 954.28 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.87 316.25 389.47 411.68 442.17 931.09 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.07 340.86 387.76 429.58 450.34 905.69 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.78 360.36 386.96 445.42 464.01 878.28 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.33 373.79 387.40 452.59 489.91 849.14 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.19 381.41 389.65 455.96 521.77 818.67 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.93 384.76 393.29 457.68 555.45 787.59 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.24 386.51 396.36 458.35 587.99 757.51 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.95 387.54 398.23 458.31 614.21 732.89 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.97 387.79 398.92 457.85 622.25 725.31 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.32 387.10 398.48 457.12 605.46 741.33 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.06 385.19 397.06 456.11 576.06 768.90 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.31 381.41 395.17 454.65 542.97 799.51 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.27 374.69 393.58 452.39 509.91 830.23 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.24 363.95 392.81 448.58 479.50 859.95 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.63 348.35 392.99 439.86 456.55 888.12 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.00 327.80 394.06 422.00 445.99 914.41 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.04 303.52 395.42 403.90 438.82 938.62 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.63 277.53 385.03 399.83 431.28 960.58 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.74 251.73 368.86 402.92 422.94 980.17 -------------------------------------------------------------------------------- K point *** = 0.140625 0.265625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.00 227.86 352.91 406.03 414.33 997.28 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 219.45 232.57 374.49 401.04 410.69 990.59 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 203.28 229.29 361.27 390.83 414.60 1002.76 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.69 230.87 348.68 382.27 418.33 1011.73 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 180.80 234.32 338.43 376.59 421.18 1017.30 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 177.41 237.13 332.74 374.56 422.76 1019.34 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 179.78 237.43 333.35 376.47 422.88 1017.83 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 187.59 235.55 340.05 381.99 421.55 1012.87 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 200.05 233.74 350.87 390.25 419.00 1004.63 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.75 234.84 363.73 400.18 415.67 993.36 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 230.38 243.69 377.17 409.66 413.16 979.24 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.41 263.46 390.23 407.98 422.08 962.46 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.20 287.57 400.31 407.69 432.15 943.16 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.61 313.25 400.41 418.03 441.43 921.44 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.82 338.66 399.15 431.42 449.97 897.46 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.89 361.43 398.79 445.79 459.52 871.34 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.03 379.07 399.52 455.90 477.05 843.30 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.66 390.66 401.42 461.00 503.58 813.63 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.33 397.05 404.40 464.07 534.58 782.81 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.77 400.27 407.43 466.04 566.89 751.83 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.79 401.92 409.45 467.30 596.66 723.33 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.27 402.36 410.34 468.11 614.63 705.96 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.20 401.59 410.21 468.48 606.35 713.94 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.58 399.81 408.95 468.28 579.54 739.62 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.51 397.42 406.07 467.19 547.40 770.27 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.14 394.81 400.75 464.81 515.24 801.59 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.74 389.29 394.56 460.38 486.58 832.14 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.72 373.89 392.96 451.68 466.04 861.28 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.63 351.55 392.97 438.17 454.82 888.61 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.20 325.14 394.13 425.37 445.59 913.88 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.28 297.64 396.07 413.95 435.64 936.89 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.82 271.17 396.23 405.21 424.79 957.46 -------------------------------------------------------------------------------- K point *** = 0.140625 0.296875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.19 247.62 387.09 405.58 413.68 975.42 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.67 251.79 394.60 406.95 419.17 967.05 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 220.76 247.62 385.59 400.62 415.82 979.70 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 208.26 249.75 377.66 387.83 419.47 989.04 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.71 254.92 372.22 375.45 423.44 994.95 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 195.97 260.68 365.29 370.66 426.54 997.41 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.25 264.49 360.36 372.55 428.32 996.47 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 203.25 264.84 361.71 378.04 428.58 992.29 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.29 262.77 368.61 386.39 427.40 985.10 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.28 261.16 378.80 396.68 425.06 975.10 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.41 263.46 390.23 407.98 422.08 962.46 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.54 273.55 401.50 418.03 420.60 947.33 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.83 291.12 410.39 418.09 430.91 929.78 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.05 312.37 411.35 425.63 441.06 909.89 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.47 335.24 410.55 435.99 450.09 887.71 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.18 358.06 410.65 447.40 458.38 863.34 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.19 378.55 411.89 458.18 469.32 836.90 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.77 394.39 414.01 464.39 488.87 808.59 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.43 405.15 416.43 468.05 515.31 778.72 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.87 412.14 418.39 470.57 545.65 747.85 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.91 416.38 419.65 472.50 576.82 717.31 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.48 416.68 421.84 474.14 603.18 691.68 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.57 414.19 424.04 475.49 608.36 686.82 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.28 410.29 425.00 476.36 586.38 708.63 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.72 405.71 423.96 476.35 555.64 739.12 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.01 401.12 419.75 474.94 524.57 771.04 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.34 397.16 410.40 471.09 497.77 802.43 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.03 393.46 394.62 462.61 480.23 832.51 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.56 370.15 392.93 450.93 470.62 860.84 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.63 342.98 393.01 439.95 462.33 887.12 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.10 315.39 394.50 429.52 453.10 911.10 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.84 289.41 397.05 419.17 442.53 932.55 -------------------------------------------------------------------------------- K point *** = 0.140625 0.328125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.20 266.85 399.26 409.80 430.80 951.27 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.55 270.07 393.70 404.78 456.68 941.32 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.17 264.71 383.26 409.36 444.66 954.40 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.18 266.65 374.65 412.92 433.28 964.09 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 218.27 272.69 369.01 409.63 428.33 970.34 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 214.45 280.49 367.01 399.66 430.35 973.19 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.01 287.60 368.82 390.68 433.08 972.76 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 219.74 291.57 374.04 386.49 434.76 969.30 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.03 291.40 381.69 388.87 435.03 963.06 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.96 288.90 390.58 396.93 433.99 954.28 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.20 287.57 400.31 407.69 432.15 943.16 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.83 291.12 410.39 418.09 430.91 929.78 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.75 301.52 419.90 423.01 435.23 914.21 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.77 316.92 421.49 430.37 444.20 896.44 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.33 334.97 420.96 439.65 452.84 876.47 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.96 354.43 421.51 449.23 460.25 854.34 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.38 374.10 423.38 459.52 467.11 830.08 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.45 392.07 426.22 467.12 478.95 803.80 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.45 406.57 429.20 470.59 499.27 775.68 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.02 417.45 431.25 472.62 525.70 746.02 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.01 425.70 431.63 474.10 555.85 715.44 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.42 429.41 432.64 475.52 586.58 685.59 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.37 425.87 437.14 477.08 608.77 664.71 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.07 420.56 439.55 478.71 598.40 676.56 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.73 414.28 438.88 480.02 570.52 706.49 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.50 407.75 434.04 480.07 541.98 739.00 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.51 401.69 423.60 476.95 518.63 771.20 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.94 396.59 406.54 468.60 504.41 802.16 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.15 382.57 394.18 456.90 497.02 831.40 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.75 356.74 392.58 444.62 491.36 858.57 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.55 330.54 393.05 432.20 485.01 883.39 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.45 306.03 395.21 419.65 477.19 905.61 -------------------------------------------------------------------------------- K point *** = 0.140625 0.359375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.89 284.90 398.33 407.58 467.70 924.99 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.99 286.90 391.78 401.37 496.15 913.64 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.13 280.42 380.35 407.20 484.57 927.09 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.03 281.64 371.36 413.48 471.63 937.11 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.00 287.89 365.63 419.27 458.19 943.67 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.35 296.81 363.68 422.78 446.34 946.87 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.49 306.26 365.63 420.10 440.79 946.91 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.33 313.86 371.11 413.29 441.11 944.08 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.40 317.32 379.37 409.65 442.09 938.71 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.87 316.25 389.47 411.68 442.17 931.09 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.61 313.25 400.41 418.03 441.43 921.44 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.05 312.37 411.35 425.63 441.06 909.89 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.77 316.92 421.49 430.37 444.20 896.44 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.65 326.95 427.92 434.10 451.24 881.06 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.04 340.13 428.84 442.10 458.69 863.68 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.71 354.86 429.97 450.55 465.09 844.25 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.63 370.54 432.56 459.26 470.20 822.75 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.97 386.68 436.47 468.33 475.31 799.20 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.15 402.19 440.65 472.92 487.67 773.69 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.40 415.98 443.65 473.98 508.38 746.40 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.57 427.72 444.55 474.00 535.06 717.64 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.81 436.55 444.03 473.73 565.58 687.94 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.45 436.33 447.89 473.83 597.23 658.80 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.89 430.57 451.36 475.28 614.44 645.29 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.46 423.14 449.61 478.27 592.00 672.91 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.42 415.04 442.52 480.48 566.76 706.12 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.91 407.08 430.33 478.81 546.88 739.04 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.01 399.86 413.28 471.56 534.74 770.73 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.92 389.29 397.06 460.14 528.44 800.71 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.10 366.73 392.77 446.92 524.25 828.61 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.29 343.00 391.80 433.02 519.72 854.12 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.42 320.66 393.12 418.90 513.77 876.96 -------------------------------------------------------------------------------- K point *** = 0.140625 0.390625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.15 301.25 396.36 405.04 505.94 896.87 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.92 301.83 389.28 398.10 535.42 884.42 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.36 294.53 377.56 404.03 524.67 898.13 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.40 294.74 368.37 411.12 511.96 908.39 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.52 300.70 362.62 418.55 497.72 915.21 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.22 310.09 360.81 425.54 482.67 918.71 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.17 320.89 362.98 431.13 468.11 919.15 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.42 331.09 368.72 433.69 456.58 916.86 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.61 338.41 377.29 431.76 451.36 912.25 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.07 340.86 387.76 429.58 450.34 905.69 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.82 338.66 399.15 431.42 449.97 897.46 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.47 335.24 410.55 435.99 450.09 887.71 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.33 334.97 420.96 439.65 452.84 876.47 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.04 340.13 428.84 442.10 458.69 863.68 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.97 349.31 432.59 447.13 465.13 849.21 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.47 360.23 434.64 453.97 470.74 832.92 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.94 371.69 437.74 460.90 475.02 814.72 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.07 383.49 442.70 467.89 478.08 794.56 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.42 395.96 448.75 474.34 482.22 772.47 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.63 409.29 453.65 475.95 494.88 748.59 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.75 422.95 455.55 474.82 515.84 723.14 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 367.12 435.79 454.59 472.62 542.72 696.50 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.48 443.43 454.84 469.57 573.44 669.23 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.53 439.48 460.36 467.57 606.33 642.19 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.79 431.51 455.63 473.68 616.56 640.22 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.66 422.28 445.86 478.70 594.30 674.07 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.35 412.73 432.62 478.74 577.39 707.28 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.94 403.44 416.34 472.79 566.91 739.29 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.51 392.41 400.57 462.00 561.43 769.64 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.34 373.54 393.34 448.44 558.17 797.95 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.07 352.79 390.49 433.63 554.93 823.86 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.64 332.97 390.50 418.46 550.42 847.08 -------------------------------------------------------------------------------- K point *** = 0.140625 0.421875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.90 315.44 392.87 403.74 544.00 867.35 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.23 314.39 385.27 396.37 573.54 854.33 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.67 306.68 374.91 400.53 563.83 868.10 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.88 305.86 365.85 407.77 551.77 878.45 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.34 311.28 360.20 416.08 537.62 885.39 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.59 320.70 358.57 424.58 521.82 889.08 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.54 332.09 361.03 432.50 505.10 889.79 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.42 343.75 367.16 439.09 488.56 887.92 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.02 353.89 376.12 443.59 474.02 883.94 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.78 360.36 386.96 445.42 464.01 878.28 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.89 361.43 398.79 445.79 459.52 871.34 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.18 358.06 410.65 447.40 458.38 863.34 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.96 354.43 421.51 449.23 460.25 854.34 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.71 354.86 429.97 450.55 465.09 844.25 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.47 360.23 434.64 453.97 470.74 832.92 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.50 368.22 436.80 459.54 475.78 820.13 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.92 376.84 439.33 465.38 479.62 805.70 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.90 385.16 443.90 470.60 482.11 789.51 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.96 393.24 450.91 475.09 483.68 771.55 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.13 402.21 458.77 477.84 487.53 751.91 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.98 413.69 463.38 477.03 499.93 730.82 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 372.48 427.26 463.01 474.37 520.68 708.72 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 370.92 440.10 459.66 470.66 546.74 686.32 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.63 444.90 458.78 466.94 575.44 664.97 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.50 438.41 454.72 471.11 602.53 648.53 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.07 428.69 444.77 476.71 611.60 653.80 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.70 417.92 431.95 477.69 603.43 680.68 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.55 406.73 417.18 472.88 596.39 710.74 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.68 394.11 403.12 462.98 592.65 740.22 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.24 377.77 393.88 449.70 590.73 768.11 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.71 359.97 388.80 434.62 588.86 793.83 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.99 342.69 387.00 419.03 585.81 816.98 -------------------------------------------------------------------------------- K point *** = 0.140625 0.453125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.04 327.06 387.65 404.31 580.82 837.23 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.76 324.13 379.63 396.74 608.99 824.76 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.86 316.41 372.32 397.37 600.76 838.11 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.04 314.82 364.10 403.88 589.82 848.17 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.90 319.65 358.72 412.59 576.34 854.94 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.87 328.87 357.30 422.14 560.65 858.57 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.04 340.37 360.11 431.63 543.23 859.34 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.79 352.55 366.76 440.28 524.83 857.67 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.03 364.17 376.26 447.41 506.52 854.09 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.33 373.79 387.40 452.59 489.91 849.14 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.03 379.07 399.52 455.90 477.05 843.30 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.19 378.55 411.89 458.18 469.32 836.90 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.38 374.10 423.38 459.52 467.11 830.08 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.63 370.54 432.56 459.26 470.20 822.75 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.94 371.69 437.74 460.90 475.02 814.72 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.92 376.84 439.33 465.38 479.62 805.70 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.12 383.36 440.32 470.58 483.29 795.42 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.33 389.61 442.96 475.03 485.70 783.68 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.50 394.94 448.33 478.18 486.90 770.40 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.02 399.65 456.47 479.79 487.57 755.62 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.41 405.63 465.00 479.41 490.76 739.56 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.23 415.56 468.01 477.20 502.23 722.66 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.87 428.19 464.58 474.17 521.74 705.67 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.64 438.57 457.87 471.49 545.33 689.80 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.19 440.58 449.71 472.06 569.95 677.15 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.41 433.30 440.44 475.31 591.78 671.39 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.82 421.99 429.23 476.19 606.00 677.46 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.74 409.03 416.71 472.22 612.28 695.24 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.30 394.96 404.38 463.39 615.25 718.66 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.63 380.01 393.95 450.91 617.23 743.27 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.06 364.68 386.55 436.27 618.17 767.02 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.34 349.68 382.55 420.89 617.45 788.89 -------------------------------------------------------------------------------- K point *** = 0.140625 0.484375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.39 335.81 381.32 406.43 614.50 808.27 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.22 330.70 373.22 398.88 638.43 798.98 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.65 323.20 369.56 395.47 632.88 810.63 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.35 321.27 363.41 399.94 624.06 819.45 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.49 325.73 358.71 408.42 612.15 825.32 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.30 334.73 357.53 418.67 597.45 828.32 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.98 346.00 360.65 429.43 580.37 828.67 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.93 357.89 368.03 439.76 561.49 826.80 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.11 369.76 378.37 448.80 541.59 823.26 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.19 381.41 389.65 455.96 521.77 818.67 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.66 390.66 401.42 461.00 503.58 813.63 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.77 394.39 414.01 464.39 488.87 808.59 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.45 392.07 426.22 467.12 478.95 803.80 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.97 386.68 436.47 468.33 475.31 799.20 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.07 383.49 442.70 467.89 478.08 794.56 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.90 385.16 443.90 470.60 482.11 789.51 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.33 389.61 442.96 475.03 485.70 783.68 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.79 394.36 442.93 478.89 488.33 776.76 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.68 398.13 445.38 481.36 489.75 768.57 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.72 400.59 450.89 482.26 489.96 759.07 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.08 402.48 458.93 481.61 489.57 748.42 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.70 406.31 466.31 479.68 491.44 737.00 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 372.79 414.94 466.43 477.17 501.46 725.42 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.75 425.48 459.94 474.66 518.67 714.64 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.40 432.08 450.08 473.57 539.20 705.94 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.38 431.52 437.98 474.43 560.80 700.89 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.56 424.28 425.13 474.53 581.63 700.99 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.43 409.68 415.49 471.10 600.12 707.07 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.30 394.96 404.38 463.39 615.25 718.66 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.37 380.75 393.26 452.10 626.76 734.10 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.89 367.16 383.81 438.44 634.77 751.35 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.40 354.00 377.50 423.80 639.37 768.67 -------------------------------------------------------------------------------- K point *** = 0.140625 0.515625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.67 341.53 374.55 409.76 640.60 784.82 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.12 334.02 366.93 402.37 654.06 784.73 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.59 326.77 366.45 395.68 654.06 791.75 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.27 324.93 363.86 396.70 649.75 796.94 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.37 329.38 360.64 403.99 641.39 800.04 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.12 338.28 359.80 414.47 629.37 800.93 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.65 349.23 363.03 426.26 614.13 799.72 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.25 360.56 370.84 438.06 596.24 796.73 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.77 372.21 381.75 448.82 576.39 792.47 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.93 384.76 393.29 457.68 555.45 787.59 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.33 397.05 404.40 464.07 534.58 782.81 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.43 405.15 416.43 468.05 515.31 778.72 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.45 406.57 429.20 470.59 499.27 775.68 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.15 402.19 440.65 472.92 487.67 773.69 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.42 395.96 448.75 474.34 482.22 772.47 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.96 393.24 450.91 475.09 483.68 771.55 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.50 394.94 448.33 478.18 486.90 770.40 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.68 398.13 445.38 481.36 489.75 768.57 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.50 400.74 444.45 483.32 491.51 765.74 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.97 401.91 446.46 483.84 491.81 761.78 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.57 401.75 451.41 483.00 490.67 756.74 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.06 401.53 458.10 481.03 488.87 750.85 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.87 404.27 462.45 478.82 489.44 744.59 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.88 411.81 459.04 476.67 497.72 738.64 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.59 419.77 450.04 474.66 512.36 733.85 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.73 422.83 438.19 473.71 530.52 731.13 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.80 419.20 425.08 472.78 550.81 731.20 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.61 408.29 413.79 469.60 571.97 734.33 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.68 394.11 403.12 462.98 592.65 740.22 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.36 380.37 391.70 453.09 611.66 748.19 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.93 367.76 380.83 440.79 627.98 757.38 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.76 355.87 372.51 427.26 640.83 766.98 -------------------------------------------------------------------------------- K point *** = 0.140625 0.546875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.37 344.32 368.09 413.86 649.62 776.30 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.72 334.31 361.71 406.69 646.95 790.93 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.06 327.26 363.36 398.03 654.42 791.33 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.39 325.72 364.90 395.13 657.48 790.03 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.21 330.42 364.45 399.89 655.94 787.15 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.96 339.37 364.29 409.96 649.83 782.86 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.66 350.31 367.19 422.45 639.40 777.36 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.34 361.71 374.33 435.54 625.15 770.97 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.66 373.54 384.81 447.88 607.74 764.14 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.24 386.51 396.36 458.35 587.99 757.51 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.77 400.27 407.43 466.04 566.89 751.83 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.87 412.14 418.39 470.57 545.65 747.85 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.02 417.45 431.25 472.62 525.70 746.02 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.40 415.98 443.65 473.98 508.38 746.40 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.63 409.29 453.65 475.95 494.88 748.59 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.13 402.21 458.77 477.84 487.53 751.91 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.02 399.65 456.47 479.79 487.57 755.62 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.72 400.59 450.89 482.26 489.96 759.07 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.97 401.91 446.46 483.84 491.81 761.78 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.23 402.04 444.76 484.12 492.24 763.48 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.20 400.64 446.10 483.05 491.09 764.07 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.03 398.31 449.85 480.69 488.65 763.67 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.99 396.88 454.05 477.81 485.81 762.59 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.29 399.45 454.15 476.38 485.10 761.29 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.34 406.10 447.44 474.74 491.50 760.38 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.31 411.59 436.62 472.65 504.00 760.45 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.55 411.57 423.93 470.71 520.64 761.98 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.35 404.70 411.51 467.61 540.28 765.12 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.51 392.41 400.57 462.00 561.43 769.64 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.58 379.21 389.19 453.58 582.59 774.98 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.94 367.01 377.71 442.84 602.58 780.41 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.92 355.66 368.18 430.68 620.45 785.22 -------------------------------------------------------------------------------- K point *** = 0.140625 0.578125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.82 344.47 362.80 418.20 635.45 788.85 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.39 331.92 358.42 411.23 621.51 813.20 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.62 324.94 361.20 401.76 633.63 809.68 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.72 323.62 365.96 395.85 642.41 803.54 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.37 328.54 369.36 396.87 647.54 794.89 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.18 337.75 370.46 405.62 648.82 784.05 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.16 349.15 372.66 418.47 646.10 771.57 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.19 361.40 378.19 432.62 639.35 758.20 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.64 374.06 387.21 446.35 628.62 744.92 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.95 387.54 398.23 458.31 614.21 732.89 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.79 401.92 409.45 467.30 596.66 723.33 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.91 416.38 419.65 472.50 576.82 717.31 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.01 425.70 431.63 474.10 555.85 715.44 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.57 427.72 444.55 474.00 535.06 717.64 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.75 422.95 455.55 474.82 515.84 723.14 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.98 413.69 463.38 477.03 499.93 730.82 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.41 405.63 465.00 479.41 490.76 739.56 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.08 402.48 458.93 481.61 489.57 748.42 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.57 401.75 451.41 483.00 490.67 756.74 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.20 400.64 446.10 483.05 491.09 764.07 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.02 398.16 443.84 481.61 490.16 770.21 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.39 394.44 444.33 478.69 487.94 775.16 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.12 390.54 446.34 474.77 484.74 779.08 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.98 388.77 447.10 471.72 481.13 782.29 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.62 391.71 442.80 471.67 478.94 785.20 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.16 397.54 433.51 470.40 483.46 788.25 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.90 400.85 421.60 467.82 494.24 791.80 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.78 398.18 408.89 464.77 509.65 796.01 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.92 389.29 397.06 460.14 528.44 800.71 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.11 377.29 385.76 453.24 548.86 805.51 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.87 365.28 374.45 444.19 569.37 809.79 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.60 353.69 364.93 433.58 588.82 812.88 -------------------------------------------------------------------------------- K point *** = 0.140625 0.609375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.47 342.20 359.42 422.26 606.41 814.17 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.11 327.12 357.32 415.45 587.38 841.96 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.35 319.97 360.63 405.98 601.52 837.04 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.66 318.45 367.19 398.49 613.01 829.00 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.53 323.43 374.32 395.67 621.62 817.81 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.50 333.11 377.42 401.98 627.25 803.57 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.72 345.44 378.70 414.87 629.95 786.58 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.07 359.11 382.21 429.79 629.86 767.30 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.76 373.34 389.09 444.61 627.23 746.46 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.97 387.79 398.92 457.85 622.25 725.31 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.27 402.36 410.34 468.11 614.63 705.96 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.48 416.68 421.84 474.14 603.18 691.68 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.42 429.41 432.64 475.52 586.58 685.59 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.81 436.55 444.03 473.73 565.58 687.94 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 367.12 435.79 454.59 472.62 542.72 696.50 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 372.48 427.26 463.01 474.37 520.68 708.72 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.23 415.56 468.01 477.20 502.23 722.66 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.70 406.31 466.31 479.68 491.44 737.00 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.06 401.53 458.10 481.03 488.87 750.85 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.03 398.31 449.85 480.69 488.65 763.67 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.39 394.44 444.33 478.69 487.94 775.16 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.83 389.41 441.75 475.17 486.06 785.23 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.51 383.73 441.28 470.52 482.97 793.93 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.84 378.87 441.03 465.91 478.90 801.46 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.27 377.42 437.81 463.71 474.44 808.12 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.53 380.81 429.94 464.29 471.34 814.23 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.11 385.75 418.96 463.06 474.21 820.08 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.13 387.15 406.59 460.39 483.15 825.82 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.15 382.57 394.18 456.90 497.02 831.40 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.20 373.15 382.55 451.68 514.47 836.51 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.98 361.64 371.85 444.46 533.58 840.69 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.97 349.55 363.21 435.56 552.78 843.36 -------------------------------------------------------------------------------- K point *** = 0.140625 0.640625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.39 337.62 358.14 425.62 570.96 843.95 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.48 320.02 358.02 418.96 549.51 872.42 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.78 312.51 361.61 410.03 564.43 867.14 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.74 310.38 368.93 402.07 577.20 858.56 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.30 315.06 378.52 396.60 587.53 846.59 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.57 325.31 384.42 399.39 595.30 831.29 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.92 338.93 384.52 412.24 600.57 812.81 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.39 354.46 385.92 427.58 603.60 791.39 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.18 370.88 390.43 442.99 604.94 767.41 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.32 387.10 398.48 457.12 605.46 741.33 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.20 401.59 410.21 468.48 606.35 713.94 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.57 414.19 424.04 475.49 608.36 686.82 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.37 425.87 437.14 477.08 608.77 664.71 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.45 436.33 447.89 473.83 597.23 658.80 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.48 443.43 454.84 469.57 573.44 669.23 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 370.92 440.10 459.66 470.66 546.74 686.32 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.87 428.19 464.58 474.17 521.74 705.67 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 372.79 414.94 466.43 477.17 501.46 725.42 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.87 404.27 462.45 478.82 489.44 744.59 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.99 396.88 454.05 477.81 485.81 762.59 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.12 390.54 446.34 474.77 484.74 779.08 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.51 383.73 441.28 470.52 482.97 793.93 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.68 376.29 438.66 465.31 479.89 807.12 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.57 368.99 437.12 459.80 475.57 818.76 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.23 363.68 434.04 455.75 470.42 829.05 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.17 362.88 427.08 454.49 465.41 838.22 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.58 366.51 416.91 453.92 462.74 846.51 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.76 370.44 405.12 452.45 464.38 854.05 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.56 370.15 392.93 450.93 470.62 860.84 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.26 364.24 381.32 448.14 482.24 866.70 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.74 354.35 371.10 443.20 497.88 871.27 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.62 342.62 363.18 436.28 515.33 874.08 -------------------------------------------------------------------------------- K point *** = 0.140625 0.671875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.21 330.66 358.59 427.97 532.90 874.61 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.31 310.66 359.94 421.44 510.07 902.64 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.59 302.80 363.70 413.47 525.07 897.41 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.37 299.82 371.24 405.77 538.47 888.80 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.03 303.80 381.79 399.21 549.85 876.74 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.77 314.47 390.97 397.94 558.96 861.26 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.11 329.56 389.44 411.01 565.79 842.51 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.44 347.26 388.94 426.32 570.50 820.68 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.09 366.32 391.25 441.68 573.60 796.04 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.06 385.19 397.06 456.11 576.06 768.90 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.58 399.81 408.95 468.28 579.54 739.62 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.28 410.29 425.00 476.36 586.38 708.63 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.07 420.56 439.55 478.71 598.40 676.56 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.89 430.57 451.36 475.28 614.44 645.29 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.53 439.48 460.36 467.57 606.33 642.19 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.63 444.90 458.78 466.94 575.44 664.97 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.64 438.57 457.87 471.49 545.33 689.80 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.75 425.48 459.94 474.66 518.67 714.64 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.88 411.81 459.04 476.67 497.72 738.64 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.29 399.45 454.15 476.38 485.10 761.29 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.98 388.77 447.10 471.72 481.13 782.29 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.84 378.87 441.03 465.91 478.90 801.46 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.57 368.99 437.12 459.80 475.57 818.76 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.59 359.22 434.77 453.44 470.87 834.22 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.62 350.59 431.89 448.03 465.10 847.96 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.40 345.28 425.58 445.25 459.15 860.13 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.04 345.20 415.96 443.17 455.03 870.89 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.23 348.77 404.71 439.90 454.11 880.38 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.63 351.55 392.97 438.17 454.82 888.61 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.76 349.76 381.72 439.12 457.47 895.47 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.70 342.80 371.90 438.84 465.38 900.70 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.19 332.55 364.45 435.08 478.61 903.92 -------------------------------------------------------------------------------- K point *** = 0.140625 0.703125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.70 321.20 360.26 428.92 494.19 904.71 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.27 298.94 362.63 422.34 470.62 931.73 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.37 290.99 366.48 415.90 484.87 926.72 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.89 287.22 374.00 409.03 498.42 918.30 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.92 290.15 384.53 402.53 510.51 906.42 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.33 300.92 396.79 397.49 520.72 891.13 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.51 317.46 393.12 411.30 528.86 872.57 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.42 337.43 391.24 425.94 534.98 850.95 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.67 359.32 391.75 440.59 539.40 826.50 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.31 381.41 395.17 454.65 542.97 799.51 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.51 397.42 406.07 467.19 547.40 770.27 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.72 405.71 423.96 476.35 555.64 739.12 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.73 414.28 438.88 480.02 570.52 706.49 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.46 423.14 449.61 478.27 592.00 672.91 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.79 431.51 455.63 473.68 616.56 640.22 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.50 438.41 454.72 471.11 602.53 648.53 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.19 440.58 449.71 472.06 569.95 677.15 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.40 432.08 450.08 473.57 539.20 705.94 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.59 419.77 450.04 474.66 512.36 733.85 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.34 406.10 447.44 474.74 491.50 760.38 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.62 391.71 442.80 471.67 478.94 785.20 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.27 377.42 437.81 463.71 474.44 808.12 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.23 363.68 434.04 455.75 470.42 829.05 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.62 350.59 431.89 448.03 465.10 847.96 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.65 338.54 430.30 440.69 458.56 864.88 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.75 328.89 425.42 436.24 451.62 879.90 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.54 323.98 416.20 433.27 446.63 893.12 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.30 324.57 405.35 427.59 445.57 904.61 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.00 327.80 394.06 422.00 445.99 914.41 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.29 329.42 383.20 420.06 446.10 922.44 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.42 326.41 373.74 423.13 445.90 928.50 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.30 318.86 366.62 427.67 448.14 932.31 -------------------------------------------------------------------------------- K point *** = 0.140625 0.734375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.50 308.93 362.73 427.12 457.23 933.50 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.88 284.68 365.81 417.37 436.25 959.18 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 230.59 277.07 369.69 416.24 445.59 954.47 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 239.61 272.83 377.05 411.30 458.16 946.34 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.09 274.59 387.11 405.70 470.59 934.76 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.39 285.08 397.82 401.74 481.79 919.82 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.23 302.95 395.73 412.65 491.32 901.68 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.47 325.06 393.08 425.99 499.02 880.55 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.09 349.54 392.24 439.34 505.02 856.64 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.27 374.69 393.58 452.39 509.91 830.23 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.14 394.81 400.75 464.81 515.24 801.59 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.01 401.12 419.75 474.94 524.57 771.04 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.50 407.75 434.04 480.07 541.98 739.00 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.42 415.04 442.52 480.48 566.76 706.12 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.66 422.28 445.86 478.70 594.30 674.07 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.07 428.69 444.77 476.71 611.60 653.80 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.41 433.30 440.44 475.31 591.78 671.39 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.38 431.52 437.98 474.43 560.80 700.89 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.73 422.83 438.19 473.71 530.52 731.13 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.31 411.59 436.62 472.65 504.00 760.45 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.16 397.54 433.51 470.40 483.46 788.25 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.53 380.81 429.94 464.29 471.34 814.23 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.17 362.88 427.08 454.49 465.41 838.22 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.40 345.28 425.58 445.25 459.15 860.13 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.75 328.89 425.42 436.24 451.62 879.90 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.01 314.59 425.48 427.27 443.34 897.56 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.12 304.31 416.76 424.27 437.04 913.12 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.92 300.21 406.34 416.74 436.28 926.62 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.47 301.33 395.69 407.56 437.59 938.05 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.51 304.09 385.40 400.54 438.52 947.35 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.50 304.67 376.31 398.43 438.32 954.37 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.48 300.88 369.46 402.41 436.87 958.87 -------------------------------------------------------------------------------- K point *** = 0.140625 0.765625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.15 293.42 365.76 410.66 434.94 960.57 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 206.58 267.60 369.32 387.65 426.61 984.67 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.68 260.99 373.14 399.27 423.07 980.31 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.89 256.78 380.20 408.27 422.56 972.50 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 235.64 257.55 389.52 407.75 431.43 961.29 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.05 267.37 398.42 405.73 443.18 946.80 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.36 286.42 397.68 414.08 454.30 929.21 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.73 310.31 394.81 425.56 464.09 908.73 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.61 336.72 393.03 437.09 472.40 885.56 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.24 363.95 392.81 448.58 479.50 859.95 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.74 389.29 394.56 460.38 486.58 832.14 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.34 397.16 410.40 471.09 497.77 802.43 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.51 401.69 423.60 476.95 518.63 771.20 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.91 407.08 430.33 478.81 546.88 739.04 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.35 412.73 432.62 478.74 577.39 707.28 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.70 417.92 431.95 477.69 603.43 680.68 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.82 421.99 429.23 476.19 606.00 677.46 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.56 424.28 425.13 474.53 581.63 700.99 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.80 419.20 425.08 472.78 550.81 731.20 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.55 411.57 423.93 470.71 520.64 761.98 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.90 400.85 421.60 467.82 494.24 791.80 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.11 385.75 418.96 463.06 474.21 820.08 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.58 366.51 416.91 453.92 462.74 846.51 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.04 345.20 415.96 443.17 455.03 870.89 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.54 323.98 416.20 433.27 446.63 893.12 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.12 304.31 416.76 424.27 437.04 913.12 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.92 287.82 411.46 420.51 427.47 930.85 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.91 277.47 401.43 412.64 426.04 946.28 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.96 274.53 390.96 401.11 428.45 959.36 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.20 276.02 381.39 390.00 430.60 970.01 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.57 278.29 374.59 380.53 431.72 978.08 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 208.26 278.13 371.96 374.58 431.43 983.37 -------------------------------------------------------------------------------- K point *** = 0.140625 0.796875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 205.11 274.15 369.21 378.26 429.65 985.64 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 187.80 247.35 351.97 373.13 423.72 1007.98 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.04 242.61 361.75 377.22 420.70 1003.98 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 205.11 239.12 373.47 385.15 416.75 996.52 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 219.74 239.41 384.83 396.47 412.47 985.71 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.44 248.26 394.49 408.75 410.02 971.74 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.01 268.34 398.41 411.34 423.03 954.79 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.44 293.37 396.51 419.80 435.50 935.08 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.57 320.64 394.27 429.46 446.69 912.79 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.63 348.35 392.99 439.86 456.55 888.12 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.72 373.89 392.96 451.68 466.04 861.28 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.03 393.46 394.62 462.61 480.23 832.51 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.94 396.59 406.54 468.60 504.41 802.16 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.01 399.86 413.28 471.56 534.74 770.73 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.94 403.44 416.34 472.79 566.91 739.29 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.55 406.73 417.18 472.88 596.39 710.74 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.74 409.03 416.71 472.22 612.28 695.24 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.43 409.68 415.49 471.10 600.12 707.07 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.61 408.29 413.79 469.60 571.97 734.33 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.35 404.70 411.51 467.61 540.28 765.12 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.78 398.18 408.89 464.77 509.65 796.01 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.13 387.15 406.59 460.39 483.15 825.82 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.76 370.44 405.12 452.45 464.38 854.05 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.23 348.77 404.71 439.90 454.11 880.38 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.30 324.57 405.35 427.59 445.57 904.61 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.92 300.21 406.34 416.74 436.28 926.62 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.91 277.47 401.43 412.64 426.04 946.28 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.68 258.81 389.99 414.72 415.57 963.51 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.34 249.20 377.53 403.86 418.69 978.20 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.27 247.53 365.29 393.16 421.92 990.23 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 200.36 249.25 354.69 383.80 424.38 999.42 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 191.25 251.18 347.81 376.79 425.64 1005.58 -------------------------------------------------------------------------------- K point *** = 0.140625 0.828125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 186.89 250.77 346.74 373.04 425.43 1008.49 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 169.05 223.73 318.53 377.08 420.33 1028.94 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 175.16 221.78 324.86 380.93 418.91 1025.32 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 186.76 219.87 335.73 387.94 416.28 1018.20 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 202.70 220.48 349.04 396.94 412.91 1007.82 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 218.70 228.30 363.27 405.28 410.81 994.41 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.34 249.20 377.53 403.86 418.69 978.20 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.96 274.53 390.96 401.11 428.45 959.36 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.47 301.33 395.69 407.56 437.59 938.05 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.00 327.80 394.06 422.00 445.99 914.41 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.63 351.55 392.97 438.17 454.82 888.61 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.56 370.15 392.93 450.93 470.62 860.84 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.15 382.57 394.18 456.90 497.02 831.40 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.92 389.29 397.06 460.14 528.44 800.71 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.51 392.41 400.57 462.00 561.43 769.64 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.68 394.11 403.12 462.98 592.65 740.22 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.30 394.96 404.38 463.39 615.25 718.66 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.30 394.96 404.38 463.39 615.25 718.66 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.68 394.11 403.12 462.98 592.65 740.22 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.51 392.41 400.57 462.00 561.43 769.64 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.92 389.29 397.06 460.14 528.44 800.71 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.15 382.57 394.18 456.90 497.02 831.40 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.56 370.15 392.93 450.93 470.62 860.84 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.63 351.55 392.97 438.17 454.82 888.61 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.00 327.80 394.06 422.00 445.99 914.41 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.47 301.33 395.69 407.56 437.59 938.05 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.96 274.53 390.96 401.11 428.45 959.36 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.34 249.20 377.53 403.86 418.69 978.20 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 218.70 228.30 363.27 405.28 410.81 994.41 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 202.70 220.48 349.04 396.94 412.91 1007.82 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 186.76 219.87 335.73 387.94 416.28 1018.20 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 175.16 221.78 324.86 380.93 418.91 1025.32 -------------------------------------------------------------------------------- K point *** = 0.140625 0.859375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 169.05 223.73 318.53 377.08 420.33 1028.94 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 150.96 197.12 288.36 381.15 415.89 1047.40 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 156.63 198.45 290.21 384.85 416.21 1044.18 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 168.46 199.07 298.53 391.52 415.19 1037.41 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.08 201.01 311.42 399.75 413.17 1027.48 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 203.03 208.14 327.02 406.88 411.94 1014.70 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.73 229.55 344.16 405.60 418.39 999.30 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.85 254.15 362.34 402.36 425.98 981.43 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.95 279.32 381.53 399.41 432.77 961.17 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.04 303.52 395.42 403.90 438.82 938.62 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.20 325.14 394.13 425.37 445.59 913.88 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.63 342.98 393.01 439.95 462.33 887.12 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.75 356.74 392.58 444.62 491.36 858.57 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.10 366.73 392.77 446.92 524.25 828.61 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.34 373.54 393.34 448.44 558.17 797.95 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.24 377.77 393.88 449.70 590.73 768.11 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.63 380.01 393.95 450.91 617.23 743.27 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.37 380.75 393.26 452.10 626.76 734.10 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.36 380.37 391.70 453.09 611.66 748.19 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.58 379.21 389.19 453.58 582.59 774.98 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.11 377.29 385.76 453.24 548.86 805.51 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.20 373.15 382.55 451.68 514.47 836.51 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.26 364.24 381.32 448.14 482.24 866.70 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.76 349.76 381.72 439.12 457.47 895.47 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.29 329.42 383.20 420.06 446.10 922.44 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.51 304.09 385.40 400.54 438.52 947.35 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.20 276.02 381.39 390.00 430.60 970.01 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.27 247.53 365.29 393.16 421.92 990.23 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 202.70 220.48 349.04 396.94 412.91 1007.82 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.45 197.20 332.97 398.29 406.38 1022.56 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 175.72 192.24 317.57 391.99 408.04 1034.18 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 160.83 192.27 303.84 385.26 411.44 1042.36 -------------------------------------------------------------------------------- K point *** = 0.140625 0.890625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.33 194.57 293.40 381.30 414.23 1046.82 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 134.36 168.85 261.56 385.27 410.42 1063.20 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 139.27 172.95 258.79 388.77 412.39 1060.46 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 151.00 176.81 263.64 395.07 413.11 1054.09 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 167.68 181.18 275.33 402.53 412.61 1044.64 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 186.72 188.56 291.94 408.76 412.20 1032.55 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.82 209.82 311.87 407.73 417.48 1018.04 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 208.92 232.73 334.27 404.96 423.02 1001.20 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.87 255.62 358.81 402.09 427.56 982.03 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.63 277.53 385.03 399.83 431.28 960.58 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.28 297.64 396.07 413.95 435.64 936.89 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.10 315.39 394.50 429.52 453.10 911.10 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.55 330.54 393.05 432.20 485.01 883.39 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.29 343.00 391.80 433.02 519.72 854.12 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.07 352.79 390.49 433.63 554.93 823.86 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.71 359.97 388.80 434.62 588.86 793.83 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.06 364.68 386.55 436.27 618.17 767.02 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.89 367.16 383.81 438.44 634.77 751.35 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.93 367.76 380.83 440.79 627.98 757.38 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.94 367.01 377.71 442.84 602.58 780.41 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.87 365.28 374.45 444.19 569.37 809.79 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.98 361.64 371.85 444.46 533.58 840.69 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.74 354.35 371.10 443.20 497.88 871.27 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.70 342.80 371.90 438.84 465.38 900.70 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.42 326.41 373.74 423.13 445.90 928.50 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.50 304.67 376.31 398.43 438.32 954.37 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.57 278.29 374.59 380.53 431.72 978.08 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 200.36 249.25 354.69 383.80 424.38 999.42 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 186.76 219.87 335.73 387.94 416.28 1018.20 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 175.72 192.24 317.57 391.99 408.04 1034.18 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 166.85 169.53 300.22 393.71 402.42 1047.04 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 149.17 165.12 284.22 389.46 403.96 1056.41 -------------------------------------------------------------------------------- K point *** = 0.140625 0.921875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 137.63 165.62 270.74 385.60 407.42 1061.88 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 120.37 141.28 237.88 389.34 404.32 1076.08 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 124.11 146.44 231.13 392.54 407.56 1074.04 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 135.39 153.40 232.16 398.35 409.91 1068.19 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 151.49 161.14 241.90 404.85 411.10 1059.32 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 170.15 170.32 259.19 410.08 411.62 1048.00 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 181.57 190.30 281.93 409.53 415.64 1034.44 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 195.17 210.88 308.45 407.56 419.07 1018.66 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.23 231.50 337.71 405.19 421.42 1000.58 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.74 251.73 368.86 402.92 422.94 980.17 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.82 271.17 396.23 405.21 424.79 957.46 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.84 289.41 397.05 419.17 442.53 932.55 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.45 306.03 395.21 419.65 477.19 905.61 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.42 320.66 393.12 418.90 513.77 876.96 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.64 332.97 390.50 418.46 550.42 847.08 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.99 342.69 387.00 419.03 585.81 816.98 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.34 349.68 382.55 420.89 617.45 788.89 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.40 354.00 377.50 423.80 639.37 768.67 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.76 355.87 372.51 427.26 640.83 766.98 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.92 355.66 368.18 430.68 620.45 785.22 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.60 353.69 364.93 433.58 588.82 812.88 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.97 349.55 363.21 435.56 552.78 843.36 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.62 342.62 363.18 436.28 515.33 874.08 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.19 332.55 364.45 435.08 478.61 903.92 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.30 318.86 366.62 427.67 448.14 932.31 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.48 300.88 369.46 402.41 436.87 958.87 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 208.26 278.13 371.96 374.58 431.43 983.37 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 191.25 251.18 347.81 376.79 425.64 1005.58 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 175.16 221.78 324.86 380.93 418.91 1025.32 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 160.83 192.27 303.84 385.26 411.44 1042.36 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 149.17 165.12 284.22 389.46 403.96 1056.41 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 139.32 144.77 266.11 391.90 399.04 1067.05 -------------------------------------------------------------------------------- K point *** = 0.140625 0.953125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 126.06 139.79 250.21 389.86 400.74 1073.75 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 110.18 117.91 217.29 393.16 398.78 1085.62 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 112.09 121.58 207.57 395.69 402.46 1084.72 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 122.58 129.92 205.29 400.90 405.80 1079.71 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 137.37 141.14 212.81 406.25 408.52 1071.60 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 153.80 153.86 230.36 410.10 410.30 1061.15 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 167.94 171.20 255.50 410.52 412.70 1048.59 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 183.56 189.33 285.42 409.59 414.12 1033.83 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.91 208.26 318.28 407.89 414.63 1016.75 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.00 227.86 352.91 406.03 414.33 997.28 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.19 247.62 387.09 405.58 413.68 975.42 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.20 266.85 399.26 409.80 430.80 951.27 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.89 284.90 398.33 407.58 467.70 924.99 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.15 301.25 396.36 405.04 505.94 896.87 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.90 315.44 392.87 403.74 544.00 867.35 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.04 327.06 387.65 404.31 580.82 837.23 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.39 335.81 381.32 406.43 614.50 808.27 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.67 341.53 374.55 409.76 640.60 784.82 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.37 344.32 368.09 413.86 649.62 776.30 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.82 344.47 362.80 418.20 635.45 788.85 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.47 342.20 359.42 422.26 606.41 814.17 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.39 337.62 358.14 425.62 570.96 843.95 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.21 330.66 358.59 427.97 532.90 874.61 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.70 321.20 360.26 428.92 494.19 904.71 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.50 308.93 362.73 427.12 457.23 933.50 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.15 293.42 365.76 410.66 434.94 960.57 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 205.11 274.15 369.21 378.26 429.65 985.64 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 186.89 250.77 346.74 373.04 425.43 1008.49 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 169.05 223.73 318.53 377.08 420.33 1028.94 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.33 194.57 293.40 381.30 414.23 1046.82 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 137.63 165.62 270.74 385.60 407.42 1061.88 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 126.06 139.79 250.21 389.86 400.74 1073.75 -------------------------------------------------------------------------------- K point *** = 0.140625 0.984375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 117.91 121.40 232.07 393.33 396.34 1081.88 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 124.87 129.73 247.89 392.03 396.08 1076.79 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 121.06 130.12 234.70 392.57 400.04 1078.69 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 126.56 135.64 226.58 396.71 404.04 1076.10 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 138.23 144.94 225.87 402.72 407.63 1069.75 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.83 156.31 234.43 408.30 410.53 1060.57 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 168.80 168.82 251.91 412.28 412.46 1049.19 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.67 185.75 275.95 412.89 415.02 1035.74 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.83 203.69 304.18 412.25 416.58 1020.15 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.37 222.75 335.09 410.96 417.22 1002.31 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.39 242.65 367.60 409.65 417.10 982.14 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.45 262.62 397.80 410.65 417.77 959.65 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.30 281.85 404.09 412.74 441.97 934.93 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.83 299.65 402.97 411.19 477.79 908.16 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.92 315.47 400.15 410.44 514.74 879.63 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.51 328.90 395.54 411.35 551.57 849.86 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.48 339.63 389.61 413.70 587.04 819.82 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.67 347.55 382.87 417.14 618.73 791.74 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.80 352.68 375.87 421.26 640.76 771.41 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.36 355.23 369.29 425.57 642.48 769.42 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.73 355.39 363.96 429.58 622.28 787.38 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.48 353.36 360.45 432.88 590.61 814.94 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.73 349.04 358.92 435.13 554.36 845.44 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.12 342.12 359.10 436.02 516.58 876.22 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.38 332.22 360.52 434.90 479.42 906.18 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 239.15 318.74 362.81 427.54 448.40 934.70 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 221.98 300.89 365.74 402.00 436.81 961.43 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 204.37 278.08 369.13 372.88 431.29 986.10 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 186.89 250.77 346.74 373.04 425.43 1008.49 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 170.17 220.76 323.62 377.20 418.64 1028.40 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 155.01 190.53 302.47 381.59 411.10 1045.58 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 142.36 162.71 282.69 386.09 403.46 1059.71 -------------------------------------------------------------------------------- K point *** = 0.171875 0.015625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 133.13 140.29 264.29 390.46 397.05 1070.31 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 121.06 130.12 234.70 392.57 400.04 1078.69 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 110.72 128.94 220.79 390.62 402.93 1082.83 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 110.67 132.49 212.50 392.07 405.88 1082.51 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 120.14 138.70 212.17 396.79 408.04 1078.08 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 135.98 146.19 221.16 402.81 409.08 1070.34 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 154.95 155.49 238.57 407.78 409.49 1059.99 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 166.71 175.86 262.19 407.09 413.30 1047.32 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 180.63 196.89 290.15 404.89 416.56 1032.35 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.26 217.70 321.19 402.22 418.73 1015.03 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.57 237.92 354.37 399.52 419.97 995.31 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.68 257.26 387.16 398.47 420.90 973.22 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.91 275.45 392.85 414.91 432.18 948.88 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.80 292.22 390.75 415.85 467.22 922.44 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.10 307.25 388.52 414.32 504.99 894.18 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.63 320.21 386.12 412.58 542.83 864.56 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.27 330.74 383.23 411.45 579.54 834.38 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.86 338.53 379.57 411.60 613.15 805.39 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.13 343.44 375.18 413.28 639.17 781.99 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.63 345.65 370.57 416.18 648.00 773.69 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.83 345.52 366.46 419.71 633.62 786.51 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.38 343.25 363.57 423.24 604.57 811.97 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.43 338.69 362.34 426.26 569.28 841.76 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.55 331.63 362.70 428.38 531.49 872.38 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.41 321.96 364.23 429.20 493.17 902.38 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.60 309.47 366.58 427.33 456.70 931.06 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.64 293.78 369.51 410.86 434.97 957.99 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.01 274.42 372.65 379.18 429.80 982.90 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 191.25 251.18 347.81 376.79 425.64 1005.58 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 174.00 224.56 319.96 380.80 420.60 1025.87 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 158.05 196.06 295.07 384.99 414.55 1043.59 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 144.34 167.87 272.60 389.17 407.81 1058.55 -------------------------------------------------------------------------------- K point *** = 0.171875 0.046875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 133.61 142.96 252.35 392.74 401.54 1070.41 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 126.56 135.64 226.58 396.71 404.04 1076.10 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 110.67 132.49 212.50 392.07 405.88 1082.51 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 103.98 132.52 205.37 390.01 407.22 1084.95 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 108.39 134.08 207.03 391.92 407.43 1083.16 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 122.38 137.25 217.34 396.84 406.52 1077.46 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 141.60 144.38 234.38 401.62 405.95 1068.45 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.66 166.58 256.31 400.31 410.41 1056.62 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 165.72 191.12 282.06 397.05 415.37 1042.18 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 181.12 215.15 311.09 393.46 419.31 1025.23 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.85 237.67 342.95 389.89 422.18 1005.80 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.00 258.14 376.27 387.18 424.28 983.99 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.84 276.42 382.57 410.52 428.53 959.89 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.80 292.52 379.84 420.50 455.88 933.68 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.41 306.47 377.37 420.14 493.54 905.62 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.27 318.26 375.33 418.34 531.97 876.10 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.05 327.75 373.80 416.00 569.63 845.81 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.39 334.71 372.80 413.68 604.83 816.12 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.95 338.99 372.14 412.06 634.08 790.37 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.34 340.76 371.37 411.77 649.32 776.53 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.27 340.31 370.27 412.99 641.58 783.52 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.74 337.61 369.27 415.34 615.94 806.29 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.98 332.42 369.06 418.12 582.14 835.18 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.46 324.69 369.86 420.72 544.96 865.57 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.62 314.53 371.52 422.64 506.54 895.58 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.94 302.01 373.84 423.23 468.40 924.37 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.85 287.06 376.62 417.97 435.79 951.46 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 217.81 269.52 379.34 389.52 427.12 976.54 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 200.36 249.25 354.69 383.80 424.38 999.42 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 183.15 226.28 322.93 387.49 421.13 1019.94 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 166.97 201.15 294.03 391.38 416.84 1038.00 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.80 175.03 268.21 395.17 411.51 1053.49 -------------------------------------------------------------------------------- K point *** = 0.171875 0.078125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 141.50 149.95 245.57 398.22 405.81 1066.28 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 138.23 144.94 225.87 402.72 407.63 1069.75 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 120.14 138.70 212.17 396.79 408.04 1078.08 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 108.39 134.08 207.03 391.92 407.43 1083.16 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 106.28 130.88 210.93 390.22 405.67 1084.28 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 115.03 130.63 222.19 392.34 403.19 1081.08 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 131.15 136.49 238.58 395.58 401.94 1073.82 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 141.99 158.16 258.52 393.74 406.60 1063.03 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 154.54 184.96 281.27 389.93 412.89 1049.18 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 169.71 212.39 306.77 385.85 418.58 1032.58 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 186.53 238.37 335.26 381.85 423.24 1013.41 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 204.10 261.57 366.56 378.26 426.92 991.79 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 221.71 281.47 374.26 400.34 430.58 967.87 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.79 298.13 371.20 423.20 445.63 941.84 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.84 311.88 368.56 426.12 480.90 913.93 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.37 322.96 366.56 425.39 519.23 884.49 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.89 331.54 365.46 423.35 557.43 854.09 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.81 337.61 365.60 420.53 593.84 823.86 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.57 341.23 367.14 417.34 625.65 796.31 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.79 342.58 369.75 414.36 646.39 777.78 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.48 341.76 372.67 412.26 645.81 778.46 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.01 338.48 375.31 411.58 624.45 797.81 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.80 332.45 377.55 412.38 592.62 825.54 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.20 323.67 379.57 414.15 556.48 855.62 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.46 312.41 381.63 416.21 518.60 885.65 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.79 298.98 383.87 417.88 480.37 914.58 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.46 283.60 386.31 417.81 443.61 941.85 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.80 266.42 388.28 401.46 423.94 967.14 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.27 247.53 365.29 393.16 421.92 990.23 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.52 227.07 331.67 396.15 420.29 1010.98 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 180.36 205.26 300.03 399.39 417.79 1029.33 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 165.77 182.59 271.27 402.45 414.19 1045.24 -------------------------------------------------------------------------------- K point *** = 0.171875 0.109375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 153.69 159.90 246.17 404.79 409.63 1058.72 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.83 156.31 234.43 408.30 410.53 1060.57 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 135.98 146.19 221.16 402.81 409.08 1070.34 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 122.38 137.25 217.34 396.84 406.52 1077.46 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 115.03 130.63 222.19 392.34 403.19 1081.08 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 117.03 128.22 233.46 391.23 399.54 1080.39 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 127.59 132.81 248.97 392.19 397.60 1075.15 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 136.95 152.17 267.21 389.26 402.24 1065.74 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 148.71 178.75 287.36 385.02 409.32 1052.75 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 163.31 208.08 309.27 380.68 416.47 1036.67 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 179.78 237.43 333.35 376.47 422.88 1017.83 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.25 264.49 360.36 372.55 428.32 996.47 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.01 287.60 368.82 390.68 433.08 972.76 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.49 306.26 365.63 420.10 440.79 946.91 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.17 320.89 362.98 431.13 468.11 919.15 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.54 332.09 361.03 432.50 505.10 889.79 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.04 340.37 360.11 431.63 543.23 859.34 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.98 346.00 360.65 429.43 580.37 828.67 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.65 349.23 363.03 426.26 614.13 799.72 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.66 350.31 367.19 422.45 639.40 777.36 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.16 349.15 372.66 418.47 646.10 771.57 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.72 345.44 378.70 414.87 629.95 786.58 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.92 338.93 384.52 412.24 600.57 812.81 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.11 329.56 389.44 411.01 565.79 842.51 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.51 317.46 393.12 411.30 528.86 872.57 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.23 302.95 395.73 412.65 491.32 901.68 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.36 286.42 397.68 414.08 454.30 929.21 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.01 268.34 398.41 411.34 423.03 954.79 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.34 249.20 377.53 403.86 418.69 978.20 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.73 229.55 344.16 405.60 418.39 999.30 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.82 209.82 311.87 407.73 417.48 1018.04 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 181.57 190.30 281.93 409.53 415.64 1034.44 -------------------------------------------------------------------------------- K point *** = 0.171875 0.140625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 167.94 171.20 255.50 410.52 412.70 1048.59 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 168.80 168.82 251.91 412.28 412.46 1049.19 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 154.95 155.49 238.57 407.78 409.49 1059.99 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 141.60 144.38 234.38 401.62 405.95 1068.45 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 131.15 136.49 238.58 395.58 401.94 1073.82 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 127.59 132.81 248.97 392.19 397.60 1075.15 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 133.91 133.91 263.38 393.02 393.02 1071.88 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 139.78 150.20 280.22 388.32 397.79 1064.10 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 149.80 174.19 298.47 383.63 405.01 1052.31 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 163.00 202.99 317.67 379.04 413.13 1037.07 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 178.42 233.91 337.92 374.66 421.06 1018.82 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 195.15 264.38 359.95 370.59 428.23 997.89 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.48 291.77 366.91 384.93 434.56 974.53 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.77 314.13 363.73 412.70 441.12 948.96 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.49 331.04 361.14 433.44 457.40 921.43 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.10 343.30 359.34 438.76 490.43 892.21 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.02 351.88 358.57 439.75 527.53 861.76 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.54 357.50 359.23 438.87 564.79 830.77 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.95 360.58 361.78 436.59 599.85 800.74 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.80 361.37 366.40 433.21 628.69 775.31 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.25 359.90 372.70 429.07 642.36 763.22 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.87 356.08 379.90 424.57 632.41 772.85 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.23 349.73 387.24 420.17 606.01 797.06 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.72 340.67 394.20 416.32 572.81 826.28 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.56 328.83 400.43 413.30 537.08 856.38 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.89 314.34 405.75 411.18 500.66 885.75 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.78 297.51 409.79 410.07 464.66 913.64 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.34 278.79 407.69 413.34 430.98 939.64 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.68 258.81 389.99 414.72 415.57 963.51 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.97 238.37 358.62 413.99 416.77 985.12 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.45 218.43 327.63 414.69 417.00 1004.43 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 198.44 199.93 298.63 415.17 416.30 1021.47 -------------------------------------------------------------------------------- K point *** = 0.171875 0.171875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 183.36 183.47 272.76 414.61 414.76 1036.35 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.67 185.75 275.95 412.89 415.02 1035.74 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 166.71 175.86 262.19 407.09 413.30 1047.32 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.66 166.58 256.31 400.31 410.41 1056.62 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 141.99 158.16 258.52 393.74 406.60 1063.03 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 136.95 152.17 267.21 389.26 402.24 1065.74 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 139.78 150.20 280.22 388.32 397.79 1064.10 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 149.99 154.49 295.77 389.20 395.53 1057.96 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 158.62 172.94 312.60 385.92 400.63 1047.61 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 169.39 199.08 329.94 381.34 408.93 1033.53 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.82 229.18 347.52 376.82 417.93 1016.19 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 198.07 260.90 365.54 372.70 426.64 995.98 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 214.35 291.72 368.78 385.30 434.61 973.20 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 230.94 318.76 365.64 407.68 442.06 948.11 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.24 339.74 363.19 431.15 452.10 920.95 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.66 354.37 361.64 443.24 476.72 892.01 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.61 360.74 364.41 446.88 511.12 861.66 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.42 361.66 370.28 447.77 547.63 830.51 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.43 364.11 373.48 446.91 583.29 799.67 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.20 368.05 374.68 444.63 614.75 771.80 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.76 370.72 376.53 441.24 634.65 753.94 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.53 368.20 382.30 437.11 631.90 757.05 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.01 362.73 388.88 432.72 609.14 778.49 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.55 354.74 395.04 428.61 577.68 807.05 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.36 344.11 400.22 425.33 543.25 837.21 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.52 330.81 404.09 423.24 508.17 866.91 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.11 314.97 406.61 422.26 473.76 895.25 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.21 296.98 407.91 420.98 441.84 921.79 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.91 277.47 401.43 412.64 426.04 946.28 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.44 257.27 374.01 412.43 424.26 968.57 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.22 237.27 345.83 413.70 422.86 988.61 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.04 218.08 319.43 414.86 420.69 1006.43 -------------------------------------------------------------------------------- K point *** = 0.171875 0.203125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.97 199.92 295.69 415.40 417.47 1022.11 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.83 203.69 304.18 412.25 416.58 1020.15 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 180.63 196.89 290.15 404.89 416.56 1032.35 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 165.72 191.12 282.06 397.05 415.37 1042.18 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 154.54 184.96 281.27 389.93 412.89 1049.18 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 148.71 178.75 287.36 385.02 409.32 1052.75 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 149.80 174.19 298.47 383.63 405.01 1052.31 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 158.62 172.94 312.60 385.92 400.63 1047.61 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 173.88 176.89 328.18 389.12 398.68 1038.74 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.34 198.11 344.15 386.99 404.50 1026.03 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 192.79 225.56 359.89 382.76 413.86 1009.91 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 205.78 256.10 374.43 379.45 423.75 990.73 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 220.40 287.79 374.13 391.58 433.25 968.84 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 235.83 318.19 371.10 408.37 442.06 944.49 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.34 344.15 368.79 427.76 451.00 917.95 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.27 363.00 367.56 444.97 466.47 889.49 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.99 366.93 375.51 452.37 495.30 859.45 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.87 367.91 382.64 455.36 529.71 828.31 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.33 370.26 386.37 456.16 565.08 796.94 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.96 373.89 387.71 455.29 598.18 767.23 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.66 378.01 387.64 453.09 623.25 744.38 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.67 379.68 388.72 449.91 628.53 739.90 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.31 376.50 392.70 446.17 610.37 757.42 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.83 370.27 397.04 442.39 580.80 785.04 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.40 361.53 400.55 439.08 547.61 815.23 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.09 350.15 403.01 436.49 513.90 845.31 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.97 336.02 404.62 434.34 481.31 874.20 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.18 319.23 405.82 431.02 451.97 901.40 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.92 300.21 406.34 416.74 436.28 926.62 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.61 279.71 389.83 409.84 432.18 949.71 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 235.97 258.61 365.70 411.47 428.68 970.59 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.98 237.72 343.01 413.42 424.41 989.27 -------------------------------------------------------------------------------- K point *** = 0.171875 0.234375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.60 217.72 322.26 415.06 419.16 1005.78 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.37 222.75 335.09 410.96 417.22 1002.31 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.26 217.70 321.19 402.22 418.73 1015.03 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 181.12 215.15 311.09 393.46 419.31 1025.23 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 169.71 212.39 306.77 385.85 418.58 1032.58 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 163.31 208.08 309.27 380.68 416.47 1036.67 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 163.00 202.99 317.67 379.04 413.13 1037.07 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 169.39 199.08 329.94 381.34 408.93 1033.53 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.34 198.11 344.15 386.99 404.50 1026.03 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.86 202.31 358.84 392.96 402.39 1014.78 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 207.46 225.24 372.96 391.83 409.40 1000.07 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 217.51 252.77 383.49 390.96 420.04 982.23 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.96 282.78 382.27 401.40 430.89 961.53 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.85 313.59 379.42 414.18 441.13 938.26 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.31 342.72 377.28 428.43 450.70 912.65 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.56 366.77 376.20 444.44 461.64 884.97 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.89 376.06 383.45 455.86 482.07 855.51 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.70 377.32 393.08 461.12 512.28 824.67 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.45 379.72 398.08 463.55 546.10 793.11 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.76 383.09 400.10 464.11 579.75 762.13 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.48 386.91 400.20 463.22 608.65 735.28 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.64 390.00 399.51 461.23 622.33 722.57 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.39 390.03 399.97 458.50 610.34 734.35 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.83 386.30 401.78 455.42 582.90 760.53 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.05 379.93 403.30 452.30 550.78 790.67 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.15 370.99 404.08 449.26 518.22 821.15 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.23 358.98 404.39 446.00 487.42 850.65 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.49 343.47 404.71 441.06 460.81 878.58 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.30 324.57 405.35 427.59 445.57 904.61 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.22 303.14 404.36 409.68 439.25 928.58 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.06 280.52 386.93 409.46 433.58 950.37 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.86 258.02 368.58 411.79 427.17 969.93 -------------------------------------------------------------------------------- K point *** = 0.171875 0.265625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.27 236.99 351.19 414.19 419.95 987.25 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.39 242.65 367.60 409.65 417.10 982.14 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.57 237.92 354.37 399.52 419.97 995.31 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.85 237.67 342.95 389.89 422.18 1005.80 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 186.53 238.37 335.26 381.85 423.24 1013.41 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 179.78 237.43 333.35 376.47 422.88 1017.83 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 178.42 233.91 337.92 374.66 421.06 1018.82 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.82 229.18 347.52 376.82 417.93 1016.19 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 192.79 225.56 359.89 382.76 413.86 1009.91 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 207.46 225.24 372.96 391.83 409.40 1000.07 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.47 232.80 385.05 401.97 406.54 986.89 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.61 253.83 392.94 403.84 416.56 970.58 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.81 279.99 392.28 411.66 428.90 951.38 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.96 308.43 389.72 421.73 440.46 929.52 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.25 337.41 387.79 432.54 450.86 905.22 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.76 364.37 386.97 444.88 460.64 878.70 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.70 385.65 387.56 457.44 473.80 850.20 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.39 388.94 399.76 464.92 497.18 820.06 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.33 391.62 407.30 468.64 527.63 788.75 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.14 395.00 410.80 470.32 560.44 757.16 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.63 398.55 411.83 470.55 591.58 727.47 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.71 401.56 411.40 469.74 613.12 706.79 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.33 403.05 410.38 468.23 609.81 710.08 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.51 401.96 409.59 466.25 585.21 733.84 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.27 398.25 408.79 463.90 553.98 763.80 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.70 391.97 407.53 461.05 522.17 794.68 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.96 382.26 406.09 457.34 492.75 824.80 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.32 367.95 405.02 451.55 468.59 853.49 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.23 348.77 404.71 439.90 454.11 880.38 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.32 326.08 405.26 424.85 445.94 905.24 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.46 302.03 405.39 411.92 438.11 927.93 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.63 278.48 395.10 410.74 429.51 948.36 -------------------------------------------------------------------------------- K point *** = 0.171875 0.296875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.26 257.20 381.42 413.46 420.16 966.45 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.45 262.62 397.80 410.65 417.77 959.65 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.68 257.26 387.16 398.47 420.90 973.22 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.00 258.14 376.27 387.18 424.28 983.99 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 204.10 261.57 366.56 378.26 426.92 991.79 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.25 264.49 360.36 372.55 428.32 996.47 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 195.15 264.38 359.95 370.59 428.23 997.89 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 198.07 260.90 365.54 372.70 426.64 995.98 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 205.78 256.10 374.43 379.45 423.75 990.73 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 217.51 252.77 383.49 390.96 420.04 982.23 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.61 253.83 392.94 403.84 416.56 970.58 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 244.08 263.63 401.53 411.02 420.23 955.94 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.88 282.77 403.23 416.62 432.09 938.49 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.59 306.48 401.04 425.93 443.53 918.37 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.78 332.34 399.30 435.71 453.67 895.76 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.69 358.54 398.76 446.10 462.56 870.82 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.39 382.47 399.61 457.55 471.62 843.76 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.12 400.59 402.04 466.89 486.72 814.83 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.30 404.85 412.48 471.55 511.40 784.35 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.54 408.55 418.63 473.71 541.50 752.91 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.58 412.13 421.49 474.50 572.96 721.74 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.26 414.88 422.37 474.49 600.41 694.79 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.43 416.23 422.01 474.09 609.02 686.27 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.03 415.87 420.67 473.47 589.38 705.46 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.10 413.91 418.17 472.54 559.24 734.92 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.76 410.47 414.09 470.91 527.97 766.14 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.20 403.51 409.72 467.99 499.44 796.89 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.72 390.10 406.81 462.55 477.26 826.33 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.76 370.44 405.12 452.45 464.38 854.05 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.98 346.79 404.71 441.15 455.68 879.78 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.25 322.05 405.54 430.98 446.45 903.34 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.52 298.33 407.11 421.58 435.91 924.59 -------------------------------------------------------------------------------- K point *** = 0.171875 0.328125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.22 277.39 406.20 415.23 424.30 943.40 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.30 281.85 404.09 412.74 441.97 934.93 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.91 275.45 392.85 414.91 432.18 948.88 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.84 276.42 382.57 410.52 428.53 959.89 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 221.71 281.47 374.26 400.34 430.58 967.87 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.01 287.60 368.82 390.68 433.08 972.76 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.48 291.77 366.91 384.93 434.56 974.53 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 214.35 291.72 368.78 385.30 434.61 973.20 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 220.40 287.79 374.13 391.58 433.25 968.84 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.96 282.78 382.27 401.40 430.89 961.53 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.81 279.99 392.28 411.66 428.90 951.38 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.88 282.77 403.23 416.62 432.09 938.49 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.16 293.61 413.78 415.69 441.35 922.95 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.96 310.84 412.41 425.42 451.21 904.85 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.15 331.53 410.71 435.81 460.07 884.30 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.64 353.97 410.39 445.98 467.64 861.40 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.48 376.53 411.65 456.44 474.36 836.30 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.64 396.80 414.43 466.68 482.85 809.15 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.37 412.10 418.38 472.79 499.47 780.21 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.19 421.70 422.95 474.95 524.48 749.82 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.76 426.43 427.94 475.41 553.96 718.65 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.82 428.78 431.54 475.30 584.03 688.40 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.22 429.19 433.48 475.38 605.79 666.89 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.90 427.61 433.75 475.94 596.84 676.10 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.98 424.17 432.29 476.70 569.01 704.41 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.68 419.50 428.37 476.92 539.07 735.89 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.24 414.48 420.50 475.48 512.32 767.19 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.92 406.83 409.97 470.29 493.18 797.33 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.13 387.15 406.59 460.39 483.15 825.82 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.46 363.79 404.79 449.38 476.61 852.37 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.80 339.65 404.69 438.55 469.81 876.73 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.11 316.73 406.18 427.52 461.78 898.72 -------------------------------------------------------------------------------- K point *** = 0.171875 0.359375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.95 296.63 408.84 416.22 452.38 918.16 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.83 299.65 402.97 411.19 477.79 908.16 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.80 292.22 390.75 415.85 467.22 922.44 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.80 292.52 379.84 420.50 455.88 933.68 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.79 298.13 371.20 423.20 445.63 941.84 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.49 306.26 365.63 420.10 440.79 946.91 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.77 314.13 363.73 412.70 441.12 948.96 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 230.94 318.76 365.64 407.68 442.06 948.11 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 235.83 318.19 371.10 408.37 442.06 944.49 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.85 313.59 379.42 414.18 441.13 938.26 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.96 308.43 389.72 421.73 440.46 929.52 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.59 306.48 401.04 425.93 443.53 918.37 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.96 310.84 412.41 425.42 451.21 904.85 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.27 321.81 420.41 426.63 459.81 889.00 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.64 337.03 420.29 435.92 467.61 870.84 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.08 354.46 420.31 445.81 474.15 850.40 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.99 372.95 421.98 455.42 479.49 827.77 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.06 391.27 425.45 464.87 484.65 803.05 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.00 407.59 430.33 472.42 493.53 776.39 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.94 420.34 435.61 475.25 511.04 748.03 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.35 429.59 440.15 474.96 535.89 718.33 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.86 435.98 443.36 473.57 564.87 687.97 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 364.32 439.16 445.27 472.69 594.20 659.07 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.80 438.25 445.89 473.52 606.88 647.88 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.61 433.85 444.48 475.80 584.61 672.72 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.10 427.48 439.97 478.00 557.49 704.33 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.62 420.44 431.27 478.03 534.10 736.10 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.40 413.51 417.69 473.69 518.11 766.84 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.78 398.18 408.89 464.77 509.65 796.01 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.26 376.59 405.26 453.62 504.72 823.25 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.71 354.28 403.82 441.62 500.07 848.31 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.15 333.01 404.47 429.07 494.30 870.94 -------------------------------------------------------------------------------- K point *** = 0.171875 0.390625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.33 314.16 406.92 416.22 486.89 890.95 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.92 315.47 400.15 410.44 514.74 879.63 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.10 307.25 388.52 414.32 504.99 894.18 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.41 306.47 377.37 420.14 493.54 905.62 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.84 311.88 368.56 426.12 480.90 913.93 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.17 320.89 362.98 431.13 468.11 919.15 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.49 331.04 361.14 433.44 457.40 921.43 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.24 339.74 363.19 431.15 452.10 920.95 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.34 344.15 368.79 427.76 451.00 917.95 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.31 342.72 377.28 428.43 450.70 912.65 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.25 337.41 387.79 432.54 450.86 905.22 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.78 332.34 399.30 435.71 453.67 895.76 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.15 331.53 410.71 435.81 460.07 884.30 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.64 337.03 420.29 435.92 467.61 870.84 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.09 347.54 425.00 440.44 474.62 855.32 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.72 360.66 426.54 448.48 480.46 837.74 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.11 374.81 428.74 456.78 485.04 818.08 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.38 389.16 432.86 464.53 488.77 796.38 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.89 402.94 438.91 471.23 493.34 772.75 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.87 415.32 445.83 475.07 502.83 747.35 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.99 426.04 451.74 474.97 520.43 720.45 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 371.49 435.47 455.42 472.35 544.92 692.43 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.17 443.40 456.62 469.02 573.77 663.91 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 371.37 446.87 455.90 467.77 604.16 636.43 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.71 442.84 453.37 471.01 605.37 640.41 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.78 435.15 447.21 475.54 581.55 672.24 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.06 426.38 437.17 477.58 561.58 704.34 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.83 417.50 423.48 475.01 547.91 735.47 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.35 404.70 411.51 467.61 540.28 765.12 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.07 385.73 405.67 456.88 536.09 792.90 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.78 365.91 402.53 444.35 532.66 818.48 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.56 346.76 401.87 430.92 528.41 841.61 -------------------------------------------------------------------------------- K point *** = 0.171875 0.421875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.27 329.44 403.07 417.57 522.54 862.06 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.51 328.90 395.54 411.35 551.57 849.86 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.63 320.21 386.12 412.58 542.83 864.56 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.27 318.26 375.33 418.34 531.97 876.10 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.37 322.96 366.56 425.39 519.23 884.49 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.54 332.09 361.03 432.50 505.10 889.79 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.10 343.30 359.34 438.76 490.43 892.21 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.66 354.37 361.64 443.24 476.72 892.01 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.27 363.00 367.56 444.97 466.47 889.49 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.56 366.77 376.20 444.44 461.64 884.97 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.76 364.37 386.97 444.88 460.64 878.70 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.69 358.54 398.76 446.10 462.56 870.82 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.64 353.97 410.39 445.98 467.64 861.40 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.08 354.46 420.31 445.81 474.15 850.40 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.72 360.66 426.54 448.48 480.46 837.74 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.36 370.32 429.27 454.49 485.84 823.31 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.04 381.28 431.57 461.38 490.07 807.05 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.07 392.25 435.52 467.51 493.30 788.93 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.47 402.52 441.96 472.22 496.25 769.00 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.33 411.78 450.55 475.04 500.70 747.40 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.27 420.46 459.02 475.43 509.95 724.37 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 377.08 429.60 464.29 473.24 526.85 700.29 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 379.78 439.61 465.52 469.06 550.65 675.73 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 377.97 448.71 463.29 464.49 578.77 651.52 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 372.84 449.11 458.68 465.63 608.11 629.71 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.39 441.22 450.63 472.08 606.11 642.77 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.29 431.31 439.69 476.04 590.07 673.88 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.94 420.77 426.41 475.34 578.65 704.70 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.61 408.29 413.79 469.60 571.97 734.33 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.69 392.02 405.56 459.81 568.37 762.24 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.89 374.78 400.42 447.41 565.81 788.04 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.24 357.84 398.08 433.73 562.72 811.41 -------------------------------------------------------------------------------- K point *** = 0.171875 0.453125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.69 342.12 397.75 420.27 558.14 832.09 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.48 339.63 389.61 413.70 587.04 819.82 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.27 330.74 383.23 411.45 579.54 834.38 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.05 327.75 373.80 416.00 569.63 845.81 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.89 331.54 365.46 423.35 557.43 854.09 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.04 340.37 360.11 431.63 543.23 859.34 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.02 351.88 358.57 439.75 527.53 861.76 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.61 360.74 364.41 446.88 511.12 861.66 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.99 366.93 375.51 452.37 495.30 859.45 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.89 376.06 383.45 455.86 482.07 855.51 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.70 385.65 387.56 457.44 473.80 850.20 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.39 382.47 399.61 457.55 471.62 843.76 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.48 376.53 411.65 456.44 474.36 836.30 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.99 372.95 421.98 455.42 479.49 827.77 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.11 374.81 428.74 456.78 485.04 818.08 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.04 381.28 431.57 461.38 490.07 807.05 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.93 389.81 433.01 467.18 494.24 794.54 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.49 398.54 435.58 472.17 497.56 780.47 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.87 406.35 440.66 475.47 500.24 764.83 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.97 412.67 448.73 476.90 502.74 747.72 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.69 417.80 458.87 476.58 506.35 729.38 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.90 423.29 467.62 474.76 514.18 710.20 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 382.36 431.15 470.67 471.70 529.72 690.79 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 381.55 440.63 467.70 468.13 551.90 672.11 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.35 446.60 460.92 466.44 576.97 655.86 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.49 443.32 451.31 470.38 599.22 646.67 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.03 434.25 439.90 474.72 606.89 655.99 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.56 422.62 427.63 475.32 603.59 680.01 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.43 409.68 415.49 471.10 600.12 707.07 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.02 395.80 405.01 462.52 598.25 733.72 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.95 381.14 397.47 450.83 597.07 758.84 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.14 366.30 393.17 437.43 595.37 781.80 -------------------------------------------------------------------------------- K point *** = 0.171875 0.484375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.52 352.09 391.39 424.02 592.22 802.23 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.67 347.55 382.87 417.14 618.73 791.74 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.86 338.53 379.57 411.60 613.15 805.39 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.39 334.71 372.80 413.68 604.83 816.12 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.81 337.61 365.60 420.53 593.84 823.86 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.98 346.00 360.65 429.43 580.37 828.67 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.54 357.50 359.23 438.87 564.79 830.77 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.42 361.66 370.28 447.77 547.63 830.51 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.87 367.91 382.64 455.36 529.71 828.31 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.70 377.32 393.08 461.12 512.28 824.67 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.39 388.94 399.76 464.92 497.18 820.06 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.12 400.59 402.04 466.89 486.72 814.83 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.64 396.80 414.43 466.68 482.85 809.15 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.06 391.27 425.45 464.87 484.65 803.05 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.38 389.16 432.86 464.53 488.77 796.38 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.07 392.25 435.52 467.51 493.30 788.93 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.49 398.54 435.58 472.17 497.56 780.47 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.69 405.59 435.99 476.16 501.27 770.84 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.04 411.82 438.55 478.53 504.21 759.97 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.47 416.28 444.18 479.24 506.20 747.89 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.74 418.83 452.80 478.59 507.41 734.81 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.39 420.55 462.69 476.89 509.14 721.07 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 378.50 423.85 469.53 474.48 515.05 707.21 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 380.56 430.63 468.36 472.37 528.75 694.03 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.36 437.81 461.31 470.61 548.27 682.67 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.61 439.78 450.63 471.54 569.64 674.85 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.03 434.60 438.24 474.39 589.18 673.10 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.56 422.62 427.63 475.32 603.59 680.01 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.74 409.03 416.71 472.22 612.28 695.24 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.99 396.43 405.07 464.92 617.46 715.11 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.87 384.66 394.52 454.26 620.69 736.22 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.12 372.24 387.58 441.56 622.20 756.66 -------------------------------------------------------------------------------- K point *** = 0.171875 0.515625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.58 359.39 384.37 428.40 621.67 775.37 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.80 352.68 375.87 421.26 640.76 771.41 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.13 343.44 375.18 413.28 639.17 781.99 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.95 338.99 372.14 412.06 634.08 790.37 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.57 341.23 367.14 417.34 625.65 796.31 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.65 349.23 363.03 426.26 614.13 799.72 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.95 360.58 361.78 436.59 599.85 800.74 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.43 364.11 373.48 446.91 583.29 799.67 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.33 370.26 386.37 456.16 565.08 796.94 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.45 379.72 398.08 463.55 546.10 793.11 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.33 391.62 407.30 468.64 527.63 788.75 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.30 404.85 412.48 471.55 511.40 784.35 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.37 412.10 418.38 472.79 499.47 780.21 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.00 407.59 430.33 472.42 493.53 776.39 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.89 402.94 438.91 471.23 493.34 772.75 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.47 402.52 441.96 472.22 496.25 769.00 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.87 406.35 440.66 475.47 500.24 764.83 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.04 411.82 438.55 478.53 504.21 759.97 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.63 416.82 438.00 480.28 507.39 754.24 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.67 419.99 440.32 480.73 509.19 747.61 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.86 420.86 445.84 480.17 509.41 740.16 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.69 420.13 453.65 478.80 508.47 732.12 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.15 419.61 461.40 476.82 508.18 723.88 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.77 422.16 464.03 475.14 512.46 716.01 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 372.14 428.07 458.63 474.18 524.05 709.24 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.40 432.71 448.23 473.89 540.76 704.48 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.17 432.02 435.21 474.91 559.62 702.71 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.94 420.77 426.41 475.34 578.65 704.70 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.55 406.73 417.18 472.88 596.39 710.74 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.56 394.12 405.93 466.71 611.79 720.34 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.49 383.82 393.71 457.25 624.19 732.47 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.94 375.05 382.67 445.53 633.24 745.80 -------------------------------------------------------------------------------- K point *** = 0.171875 0.546875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.59 364.17 377.19 432.93 638.79 759.11 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.36 355.23 369.29 425.57 642.48 769.42 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.63 345.65 370.57 416.18 648.00 773.69 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.34 340.76 371.37 411.77 649.32 776.53 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.79 342.58 369.75 414.36 646.39 777.78 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.66 350.31 367.19 422.45 639.40 777.36 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.80 361.37 366.40 433.21 628.69 775.31 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.20 368.05 374.68 444.63 614.75 771.80 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.96 373.89 387.71 455.29 598.18 767.23 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.76 383.09 400.10 464.11 579.75 762.13 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.14 395.00 410.80 470.32 560.44 757.16 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.54 408.55 418.63 473.71 541.50 752.91 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.19 421.70 422.95 474.95 524.48 749.82 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.94 420.34 435.61 475.25 511.04 748.03 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.87 415.32 445.83 475.07 502.83 747.35 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.33 411.78 450.55 475.04 500.70 747.40 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.97 412.67 448.73 476.90 502.74 747.72 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.47 416.28 444.18 479.24 506.20 747.89 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.67 419.99 440.32 480.73 509.19 747.61 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.75 422.09 438.89 481.28 510.70 746.68 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.40 421.71 440.70 481.00 510.34 745.04 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.07 419.31 445.27 479.92 508.29 742.77 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.83 416.31 451.13 478.03 505.42 740.08 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.06 415.16 455.21 476.04 503.80 737.31 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.58 418.19 452.85 475.46 506.71 734.93 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.86 423.47 443.95 475.39 516.06 733.50 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.55 426.05 431.52 475.35 530.44 733.56 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.83 417.50 423.48 475.01 547.91 735.47 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.94 403.44 416.34 472.79 566.91 739.29 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.67 390.60 406.17 467.59 586.02 744.68 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.59 380.10 394.15 459.37 604.04 751.04 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.24 372.69 381.30 448.85 619.96 757.68 -------------------------------------------------------------------------------- K point *** = 0.171875 0.578125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.08 366.44 370.73 437.11 632.98 763.97 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.73 355.39 363.96 429.58 622.28 787.38 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.83 345.52 366.46 419.71 633.62 786.51 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.27 340.31 370.27 412.99 641.58 783.52 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.48 341.76 372.67 412.26 645.81 778.46 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.16 349.15 372.66 418.47 646.10 771.57 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.25 359.90 372.70 429.07 642.36 763.22 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.76 370.72 376.53 441.24 634.65 753.94 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.66 378.01 387.64 453.09 623.25 744.38 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.48 386.91 400.20 463.22 608.65 735.28 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.63 398.55 411.83 470.55 591.58 727.47 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.58 412.13 421.49 474.50 572.96 721.74 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.76 426.43 427.94 475.41 553.96 718.65 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.35 429.59 440.15 474.96 535.89 718.33 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.99 426.04 451.74 474.97 520.43 720.45 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.27 420.46 459.02 475.43 509.95 724.37 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.69 417.80 458.87 476.58 506.35 729.38 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.74 418.83 452.80 478.59 507.41 734.81 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.86 420.86 445.84 480.17 509.41 740.16 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.40 421.71 440.70 481.00 510.34 745.04 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.04 420.29 438.59 481.01 509.54 749.23 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.22 416.63 439.59 480.01 507.05 752.65 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.07 411.91 442.63 477.85 503.42 755.33 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.18 408.04 445.66 474.99 499.63 757.45 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.58 407.71 445.05 473.46 497.18 759.31 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.30 411.80 438.24 474.09 498.40 761.27 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.41 416.58 427.00 474.42 505.47 763.69 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.40 413.51 417.69 473.69 518.11 766.84 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.01 399.86 413.28 471.56 534.74 770.73 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.29 387.02 404.75 467.19 553.51 775.15 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.98 376.24 393.52 460.25 572.77 779.61 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.59 368.49 380.82 451.10 591.23 783.52 -------------------------------------------------------------------------------- K point *** = 0.171875 0.609375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.48 364.30 367.80 440.52 607.96 786.28 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.48 353.36 360.45 432.88 590.61 814.94 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.38 343.25 363.57 423.24 604.57 811.97 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.74 337.61 369.27 415.34 615.94 806.29 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.01 338.48 375.31 411.58 624.45 797.81 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.72 345.44 378.70 414.87 629.95 786.58 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.87 356.08 379.90 424.57 632.41 772.85 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.53 368.20 382.30 437.11 631.90 757.05 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.67 379.68 388.72 449.91 628.53 739.90 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.64 390.00 399.51 461.23 622.33 722.57 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.71 401.56 411.40 469.74 613.12 706.79 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.26 414.88 422.37 474.49 600.41 694.79 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.82 428.78 431.54 475.30 584.03 688.40 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.86 435.98 443.36 473.57 564.87 687.97 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 371.49 435.47 455.42 472.35 544.92 692.43 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 377.08 429.60 464.29 473.24 526.85 700.29 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.90 423.29 467.62 474.76 514.18 710.20 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.39 420.55 462.69 476.89 509.14 721.07 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.69 420.13 453.65 478.80 508.47 732.12 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.07 419.31 445.27 479.92 508.29 742.77 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.22 416.63 439.59 480.01 507.05 752.65 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.52 411.85 437.13 478.77 504.53 761.53 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.13 405.74 437.20 475.97 500.97 769.33 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.87 399.76 438.29 471.99 496.86 776.12 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.86 396.21 437.68 468.67 492.67 782.06 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.35 397.47 432.31 468.34 489.17 787.41 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.09 402.61 422.33 469.97 488.31 792.43 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.92 406.83 409.97 470.29 493.18 797.33 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.94 396.59 406.54 468.60 504.41 802.16 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.54 384.05 400.59 465.11 520.15 806.78 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.63 373.29 390.73 459.55 538.18 810.88 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.82 365.34 378.62 451.96 556.69 813.95 -------------------------------------------------------------------------------- K point *** = 0.171875 0.640625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.44 360.95 365.71 442.81 574.45 815.47 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.73 349.04 358.92 435.13 554.36 845.44 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.43 338.69 362.34 426.26 569.28 841.76 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.98 332.42 369.06 418.12 582.14 835.18 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.80 332.45 377.55 412.38 592.62 825.54 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.92 338.93 384.52 412.24 600.57 812.81 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.23 349.73 387.24 420.17 606.01 797.06 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.01 362.73 388.88 432.72 609.14 778.49 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.31 376.50 392.70 446.17 610.37 757.42 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.39 390.03 399.97 458.50 610.34 734.35 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.33 403.05 410.38 468.23 609.81 710.08 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.43 416.23 422.01 474.09 609.02 686.27 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.22 429.19 433.48 475.38 605.79 666.89 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 364.32 439.16 445.27 472.69 594.20 659.07 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.17 443.40 456.62 469.02 573.77 663.91 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 379.78 439.61 465.52 469.06 550.65 675.73 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 382.36 431.15 470.67 471.70 529.72 690.79 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 378.50 423.85 469.53 474.48 515.05 707.21 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.15 419.61 461.40 476.82 508.18 723.88 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.83 416.31 451.13 478.03 505.42 740.08 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.07 411.91 442.63 477.85 503.42 755.33 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.13 405.74 437.20 475.97 500.97 769.33 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.16 398.21 434.61 472.27 497.84 781.94 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.13 390.36 433.70 467.21 493.98 793.13 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.48 383.91 432.34 462.32 489.43 803.00 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.08 381.40 427.58 460.05 484.42 811.69 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.08 384.30 418.51 460.87 479.73 819.42 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.72 390.10 406.81 462.55 477.26 826.33 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.03 393.46 394.62 462.61 480.23 832.51 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.69 382.06 392.08 460.63 489.73 837.90 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.83 371.57 384.71 456.83 504.01 842.28 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.18 363.72 373.83 451.10 520.69 845.28 -------------------------------------------------------------------------------- K point *** = 0.171875 0.671875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.14 359.26 361.46 443.68 537.89 846.48 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.12 342.12 359.10 436.02 516.58 876.22 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.55 331.63 362.70 428.38 531.49 872.38 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.46 324.69 369.86 420.72 544.96 865.57 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.20 323.67 379.57 414.15 556.48 855.62 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.11 329.56 389.44 411.01 565.79 842.51 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.72 340.67 394.20 416.32 572.81 826.28 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.55 354.74 395.04 428.61 577.68 807.05 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.83 370.27 397.04 442.39 580.80 785.04 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.83 386.30 401.78 455.42 582.90 760.53 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.51 401.96 409.59 466.25 585.21 733.84 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.03 415.87 420.67 473.47 589.38 705.46 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.90 427.61 433.75 475.94 596.84 676.10 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.80 438.25 445.89 473.52 606.88 647.88 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 371.37 446.87 455.90 467.77 604.16 636.43 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 377.97 448.71 463.29 464.49 578.77 651.52 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 381.55 440.63 467.70 468.13 551.90 672.11 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 380.56 430.63 468.36 472.37 528.75 694.03 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.77 422.16 464.03 475.14 512.46 716.01 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.06 415.16 455.21 476.04 503.80 737.31 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.18 408.04 445.66 474.99 499.63 757.45 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.87 399.76 438.29 471.99 496.86 776.12 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.13 390.36 433.70 467.21 493.98 793.13 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.99 380.50 431.22 461.14 490.31 808.41 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.23 371.36 429.18 455.03 485.62 821.99 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.97 364.98 424.72 451.21 479.98 833.95 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.16 363.80 416.19 450.73 473.90 844.41 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.32 367.95 405.02 451.55 468.59 853.49 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.72 373.89 392.96 451.68 466.04 861.28 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.18 376.73 381.40 451.39 467.57 867.74 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.06 370.92 374.01 450.66 474.27 872.76 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.24 363.21 365.76 447.83 486.19 876.07 -------------------------------------------------------------------------------- K point *** = 0.171875 0.703125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.22 353.92 359.55 442.75 501.02 877.34 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.38 332.22 360.52 434.90 479.42 906.18 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.41 321.96 364.23 429.20 493.17 902.38 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.62 314.53 371.52 422.64 506.54 895.58 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.46 312.41 381.63 416.21 518.60 885.65 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.51 317.46 393.12 411.30 528.86 872.57 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.56 328.83 400.43 413.30 537.08 856.38 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.36 344.11 400.22 425.33 543.25 837.21 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.40 361.53 400.55 439.08 547.61 815.23 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.05 379.93 403.30 452.30 550.78 790.67 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.27 398.25 408.79 463.90 553.98 763.80 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.10 413.91 418.17 472.54 559.24 734.92 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.98 424.17 432.29 476.70 569.01 704.41 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.61 433.85 444.48 475.80 584.61 672.72 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.71 442.84 453.37 471.01 605.37 640.41 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 372.84 449.11 458.68 465.63 608.11 629.71 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.35 446.60 460.92 466.44 576.97 655.86 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.36 437.81 461.31 470.61 548.27 682.67 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 372.14 428.07 458.63 474.18 524.05 709.24 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.58 418.19 452.85 475.46 506.71 734.93 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.58 407.71 445.05 473.46 497.18 759.31 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.86 396.21 437.68 468.67 492.67 782.06 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.48 383.91 432.34 462.32 489.43 803.00 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.23 371.36 429.18 455.03 485.62 821.99 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.06 359.33 427.19 447.51 480.65 839.02 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.52 349.19 423.59 442.02 474.48 854.08 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.46 343.29 415.60 440.69 467.50 867.25 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.49 343.47 404.71 441.06 460.81 878.58 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.63 348.35 392.99 439.86 456.55 888.12 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.59 353.96 381.72 437.13 455.51 895.87 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.91 355.87 371.98 436.56 456.10 901.76 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.63 351.76 364.73 438.57 458.95 905.60 -------------------------------------------------------------------------------- K point *** = 0.171875 0.734375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.37 342.98 360.73 438.52 467.03 907.16 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 239.15 318.74 362.81 427.54 448.40 934.70 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.60 309.47 366.58 427.33 456.70 931.06 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.94 302.01 373.84 423.23 468.40 924.37 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.79 298.98 383.87 417.88 480.37 914.58 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.23 302.95 395.73 412.65 491.32 901.68 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.89 314.34 405.75 411.18 500.66 885.75 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.52 330.81 404.09 423.24 508.17 866.91 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.09 350.15 403.01 436.49 513.90 845.31 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.15 370.99 404.08 449.26 518.22 821.15 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.70 391.97 407.53 461.05 522.17 794.68 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.76 410.47 414.09 470.91 527.97 766.14 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.68 419.50 428.37 476.92 539.07 735.89 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.10 427.48 439.97 478.00 557.49 704.33 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.78 435.15 447.21 475.54 581.55 672.24 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.39 441.22 450.63 472.08 606.11 642.77 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.49 443.32 451.31 470.38 599.22 646.67 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.61 439.78 450.63 471.54 569.64 674.85 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.40 432.71 448.23 473.89 540.76 704.48 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.86 423.47 443.95 475.39 516.06 733.50 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.30 411.80 438.24 474.09 498.40 761.27 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.35 397.47 432.31 468.34 489.17 787.41 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.08 381.40 427.58 460.05 484.42 811.69 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.97 364.98 424.72 451.21 479.98 833.95 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.52 349.19 423.59 442.02 474.48 854.08 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.49 335.02 422.73 433.44 467.68 872.04 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.11 324.22 416.57 430.36 459.84 887.81 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.18 319.23 405.82 431.02 451.97 901.40 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.57 320.64 394.27 429.46 446.69 912.79 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.62 325.79 383.24 423.96 445.72 921.98 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.02 330.77 373.73 418.82 446.23 928.90 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.98 331.73 366.67 418.10 446.33 933.44 -------------------------------------------------------------------------------- K point *** = 0.171875 0.765625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.24 327.13 362.86 422.50 446.16 935.44 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 221.98 300.89 365.74 402.00 436.81 961.43 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.64 293.78 369.51 410.86 434.97 957.99 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.85 287.06 376.62 417.97 435.79 951.46 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.46 283.60 386.31 417.81 443.61 941.85 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.36 286.42 397.68 414.08 454.30 929.21 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.78 297.51 409.79 410.07 464.66 913.64 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.11 314.97 406.61 422.26 473.76 895.25 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.97 336.02 404.62 434.34 481.31 874.20 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.23 358.98 404.39 446.00 487.42 850.65 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.96 382.26 406.09 457.34 492.75 824.80 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.20 403.51 409.72 467.99 499.44 796.89 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.24 414.48 420.50 475.48 512.32 767.19 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.62 420.44 431.27 478.03 534.10 736.10 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.06 426.38 437.17 477.58 561.58 704.34 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.29 431.31 439.69 476.04 590.07 673.88 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.03 434.25 439.90 474.72 606.89 655.99 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.03 434.60 438.24 474.39 589.18 673.10 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.17 432.02 435.21 474.91 559.62 702.71 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.55 426.05 431.52 475.35 530.44 733.56 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.41 416.58 427.00 474.42 505.47 763.69 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.09 402.61 422.33 469.97 488.31 792.43 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.08 384.30 418.51 460.87 479.73 819.42 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.16 363.80 416.19 450.73 473.90 844.41 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.46 343.29 415.60 440.69 467.50 867.25 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.11 324.22 416.57 430.36 459.84 887.81 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.48 307.98 418.06 420.08 451.01 906.02 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.21 296.98 407.91 420.98 441.84 921.79 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.44 293.37 396.51 419.80 435.50 935.08 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.05 295.78 385.70 412.29 435.26 945.82 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.07 300.89 376.36 403.33 437.00 953.92 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.89 305.13 369.43 397.17 438.20 959.30 -------------------------------------------------------------------------------- K point *** = 0.171875 0.796875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 221.39 305.39 365.72 396.58 438.14 961.84 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 204.37 278.08 369.13 372.88 431.29 986.10 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.01 274.42 372.65 379.18 429.80 982.90 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 217.81 269.52 379.34 389.52 427.12 976.54 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.80 266.42 388.28 401.46 423.94 967.14 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.01 268.34 398.41 411.34 423.03 954.79 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.34 278.79 407.69 413.34 430.98 939.64 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.21 296.98 407.91 420.98 441.84 921.79 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.18 319.23 405.82 431.02 451.97 901.40 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.49 343.47 404.71 441.06 460.81 878.58 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.32 367.95 405.02 451.55 468.59 853.49 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.72 390.10 406.81 462.55 477.26 826.33 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.92 406.83 409.97 470.29 493.18 797.33 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.40 413.51 417.69 473.69 518.11 766.84 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.83 417.50 423.48 475.01 547.91 735.47 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.94 420.77 426.41 475.34 578.65 704.70 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.56 422.62 427.63 475.32 603.59 680.01 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.56 422.62 427.63 475.32 603.59 680.01 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.94 420.77 426.41 475.34 578.65 704.70 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.83 417.50 423.48 475.01 547.91 735.47 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.40 413.51 417.69 473.69 518.11 766.84 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.92 406.83 409.97 470.29 493.18 797.33 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.72 390.10 406.81 462.55 477.26 826.33 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.32 367.95 405.02 451.55 468.59 853.49 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.49 343.47 404.71 441.06 460.81 878.58 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.18 319.23 405.82 431.02 451.97 901.40 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.21 296.98 407.91 420.98 441.84 921.79 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.34 278.79 407.69 413.34 430.98 939.64 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.01 268.34 398.41 411.34 423.03 954.79 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.80 266.42 388.28 401.46 423.94 967.14 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 217.81 269.52 379.34 389.52 427.12 976.54 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.01 274.42 372.65 379.18 429.80 982.90 -------------------------------------------------------------------------------- K point *** = 0.171875 0.828125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 204.37 278.08 369.13 372.88 431.29 986.10 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 186.89 250.77 346.74 373.04 425.43 1008.49 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 191.25 251.18 347.81 376.79 425.64 1005.58 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 200.36 249.25 354.69 383.80 424.38 999.42 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.27 247.53 365.29 393.16 421.92 990.23 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.34 249.20 377.53 403.86 418.69 978.20 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.68 258.81 389.99 414.72 415.57 963.51 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.91 277.47 401.43 412.64 426.04 946.28 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.92 300.21 406.34 416.74 436.28 926.62 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.30 324.57 405.35 427.59 445.57 904.61 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.23 348.77 404.71 439.90 454.11 880.38 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.76 370.44 405.12 452.45 464.38 854.05 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.13 387.15 406.59 460.39 483.15 825.82 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.78 398.18 408.89 464.77 509.65 796.01 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.35 404.70 411.51 467.61 540.28 765.12 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.61 408.29 413.79 469.60 571.97 734.33 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.43 409.68 415.49 471.10 600.12 707.07 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.74 409.03 416.71 472.22 612.28 695.24 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.55 406.73 417.18 472.88 596.39 710.74 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.94 403.44 416.34 472.79 566.91 739.29 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.01 399.86 413.28 471.56 534.74 770.73 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.94 396.59 406.54 468.60 504.41 802.16 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.03 393.46 394.62 462.61 480.23 832.51 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.72 373.89 392.96 451.68 466.04 861.28 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.63 348.35 392.99 439.86 456.55 888.12 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.57 320.64 394.27 429.46 446.69 912.79 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.44 293.37 396.51 419.80 435.50 935.08 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.01 268.34 398.41 411.34 423.03 954.79 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.44 248.26 394.49 408.75 410.02 971.74 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 219.74 239.41 384.83 396.47 412.47 985.71 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 205.11 239.12 373.47 385.15 416.75 996.52 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.04 242.61 361.75 377.22 420.70 1003.98 -------------------------------------------------------------------------------- K point *** = 0.171875 0.859375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 187.80 247.35 351.97 373.13 423.72 1007.98 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 170.17 220.76 323.62 377.20 418.64 1028.40 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 174.00 224.56 319.96 380.80 420.60 1025.87 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 183.15 226.28 322.93 387.49 421.13 1019.94 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.52 227.07 331.67 396.15 420.29 1010.98 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.73 229.55 344.16 405.60 418.39 999.30 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.97 238.37 358.62 413.99 416.77 985.12 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.44 257.27 374.01 412.43 424.26 968.57 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.61 279.71 389.83 409.84 432.18 949.71 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.22 303.14 404.36 409.68 439.25 928.58 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.32 326.08 405.26 424.85 445.94 905.24 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.98 346.79 404.71 441.15 455.68 879.78 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.46 363.79 404.79 449.38 476.61 852.37 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.26 376.59 405.26 453.62 504.72 823.25 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.07 385.73 405.67 456.88 536.09 792.90 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.69 392.02 405.56 459.81 568.37 762.24 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.02 395.80 405.01 462.52 598.25 733.72 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.99 396.43 405.07 464.92 617.46 715.11 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.56 394.12 405.93 466.71 611.79 720.34 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.67 390.60 406.17 467.59 586.02 744.68 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.29 387.02 404.75 467.19 553.51 775.15 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.54 384.05 400.59 465.11 520.15 806.78 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.69 382.06 392.08 460.63 489.73 837.90 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.18 376.73 381.40 451.39 467.57 867.74 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.59 353.96 381.72 437.13 455.51 895.87 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.62 325.79 383.24 423.96 445.72 921.98 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.05 295.78 385.70 412.29 435.26 945.82 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.80 266.42 388.28 401.46 423.94 967.14 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 219.74 239.41 384.83 396.47 412.47 985.71 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.25 217.42 372.82 396.58 404.42 1001.27 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.91 211.44 359.07 388.88 406.80 1013.55 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 180.79 212.18 345.22 381.58 411.26 1022.28 -------------------------------------------------------------------------------- K point *** = 0.171875 0.890625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 172.38 215.92 332.75 377.44 415.41 1027.24 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 155.01 190.53 302.47 381.59 411.10 1045.58 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 158.05 196.06 295.07 384.99 414.55 1043.59 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 166.97 201.15 294.03 391.38 416.84 1038.00 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 180.36 205.26 300.03 399.39 417.79 1029.33 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.82 209.82 311.87 407.73 417.48 1018.04 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.45 218.43 327.63 414.69 417.00 1004.43 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.22 237.27 345.83 413.70 422.86 988.61 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 235.97 258.61 365.70 411.47 428.68 970.59 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.06 280.52 386.93 409.46 433.58 950.37 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.46 302.03 405.39 411.92 438.11 927.93 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.25 322.05 405.54 430.98 446.45 903.34 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.80 339.65 404.69 438.55 469.81 876.73 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.71 354.28 403.82 441.62 500.07 848.31 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.78 365.91 402.53 444.35 532.66 818.48 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.89 374.78 400.42 447.41 565.81 788.04 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.95 381.14 397.47 450.83 597.07 758.84 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.87 384.66 394.52 454.26 620.69 736.22 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.49 383.82 393.71 457.25 624.19 732.47 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.59 380.10 394.15 459.37 604.04 751.04 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.98 376.24 393.52 460.25 572.77 779.61 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.63 373.29 390.73 459.55 538.18 810.88 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.83 371.57 384.71 456.83 504.01 842.28 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.06 370.92 374.01 450.66 474.27 872.76 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.91 355.87 371.98 436.56 456.10 901.76 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.02 330.77 373.73 418.82 446.23 928.90 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.07 300.89 376.36 403.33 437.00 953.92 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 217.81 269.52 379.34 389.52 427.12 976.54 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 205.11 239.12 373.47 385.15 416.75 996.52 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.91 211.44 359.07 388.88 406.80 1013.55 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 187.71 188.37 343.84 390.54 400.47 1027.31 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 170.10 185.26 328.58 386.01 402.45 1037.42 -------------------------------------------------------------------------------- K point *** = 0.171875 0.921875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 158.93 186.37 314.30 382.02 406.85 1043.56 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 142.36 162.71 282.69 386.09 403.46 1059.71 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 144.34 167.87 272.60 389.17 407.81 1058.55 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.80 175.03 268.21 395.17 411.51 1053.49 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 165.77 182.59 271.27 402.45 414.19 1045.24 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 181.57 190.30 281.93 409.53 415.64 1034.44 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 198.44 199.93 298.63 415.17 416.30 1021.47 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.04 218.08 319.43 414.86 420.69 1006.43 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.98 237.72 343.01 413.42 424.41 989.27 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.86 258.02 368.58 411.79 427.17 969.93 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.63 278.48 395.10 410.74 429.51 948.36 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.52 298.33 407.11 421.58 435.91 924.59 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.11 316.73 406.18 427.52 461.78 898.72 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.15 333.01 404.47 429.07 494.30 870.94 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.56 346.76 401.87 430.92 528.41 841.61 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.24 357.84 398.08 433.73 562.72 811.41 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.14 366.30 393.17 437.43 595.37 781.80 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.12 372.24 387.58 441.56 622.20 756.66 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.94 375.05 382.67 445.53 633.24 745.80 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.24 372.69 381.30 448.85 619.96 757.68 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.59 368.49 380.82 451.10 591.23 783.52 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.82 365.34 378.62 451.96 556.69 813.95 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.18 363.72 373.83 451.10 520.69 845.28 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.24 363.21 365.76 447.83 486.19 876.07 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.63 351.76 364.73 438.57 458.95 905.60 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.98 331.73 366.67 418.10 446.33 933.44 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.89 305.13 369.43 397.17 438.20 959.30 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.01 274.42 372.65 379.18 429.80 982.90 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.04 242.61 361.75 377.22 420.70 1003.98 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 180.79 212.18 345.22 381.58 411.26 1022.28 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 170.10 185.26 328.58 386.01 402.45 1037.42 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 161.18 165.55 312.09 388.68 397.03 1048.99 -------------------------------------------------------------------------------- K point *** = 0.171875 0.953125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 148.37 161.20 296.41 386.72 399.05 1056.53 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 133.13 140.29 264.29 390.46 397.05 1070.31 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 133.61 142.96 252.35 392.74 401.54 1070.41 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 141.50 149.95 245.57 398.22 405.81 1066.28 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 153.69 159.90 246.17 404.79 409.63 1058.72 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 167.94 171.20 255.50 410.52 412.70 1048.59 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 183.36 183.47 272.76 414.61 414.76 1036.35 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.97 199.92 295.69 415.40 417.47 1022.11 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.60 217.72 322.26 415.06 419.16 1005.78 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.27 236.99 351.19 414.19 419.95 987.25 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.26 257.20 381.42 413.46 420.16 966.45 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.22 277.39 406.20 415.23 424.30 943.40 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.95 296.63 408.84 416.22 452.38 918.16 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.33 314.16 406.92 416.22 486.89 890.95 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.27 329.44 403.07 417.57 522.54 862.06 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.69 342.12 397.75 420.27 558.14 832.09 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.52 352.09 391.39 424.02 592.22 802.23 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.58 359.39 384.37 428.40 621.67 775.37 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.59 364.17 377.19 432.93 638.79 759.11 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.08 366.44 370.73 437.11 632.98 763.97 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.48 364.30 367.80 440.52 607.96 786.28 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.44 360.95 365.71 442.81 574.45 815.47 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.14 359.26 361.46 443.68 537.89 846.48 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.22 353.92 359.55 442.75 501.02 877.34 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.37 342.98 360.73 438.52 467.03 907.16 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.24 327.13 362.86 422.50 446.16 935.44 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 221.39 305.39 365.72 396.58 438.14 961.84 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 204.37 278.08 369.13 372.88 431.29 986.10 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 187.80 247.35 351.97 373.13 423.72 1007.98 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 172.38 215.92 332.75 377.44 415.41 1027.24 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 158.93 186.37 314.30 382.02 406.85 1043.56 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 148.37 161.20 296.41 386.72 399.05 1056.53 -------------------------------------------------------------------------------- K point *** = 0.171875 0.984375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 140.76 143.87 279.45 390.67 394.19 1065.61 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 147.48 151.88 295.20 389.22 393.77 1059.58 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 143.37 151.74 280.95 389.57 398.40 1062.45 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 147.22 156.24 270.00 393.61 403.23 1060.85 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 156.56 164.42 264.36 400.16 407.77 1055.34 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 168.82 174.71 266.05 407.09 411.80 1046.72 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.67 185.75 275.95 412.89 415.02 1035.74 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.52 197.70 292.87 417.06 417.19 1022.75 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.81 213.66 314.67 418.02 420.02 1007.81 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.83 231.35 339.58 417.99 421.85 990.83 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.62 250.84 366.50 417.54 422.84 971.71 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.60 271.37 394.27 417.28 423.70 950.36 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.48 291.81 412.75 419.12 432.90 926.80 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.10 311.06 412.98 420.77 461.88 901.11 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.34 328.31 410.04 422.70 495.01 873.49 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.14 343.05 405.50 425.83 529.35 844.29 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.43 355.07 399.75 429.99 563.76 814.18 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.14 364.43 393.07 434.80 596.44 784.60 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.10 371.33 385.82 439.77 623.34 759.40 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.05 375.63 378.84 444.37 634.65 748.22 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.54 371.17 379.10 448.13 621.69 759.70 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.08 365.64 379.63 450.70 593.02 785.35 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.37 361.90 377.95 451.76 558.32 815.76 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.65 360.05 373.51 451.02 522.00 847.16 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.53 359.81 365.44 447.80 487.05 878.07 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.69 352.21 360.87 438.51 459.30 907.76 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.78 332.23 362.89 417.78 446.39 935.79 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 221.39 305.39 365.72 396.58 438.14 961.84 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 205.11 274.15 369.21 378.26 429.65 985.64 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.61 241.67 361.26 373.32 420.47 1006.92 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 175.61 210.58 344.63 377.80 410.94 1025.37 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 163.96 183.16 327.88 382.59 401.91 1040.62 -------------------------------------------------------------------------------- K point *** = 0.203125 0.015625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 155.39 161.82 311.20 387.38 394.77 1052.18 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 143.37 151.74 280.95 389.57 398.40 1062.45 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 133.22 150.80 266.31 387.60 401.94 1067.42 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 131.75 154.34 255.23 388.87 405.95 1067.97 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 138.28 160.68 249.76 393.61 409.44 1064.34 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 150.65 168.07 251.90 400.26 411.97 1057.21 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 166.71 175.86 262.19 407.09 413.30 1047.32 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 184.48 185.33 279.24 412.55 413.90 1035.13 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.03 204.39 301.04 412.12 418.11 1020.78 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.30 224.51 326.10 410.41 421.69 1004.26 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.79 244.96 353.54 408.38 424.24 985.51 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.45 265.27 382.49 406.65 426.11 964.48 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.45 284.90 402.16 413.83 429.63 941.20 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.26 303.21 401.55 423.23 452.52 915.78 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.58 319.67 399.87 424.00 486.23 888.40 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.25 333.86 397.66 424.40 521.57 859.39 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.18 345.52 394.53 425.56 557.03 829.32 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.29 354.53 390.29 427.83 591.06 799.41 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.43 360.93 385.16 431.05 620.46 772.57 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.34 364.78 379.74 434.71 637.41 756.50 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.63 366.01 374.98 438.28 631.29 761.74 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.84 364.81 371.55 441.25 606.15 784.28 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.74 362.75 368.36 443.24 572.74 813.54 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.55 360.33 364.76 443.93 536.44 844.51 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.84 353.96 363.64 442.89 499.95 875.28 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.26 342.90 364.62 438.62 466.46 904.96 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.42 326.88 366.65 422.69 446.06 933.08 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.89 305.13 369.43 397.17 438.20 959.30 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 208.26 278.13 371.96 374.58 431.43 983.37 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 192.19 247.97 352.83 376.92 423.94 1005.06 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 177.44 217.23 333.70 381.19 415.70 1024.15 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 164.88 188.32 315.33 385.63 407.23 1040.35 -------------------------------------------------------------------------------- K point *** = 0.203125 0.046875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 155.19 163.80 297.61 389.52 399.98 1053.27 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 147.22 156.24 270.00 393.61 403.23 1060.85 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 131.75 154.34 255.23 388.87 405.95 1067.97 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 124.42 155.89 244.81 386.68 408.67 1071.04 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 126.26 159.04 240.89 388.41 410.46 1069.94 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 136.37 162.44 244.91 393.50 411.02 1064.95 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.66 166.58 256.31 400.31 410.41 1056.62 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 172.84 173.10 273.19 406.12 409.97 1045.45 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.43 195.61 293.88 405.02 414.98 1031.75 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.79 219.16 317.46 402.04 420.34 1015.63 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.19 242.48 343.57 398.86 424.69 997.13 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.61 264.58 371.86 395.98 428.09 976.28 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.13 284.78 391.65 403.44 431.40 953.16 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.01 302.66 389.97 424.64 444.10 927.87 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.69 318.10 388.08 428.06 476.14 900.61 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.75 331.06 386.51 428.23 511.92 871.69 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.90 341.49 385.18 427.80 548.22 841.61 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.90 349.33 383.86 427.48 583.44 811.37 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.53 354.61 382.28 427.78 615.00 783.26 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.55 357.52 380.21 428.95 636.70 763.24 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.66 358.49 377.64 430.85 637.61 762.21 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.59 357.91 374.81 433.06 616.85 781.00 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.31 355.69 372.29 435.09 585.31 808.86 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.04 351.21 370.82 436.50 549.67 839.33 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.25 343.85 370.73 436.86 512.88 869.92 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.46 333.30 371.80 435.46 477.06 899.55 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.23 319.15 373.76 427.97 447.70 927.66 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.07 300.89 376.36 403.33 437.00 953.92 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.57 278.29 374.59 380.53 431.72 978.08 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.40 252.06 350.05 383.63 426.05 999.95 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 184.36 223.86 327.48 387.64 419.46 1019.38 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 171.41 195.75 306.73 391.75 412.12 1036.18 -------------------------------------------------------------------------------- K point *** = 0.203125 0.078125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 161.39 169.89 287.48 395.12 405.11 1050.11 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 156.56 164.42 264.36 400.16 407.77 1055.34 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 138.28 160.68 249.76 393.61 409.44 1064.34 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 126.26 159.04 240.89 388.41 410.46 1069.94 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 122.57 157.90 239.58 386.50 410.27 1071.68 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 128.12 157.10 246.02 388.57 408.86 1069.32 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 141.99 158.16 258.52 393.74 406.60 1063.03 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 161.36 163.42 275.03 398.77 405.51 1053.22 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 170.76 186.66 294.19 397.32 410.80 1040.33 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.51 213.14 315.36 393.61 417.67 1024.64 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.74 240.02 338.59 389.72 423.84 1006.37 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.42 265.51 364.20 386.13 429.03 985.63 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.68 288.19 381.98 393.36 433.54 962.56 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 244.76 307.31 379.51 420.83 440.52 937.32 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.04 322.83 377.31 431.97 465.60 910.10 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.99 335.06 375.79 433.69 500.71 881.18 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.14 344.30 375.10 433.48 537.39 851.04 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.02 350.74 375.39 432.38 573.54 820.48 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.22 354.61 376.58 430.88 606.89 791.31 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.41 356.39 378.09 429.44 632.56 768.12 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.44 356.57 379.22 428.53 640.34 761.01 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.32 355.16 379.64 428.42 624.82 775.34 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.25 351.77 379.65 429.01 595.66 801.52 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.49 345.95 379.79 429.95 561.13 831.43 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.34 337.52 380.43 430.73 524.76 861.84 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.12 326.41 381.65 430.75 488.41 891.42 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.21 312.55 383.46 428.47 454.45 919.54 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.05 295.78 385.70 412.29 435.26 945.82 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.20 276.02 381.39 390.00 430.60 970.01 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.32 253.49 353.65 392.46 426.69 991.96 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 195.24 228.96 327.63 395.97 421.93 1011.57 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 181.95 203.64 304.03 399.54 416.17 1028.73 -------------------------------------------------------------------------------- K point *** = 0.203125 0.109375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 171.43 178.99 282.82 402.44 409.90 1043.37 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 168.82 174.71 266.05 407.09 411.80 1046.72 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 150.65 168.07 251.90 400.26 411.97 1057.21 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 136.37 162.44 244.91 393.50 411.02 1064.95 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 128.12 157.10 246.02 388.57 408.86 1069.32 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 128.03 153.05 254.17 387.05 405.74 1069.68 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 136.95 152.17 267.21 389.26 402.24 1065.74 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.56 157.06 283.25 392.42 400.65 1057.65 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 162.23 178.51 301.06 390.39 405.90 1045.86 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 173.61 206.01 320.01 386.25 413.76 1030.81 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 187.59 235.55 340.05 381.99 421.55 1012.87 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 203.25 264.84 361.71 378.04 428.58 992.29 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 219.74 291.57 374.04 386.49 434.76 969.30 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.33 313.86 371.11 413.29 441.11 944.08 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.42 331.09 368.72 433.69 456.58 916.86 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.42 343.75 367.16 439.09 488.56 887.92 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.79 352.55 366.76 440.28 524.83 857.67 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.93 357.89 368.03 439.76 561.49 826.80 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.25 360.56 370.84 438.06 596.24 796.73 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.34 361.71 374.33 435.54 625.15 770.97 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.19 361.40 378.19 432.62 639.35 758.20 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.07 359.11 382.21 429.79 629.86 767.30 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.39 354.46 385.92 427.58 603.60 791.39 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.44 347.26 388.94 426.32 570.50 820.68 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.42 337.43 391.24 425.94 534.98 850.95 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.47 325.06 393.08 425.99 499.02 880.55 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.73 310.31 394.81 425.56 464.09 908.73 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.44 293.37 396.51 419.80 435.50 935.08 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.96 274.53 390.96 401.11 428.45 959.36 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.85 254.15 362.34 402.36 425.98 981.43 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 208.92 232.73 334.27 404.96 423.02 1001.20 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 195.17 210.88 308.45 407.56 419.07 1018.66 -------------------------------------------------------------------------------- K point *** = 0.203125 0.140625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 183.56 189.33 285.42 409.59 414.12 1033.83 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.67 185.75 275.95 412.89 415.02 1035.74 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 166.71 175.86 262.19 407.09 413.30 1047.32 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.66 166.58 256.31 400.31 410.41 1056.62 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 141.99 158.16 258.52 393.74 406.60 1063.03 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 136.95 152.17 267.21 389.26 402.24 1065.74 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 139.78 150.20 280.22 388.32 397.79 1064.10 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 149.99 154.49 295.77 389.20 395.53 1057.96 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 158.62 172.94 312.60 385.92 400.63 1047.61 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 169.39 199.08 329.94 381.34 408.93 1033.53 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.82 229.18 347.52 376.82 417.93 1016.19 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 198.07 260.90 365.54 372.70 426.64 995.98 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 214.35 291.72 368.78 385.30 434.61 973.20 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 230.94 318.76 365.64 407.68 442.06 948.11 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.24 339.74 363.19 431.15 452.10 920.95 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.66 354.37 361.64 443.24 476.72 892.01 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.61 360.74 364.41 446.88 511.12 861.66 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.42 361.66 370.28 447.77 547.63 830.51 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.43 364.11 373.48 446.91 583.29 799.67 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.20 368.05 374.68 444.63 614.75 771.80 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.76 370.72 376.53 441.24 634.65 753.94 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.53 368.20 382.30 437.11 631.90 757.05 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.01 362.73 388.88 432.72 609.14 778.49 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.55 354.74 395.04 428.61 577.68 807.05 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.36 344.11 400.22 425.33 543.25 837.21 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.52 330.81 404.09 423.24 508.17 866.91 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.11 314.97 406.61 422.26 473.76 895.25 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.21 296.98 407.91 420.98 441.84 921.79 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.91 277.47 401.43 412.64 426.04 946.28 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.44 257.27 374.01 412.43 424.26 968.57 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.22 237.27 345.83 413.70 422.86 988.61 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.04 218.08 319.43 414.86 420.69 1006.43 -------------------------------------------------------------------------------- K point *** = 0.203125 0.171875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.97 199.92 295.69 415.40 417.47 1022.11 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.52 197.70 292.87 417.06 417.19 1022.75 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 184.48 185.33 279.24 412.55 413.90 1035.13 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 172.84 173.10 273.19 406.12 409.97 1045.45 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 161.36 163.42 275.03 398.77 405.51 1053.22 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.56 157.06 283.25 392.42 400.65 1057.65 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 149.99 154.49 295.77 389.20 395.53 1057.96 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 156.09 156.09 310.77 390.28 390.28 1053.75 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 161.79 171.27 326.88 385.05 395.47 1045.06 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 171.12 194.18 343.17 379.97 403.60 1032.28 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 183.33 222.67 359.14 375.18 413.27 1015.91 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.60 254.53 370.80 374.72 423.34 996.39 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.14 287.54 366.94 390.40 433.03 974.10 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.25 318.95 363.74 407.46 442.06 949.34 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.29 345.33 361.30 427.32 451.27 922.40 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.67 359.80 364.10 444.93 467.43 893.58 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.76 359.45 375.72 452.39 497.29 863.23 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.89 360.57 382.25 455.28 532.53 831.87 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.39 363.50 385.26 455.82 568.45 800.39 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.79 368.38 385.62 454.53 601.75 770.81 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.13 374.90 383.80 451.68 626.48 748.51 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.80 379.97 382.37 447.59 630.97 744.97 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.31 374.12 390.06 442.63 612.43 762.93 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.00 366.07 397.41 437.27 582.78 790.60 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.07 355.56 404.06 432.04 549.53 820.67 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.63 342.34 409.79 427.38 515.57 850.54 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.75 326.38 414.48 423.53 482.32 879.16 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.48 307.98 418.06 420.08 451.01 906.02 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.92 287.82 411.46 420.51 427.47 930.85 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.18 266.90 387.02 421.86 422.24 953.51 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.46 246.48 360.40 421.31 422.14 973.97 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.03 227.73 335.14 420.78 421.40 992.26 -------------------------------------------------------------------------------- K point *** = 0.203125 0.203125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.22 211.48 312.18 419.62 419.72 1008.47 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.81 213.66 314.67 418.02 420.02 1007.81 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.03 204.39 301.04 412.12 418.11 1020.78 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.43 195.61 293.88 405.02 414.98 1031.75 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 170.76 186.66 294.19 397.32 410.80 1040.33 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 162.23 178.51 301.06 390.39 405.90 1045.86 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 158.62 172.94 312.60 385.92 400.63 1047.61 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 161.79 171.27 326.88 385.05 395.47 1045.06 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 171.64 175.20 342.36 385.91 392.87 1038.06 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 179.64 192.74 357.86 382.42 398.45 1026.83 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.65 218.03 372.31 378.03 408.07 1011.77 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 202.13 248.00 372.79 386.85 419.14 993.30 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.32 280.73 368.89 399.82 430.40 971.84 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.46 314.06 365.64 412.84 441.11 947.72 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.85 345.03 363.23 427.42 451.20 921.27 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.83 361.85 369.64 444.24 462.94 892.79 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.76 361.69 385.41 456.19 485.09 862.61 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.99 363.00 393.87 461.51 517.19 831.20 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.86 366.05 397.61 463.69 552.39 799.28 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.93 370.90 398.21 463.70 586.71 768.35 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.16 377.24 396.49 461.88 615.24 742.33 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.86 384.26 392.99 458.52 627.14 731.70 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.42 386.33 392.76 453.97 613.81 745.00 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.15 379.21 399.36 448.66 586.13 771.45 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.23 369.51 405.50 443.14 553.99 801.43 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.72 357.20 410.56 438.02 521.17 831.54 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.67 342.06 414.29 433.78 489.38 860.53 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.11 324.22 416.57 430.36 459.84 887.81 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.12 304.31 416.76 424.27 437.04 913.12 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.81 283.46 400.38 419.84 430.93 936.29 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.43 263.02 376.65 420.20 428.66 957.29 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.55 244.07 353.84 420.67 426.10 976.15 -------------------------------------------------------------------------------- K point *** = 0.203125 0.234375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.15 226.93 332.83 420.74 422.66 992.95 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.83 231.35 339.58 417.99 421.85 990.83 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.30 224.51 326.10 410.41 421.69 1004.26 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.79 219.16 317.46 402.04 420.34 1015.63 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.51 213.14 315.36 393.61 417.67 1024.64 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 173.61 206.01 320.01 386.25 413.76 1030.81 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 169.39 199.08 329.94 381.34 408.93 1033.53 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 171.12 194.18 343.17 379.97 403.60 1032.28 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 179.64 192.74 357.86 382.42 398.45 1026.83 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.65 195.75 372.11 386.66 396.02 1017.21 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 201.75 216.81 380.72 389.49 403.16 1003.68 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.50 243.57 378.25 399.38 415.39 986.60 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.65 274.05 374.43 409.92 428.38 966.33 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.33 306.63 371.14 420.34 440.66 943.22 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.70 339.22 368.77 431.34 451.80 917.60 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.03 367.44 368.61 444.28 462.43 889.77 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.62 367.56 390.27 457.91 477.20 860.06 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.79 369.08 402.75 465.99 503.26 828.87 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.95 372.21 408.48 469.78 536.14 796.78 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.69 376.91 410.08 471.05 570.40 764.89 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.88 382.84 408.94 470.36 601.53 735.92 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.69 389.34 405.84 468.04 620.50 718.24 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.38 395.07 401.76 464.39 613.80 725.15 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.16 392.77 403.44 459.76 588.35 749.84 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.13 384.56 408.14 454.64 557.14 779.67 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.32 373.72 411.87 449.57 525.27 810.05 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.76 360.02 414.29 444.99 494.90 839.45 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.46 343.29 415.60 440.69 467.50 867.25 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.54 323.98 416.20 433.27 446.63 893.12 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.21 303.22 412.93 419.02 438.86 916.90 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.99 282.42 393.84 418.71 434.60 938.53 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.77 262.64 374.39 419.85 430.06 958.02 -------------------------------------------------------------------------------- K point *** = 0.203125 0.265625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.51 244.52 356.08 421.00 424.63 975.43 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.62 250.84 366.50 417.54 422.84 971.71 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.79 244.96 353.54 408.38 424.24 985.51 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.19 242.48 343.57 398.86 424.69 997.13 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.74 240.02 338.59 389.72 423.84 1006.37 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 187.59 235.55 340.05 381.99 421.55 1012.87 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.82 229.18 347.52 376.82 417.93 1016.19 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 183.33 222.67 359.14 375.18 413.27 1015.91 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.65 218.03 372.31 378.03 408.07 1011.77 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 201.75 216.81 380.72 389.49 403.16 1003.68 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.67 222.27 386.23 399.63 405.17 991.78 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.62 243.44 386.21 404.58 419.24 976.30 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.27 270.15 382.91 413.71 432.69 957.55 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.08 299.92 379.65 423.77 444.88 935.82 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.19 331.24 377.30 434.06 455.68 911.42 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.71 361.88 376.20 445.09 465.36 884.64 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.86 376.38 388.40 457.63 475.71 855.77 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.93 378.20 406.54 468.27 493.36 825.17 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.33 381.51 416.12 473.64 521.33 793.30 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.69 386.17 419.89 475.88 553.91 760.96 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.81 391.77 420.06 476.12 586.15 729.92 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.74 397.72 417.84 474.81 611.05 705.90 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.56 403.23 414.00 472.24 612.89 704.19 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.34 405.68 410.86 468.72 590.38 726.09 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.09 399.88 413.18 464.57 559.89 755.60 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.80 390.87 415.29 460.13 528.57 786.22 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.47 379.04 416.18 455.60 499.29 816.07 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.16 363.80 416.19 450.73 473.90 844.41 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.04 345.20 415.96 443.17 455.03 870.89 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.50 324.43 415.93 428.77 446.00 895.33 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.25 303.14 411.18 418.20 439.84 917.64 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.30 282.69 396.11 419.08 433.33 937.79 -------------------------------------------------------------------------------- K point *** = 0.203125 0.296875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.40 264.22 380.97 420.92 425.93 955.80 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.60 271.37 394.27 417.28 423.70 950.36 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.45 265.27 382.49 406.65 426.11 964.48 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.61 264.58 371.86 395.98 428.09 976.28 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.42 265.51 364.20 386.13 429.03 985.63 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 203.25 264.84 361.71 378.04 428.58 992.29 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 198.07 260.90 365.54 372.70 426.64 995.98 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.60 254.53 370.80 374.72 423.34 996.39 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 202.13 248.00 372.79 386.85 419.14 993.30 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.50 243.57 378.25 399.38 415.39 986.60 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.62 243.44 386.21 404.58 419.24 976.30 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.16 252.14 393.74 403.63 431.14 962.55 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.24 271.94 393.39 410.80 443.24 945.55 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.31 297.02 390.32 421.64 454.20 925.53 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.08 324.84 387.95 432.81 463.73 902.74 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.80 353.72 386.92 444.02 471.97 877.43 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.58 381.09 387.62 455.77 479.71 849.86 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.63 389.39 404.07 467.51 490.30 820.32 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.34 393.05 418.76 475.01 510.30 789.20 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.30 397.89 426.23 478.03 538.72 757.03 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.30 403.41 428.82 478.72 570.08 724.93 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.24 408.99 428.25 478.03 598.80 696.18 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.07 413.96 425.55 476.42 611.02 683.70 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.69 417.53 421.49 474.21 593.37 700.65 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.01 414.97 420.59 471.60 563.63 729.52 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.99 407.73 421.04 468.66 532.52 760.31 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.64 397.88 420.16 465.24 503.74 790.55 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.08 384.30 418.51 460.87 479.73 819.42 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.58 366.51 416.91 453.92 462.74 846.51 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.66 345.78 416.02 442.50 453.45 871.61 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.15 324.23 416.02 430.80 445.75 894.60 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.15 303.53 415.20 421.35 437.30 915.40 -------------------------------------------------------------------------------- K point *** = 0.203125 0.328125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.38 285.07 405.99 420.92 427.95 933.99 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.48 291.81 412.75 419.12 432.90 926.80 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.45 284.90 402.16 413.83 429.63 941.20 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.13 284.78 391.65 403.44 431.40 953.16 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.68 288.19 381.98 393.36 433.54 962.56 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 219.74 291.57 374.04 386.49 434.76 969.30 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 214.35 291.72 368.78 385.30 434.61 973.20 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.14 287.54 366.94 390.40 433.03 974.10 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.32 280.73 368.89 399.82 430.40 971.84 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.65 274.05 374.43 409.92 428.38 966.33 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.27 270.15 382.91 413.71 432.69 957.55 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.24 271.94 393.39 410.80 443.24 945.55 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.61 282.54 403.78 407.88 454.38 930.45 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.00 300.82 402.18 417.82 464.50 912.40 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.64 323.34 399.64 429.76 473.15 891.57 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.68 348.11 398.56 441.46 480.31 868.15 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.32 373.46 399.26 453.02 486.43 842.36 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.63 396.75 401.98 464.48 493.16 814.43 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.90 405.58 415.84 473.75 505.16 784.66 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.62 410.89 427.74 477.94 526.61 753.43 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.53 416.67 433.94 478.65 554.54 721.40 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.41 422.17 436.15 477.83 584.07 690.18 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.06 426.61 435.64 476.55 606.36 666.95 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.26 429.28 433.20 475.43 598.23 674.27 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.84 428.67 430.35 474.67 570.04 701.81 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.74 423.01 428.84 474.02 539.40 732.58 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.09 414.74 425.96 472.81 511.11 763.12 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.09 402.61 422.33 469.97 488.31 792.43 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.11 385.75 418.96 463.06 474.21 820.08 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.74 365.50 416.68 452.70 466.75 845.81 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.91 344.27 415.84 442.77 459.66 869.44 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.79 323.91 416.41 433.16 451.37 890.87 -------------------------------------------------------------------------------- K point *** = 0.203125 0.359375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.19 305.75 417.89 423.37 441.98 910.00 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.10 311.06 412.98 420.77 461.88 901.11 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.26 303.21 401.55 423.23 452.52 915.78 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.01 302.66 389.97 424.64 444.10 927.87 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 244.76 307.31 379.51 420.83 440.52 937.32 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.33 313.86 371.11 413.29 441.11 944.08 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 230.94 318.76 365.64 407.68 442.06 948.11 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.25 318.95 363.74 407.46 442.06 949.34 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.46 314.06 365.64 412.84 441.11 947.72 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.33 306.63 371.14 420.34 440.66 943.22 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.08 299.92 379.65 423.77 444.88 935.82 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.31 297.02 390.32 421.64 454.20 925.53 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.00 300.82 402.18 417.82 464.50 912.40 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.51 312.16 412.28 416.40 473.98 896.49 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.68 328.75 410.68 427.57 482.05 877.91 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.69 348.27 409.57 439.41 488.55 856.77 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.18 369.29 410.34 450.73 493.72 833.23 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.09 390.38 413.12 461.45 498.49 807.47 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.38 409.51 417.75 470.79 505.43 779.71 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.30 423.63 424.47 476.32 519.09 750.24 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.40 430.11 434.28 477.29 540.94 719.46 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.33 435.71 440.34 475.69 567.93 688.14 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.74 438.93 444.25 473.47 595.36 658.70 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.29 439.62 445.55 472.46 604.51 648.74 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.76 438.40 443.20 473.49 580.44 672.94 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.24 434.90 438.35 475.38 551.54 703.42 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.00 427.79 432.87 476.35 525.33 734.06 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.41 416.58 427.00 474.42 505.47 763.69 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.90 400.85 421.60 467.82 494.24 791.80 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.13 381.87 417.59 458.31 488.41 818.08 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.07 361.86 415.42 448.12 483.49 842.29 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.96 342.51 415.14 437.50 477.66 864.28 -------------------------------------------------------------------------------- K point *** = 0.203125 0.390625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.71 325.02 416.31 426.55 470.44 883.92 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.34 328.31 410.04 422.70 495.01 873.49 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.58 319.67 399.87 424.00 486.23 888.40 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.69 318.10 388.08 428.06 476.14 900.61 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.04 322.83 377.31 431.97 465.60 910.10 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.42 331.09 368.72 433.69 456.58 916.86 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.24 339.74 363.19 431.15 452.10 920.95 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.29 345.33 361.30 427.32 451.27 922.40 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.85 345.03 363.23 427.42 451.20 921.27 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.70 339.22 368.77 431.34 451.80 917.60 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.19 331.24 377.30 434.06 455.68 911.42 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.08 324.84 387.95 432.81 463.73 902.74 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.64 323.34 399.64 429.76 473.15 891.57 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.68 328.75 410.68 427.57 482.05 877.91 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.46 340.08 416.66 431.10 489.67 861.79 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.06 354.82 417.46 440.68 495.76 843.26 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.15 371.24 418.64 450.99 500.42 822.41 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.07 388.26 421.75 460.50 504.22 799.35 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.53 404.79 427.03 468.56 508.60 774.26 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.24 419.29 434.13 474.03 516.45 747.35 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.21 430.58 441.86 475.67 530.91 718.95 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.72 438.85 448.68 473.89 552.26 689.50 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.16 444.33 454.30 470.07 578.25 659.77 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.01 447.00 457.65 466.77 603.94 633.29 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.14 447.04 454.00 469.05 595.21 643.57 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.89 444.00 447.00 473.18 569.62 673.31 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.84 436.74 439.68 475.85 547.03 703.81 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.55 426.05 431.52 475.35 530.44 733.56 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.55 411.57 423.93 470.71 520.64 761.98 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.50 394.39 418.04 462.69 515.43 788.69 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.43 376.26 414.28 452.68 511.74 813.39 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.54 358.45 412.71 441.53 507.61 835.87 -------------------------------------------------------------------------------- K point *** = 0.203125 0.421875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.84 342.00 412.67 430.17 502.14 855.95 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.14 343.05 405.50 425.83 529.35 844.29 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.25 333.86 397.66 424.40 521.57 859.39 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.75 331.06 386.51 428.23 511.92 871.69 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.99 335.06 375.79 433.69 500.71 881.18 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.42 343.75 367.16 439.09 488.56 887.92 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.66 354.37 361.64 443.24 476.72 892.01 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.67 359.80 364.10 444.93 467.43 893.58 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.83 361.85 369.64 444.24 462.94 892.79 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.03 367.44 368.61 444.28 462.43 889.77 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.71 361.88 376.20 445.09 465.36 884.64 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.80 353.72 386.92 444.02 471.97 877.43 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.68 348.11 398.56 441.46 480.31 868.15 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.69 348.27 409.57 439.41 488.55 856.77 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.06 354.82 417.46 440.68 495.76 843.26 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.15 365.68 420.86 446.93 501.59 827.61 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.93 378.54 422.80 455.34 506.04 809.81 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.79 392.00 426.00 463.23 509.51 789.94 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.97 405.13 431.53 469.41 512.84 768.12 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.02 416.95 439.61 473.19 517.56 744.54 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.33 426.73 449.26 474.27 525.82 719.50 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.35 434.71 457.87 472.94 539.71 693.39 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 381.67 441.82 462.99 470.01 559.85 666.77 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 384.29 448.71 462.80 467.47 584.95 640.41 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 382.14 454.03 457.81 466.71 611.63 616.76 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.07 450.01 453.87 469.03 592.29 643.12 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 367.13 441.63 446.22 473.11 573.50 673.13 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.17 432.02 435.21 474.91 559.62 702.71 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.80 419.20 425.08 472.78 550.81 731.20 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.72 403.74 417.41 466.66 545.81 758.16 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.90 387.57 411.97 457.46 542.62 783.20 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.50 371.48 408.94 446.35 539.47 806.05 -------------------------------------------------------------------------------- K point *** = 0.203125 0.453125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.51 356.25 407.70 434.76 535.24 826.47 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.43 355.07 399.75 429.99 563.76 814.18 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.18 345.52 394.53 425.56 557.03 829.32 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.90 341.49 385.18 427.80 548.22 841.61 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.14 344.30 375.10 433.48 537.39 851.04 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.79 352.55 366.76 440.28 524.83 857.67 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.61 360.74 364.41 446.88 511.12 861.66 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.76 359.45 375.72 452.39 497.29 863.23 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.76 361.69 385.41 456.19 485.09 862.61 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.62 367.56 390.27 457.91 477.20 860.06 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.86 376.38 388.40 457.63 475.71 855.77 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.58 381.09 387.62 455.77 479.71 849.86 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.32 373.46 399.26 453.02 486.43 842.36 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.18 369.29 410.34 450.73 493.72 833.23 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.15 371.24 418.64 450.99 500.42 822.41 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.93 378.54 422.80 455.34 506.04 809.81 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.37 388.68 424.69 462.06 510.53 795.38 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.16 399.69 427.10 468.48 514.14 779.12 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.51 410.34 431.67 473.01 517.38 761.12 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.59 419.58 439.24 475.04 520.89 741.55 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.87 426.73 449.65 474.70 525.52 720.71 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.36 432.12 460.79 472.64 532.74 699.02 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 383.62 437.06 467.73 470.92 544.85 677.07 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 388.25 443.20 464.81 472.82 563.22 655.66 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 386.55 450.21 460.98 469.97 586.51 635.97 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 380.02 450.42 460.83 464.85 607.65 623.84 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 370.44 443.54 451.03 470.28 599.94 645.03 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.03 434.60 438.24 474.39 589.18 673.10 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.56 424.28 425.13 474.53 581.63 700.99 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.74 410.48 415.73 470.30 577.05 727.73 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.47 396.22 408.48 462.29 574.23 752.77 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.81 381.79 403.90 451.69 571.77 775.71 -------------------------------------------------------------------------------- K point *** = 0.203125 0.484375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.69 367.74 401.62 440.08 568.53 796.25 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.14 364.43 393.07 434.80 596.44 784.60 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.29 354.53 390.29 427.83 591.06 799.41 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.90 349.33 383.86 427.48 583.44 811.37 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.02 350.74 375.39 432.38 573.54 820.48 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.93 357.89 368.03 439.76 561.49 826.80 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.42 361.66 370.28 447.77 547.63 830.51 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.89 360.57 382.25 455.28 532.53 831.87 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.99 363.00 393.87 461.51 517.19 831.20 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.79 369.08 402.75 465.99 503.26 828.87 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.93 378.20 406.54 468.27 493.36 825.17 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.63 389.39 404.07 467.51 490.30 820.32 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.63 396.75 401.98 464.48 493.16 814.43 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.09 390.38 413.12 461.45 498.49 807.47 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.07 388.26 421.75 460.50 504.22 799.35 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.79 392.00 426.00 463.23 509.51 789.94 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.16 399.69 427.10 468.48 514.14 779.12 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.00 408.91 427.91 473.52 518.22 766.84 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.68 417.94 430.46 476.66 521.90 753.15 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.25 425.35 436.10 477.46 525.19 738.20 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.77 430.28 445.12 476.32 528.12 722.26 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.52 433.14 456.06 474.01 531.17 705.77 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 377.97 434.84 466.31 471.21 536.08 689.30 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 385.65 437.54 468.23 472.02 545.90 673.56 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 385.97 442.73 465.21 470.87 562.09 659.48 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 380.02 446.62 461.12 467.03 582.11 648.62 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 370.44 443.54 451.03 470.28 599.94 645.03 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.03 434.25 439.90 474.72 606.89 655.99 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.82 421.99 429.23 476.19 606.00 677.46 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.58 410.42 417.79 473.49 604.17 701.44 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.14 400.51 406.21 466.76 602.91 725.04 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.43 389.49 398.17 456.98 601.75 747.12 -------------------------------------------------------------------------------- K point *** = 0.203125 0.515625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.31 376.69 394.68 445.62 599.84 767.09 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.10 371.33 385.82 439.77 623.34 759.40 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.43 360.93 385.16 431.05 620.46 772.57 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.53 354.61 382.28 427.78 615.00 783.26 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.22 354.61 376.58 430.88 606.89 791.31 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.25 360.56 370.84 438.06 596.24 796.73 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.43 364.11 373.48 446.91 583.29 799.67 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.39 363.50 385.26 455.82 568.45 800.39 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.86 366.05 397.61 463.69 552.39 799.28 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.95 372.21 408.48 469.78 536.14 796.78 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.33 381.51 416.12 473.64 521.33 793.30 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.34 393.05 418.76 475.01 510.30 789.20 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.90 405.58 415.84 473.75 505.16 784.66 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.38 409.51 417.75 470.79 505.43 779.71 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.53 404.79 427.03 468.56 508.60 774.26 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.97 405.13 431.53 469.41 512.84 768.12 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.51 410.34 431.67 473.01 517.38 761.12 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.68 417.94 430.46 476.66 521.90 753.15 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.97 425.81 430.32 478.61 526.06 744.20 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.45 431.08 433.93 478.62 529.35 734.39 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.98 433.82 440.71 477.31 531.36 723.94 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.42 435.19 448.63 475.48 532.08 713.20 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.67 434.56 457.49 473.60 532.46 702.59 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.41 433.89 464.42 471.75 534.94 692.61 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 379.76 436.10 464.00 471.48 542.77 683.83 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 375.79 440.53 456.74 471.71 556.56 676.97 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 367.13 441.63 446.22 473.11 573.50 673.13 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.29 431.31 439.69 476.04 590.07 673.88 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.70 417.92 431.95 477.69 603.43 680.68 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.29 405.78 421.80 475.98 612.59 693.37 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.87 396.15 410.03 470.42 618.49 709.70 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.26 389.58 397.40 461.62 622.14 727.16 -------------------------------------------------------------------------------- K point *** = 0.203125 0.546875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.22 383.24 387.36 450.82 623.81 744.07 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.05 375.63 378.84 444.37 634.65 748.22 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.34 364.78 379.74 434.71 637.41 756.50 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.55 357.52 380.21 428.95 636.70 763.24 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.41 356.39 378.09 429.44 632.56 768.12 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.34 361.71 374.33 435.54 625.15 770.97 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.20 368.05 374.68 444.63 614.75 771.80 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.79 368.38 385.62 454.53 601.75 770.81 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.93 370.90 398.21 463.70 586.71 768.35 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.69 376.91 410.08 471.05 570.40 764.89 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.69 386.17 419.89 475.88 553.91 760.96 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.30 397.89 426.23 478.03 538.72 757.03 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.62 410.89 427.74 477.94 526.61 753.43 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.30 423.63 424.47 476.32 519.09 750.24 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.24 419.29 434.13 474.03 516.45 747.35 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.02 416.95 439.61 473.19 517.56 744.54 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.59 419.58 439.24 475.04 520.89 741.55 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.25 425.35 436.10 477.46 525.19 738.20 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.45 431.08 433.93 478.62 529.35 734.39 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.29 431.72 437.57 478.45 532.37 730.15 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.50 433.13 440.53 477.65 533.56 725.60 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.73 435.07 442.47 476.83 532.81 720.91 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.54 433.55 447.33 475.91 530.69 716.28 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.25 430.45 453.38 474.50 528.77 711.93 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.94 429.70 455.63 473.58 529.65 708.13 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 367.74 432.87 450.33 474.46 535.74 705.26 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.84 436.74 439.68 475.85 547.03 703.81 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.06 426.38 437.17 477.58 561.58 704.34 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.35 412.73 432.62 478.74 577.39 707.28 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.90 400.19 424.33 477.50 592.94 712.74 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.57 390.01 413.59 472.91 607.15 720.35 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.12 382.98 401.34 465.16 619.20 729.38 -------------------------------------------------------------------------------- K point *** = 0.203125 0.578125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.18 379.31 388.46 455.18 628.50 738.95 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.54 371.17 379.10 448.13 621.69 759.70 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.63 366.01 374.98 438.28 631.29 761.74 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.66 358.49 377.64 430.85 637.61 762.21 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.44 356.57 379.22 428.53 640.34 761.01 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.19 361.40 378.19 432.62 639.35 758.20 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.76 370.72 376.53 441.24 634.65 753.94 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.13 374.90 383.80 451.68 626.48 748.51 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.16 377.24 396.49 461.88 615.24 742.33 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.88 382.84 408.94 470.36 601.53 735.92 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.81 391.77 420.06 476.12 586.15 729.92 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.30 403.41 428.82 478.72 570.08 724.93 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.53 416.67 433.94 478.65 554.54 721.40 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.40 430.11 434.28 477.29 540.94 719.46 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.21 430.58 441.86 475.67 530.91 718.95 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.33 426.73 449.26 474.27 525.82 719.50 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.87 426.73 449.65 474.70 525.52 720.71 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.77 430.28 445.12 476.32 528.12 722.26 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.98 433.82 440.71 477.31 531.36 723.94 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.50 433.13 440.53 477.65 533.56 725.60 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.95 432.01 440.35 477.92 533.86 727.18 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.82 432.68 437.94 478.16 532.08 728.59 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.49 430.69 438.29 477.74 528.69 729.80 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.12 425.53 442.39 476.17 524.73 730.81 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.44 422.18 445.01 474.32 521.71 731.71 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.70 423.27 441.99 474.48 521.38 732.70 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.00 427.79 432.87 476.35 525.33 734.06 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.62 420.44 431.27 478.03 534.10 736.10 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.91 407.08 430.33 478.81 546.88 739.04 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.39 394.48 424.61 477.75 562.23 742.88 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.07 383.94 415.34 473.94 578.59 747.38 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.68 376.40 403.84 467.25 594.63 752.05 -------------------------------------------------------------------------------- K point *** = 0.203125 0.609375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.77 372.30 391.26 458.29 609.27 756.33 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.08 365.64 379.63 450.70 593.02 785.35 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.84 364.81 371.55 441.25 606.15 784.28 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.59 357.91 374.81 433.06 616.85 781.00 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.32 355.16 379.64 428.42 624.82 775.34 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.07 359.11 382.21 429.79 629.86 767.30 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.53 368.20 382.30 437.11 631.90 757.05 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.80 379.97 382.37 447.59 630.97 744.97 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.86 384.26 392.99 458.52 627.14 731.70 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.69 389.34 405.84 468.04 620.50 718.24 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.74 397.72 417.84 474.81 611.05 705.90 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.24 408.99 428.25 478.03 598.80 696.18 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.41 422.17 436.15 477.83 584.07 690.18 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.33 435.71 440.34 475.69 567.93 688.14 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.72 438.85 448.68 473.89 552.26 689.50 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.35 434.71 457.87 472.94 539.71 693.39 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.36 432.12 460.79 472.64 532.74 699.02 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.52 433.14 456.06 474.01 531.17 705.77 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.42 435.19 448.63 475.48 532.08 713.20 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.73 435.07 442.47 476.83 532.81 720.91 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.82 432.68 437.94 478.16 532.08 728.59 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.96 431.16 432.53 478.92 529.62 735.93 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.41 425.60 431.87 478.31 525.81 742.69 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.25 418.38 433.99 475.97 521.32 748.76 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.20 412.71 435.64 472.77 516.89 754.10 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.69 411.15 433.57 471.25 513.18 758.83 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.09 414.74 425.96 472.81 511.11 763.12 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.24 414.48 420.50 475.48 512.32 767.19 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.51 401.69 423.60 476.95 518.63 771.20 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.77 389.30 421.53 476.29 530.16 775.18 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.21 378.68 414.54 473.18 545.19 778.97 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.63 370.88 404.19 467.58 561.64 782.24 -------------------------------------------------------------------------------- K point *** = 0.203125 0.640625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.54 366.54 392.02 459.84 577.94 784.53 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.37 361.90 377.95 451.76 558.32 815.76 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.74 362.75 368.36 443.24 572.74 813.54 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.31 355.69 372.29 435.09 585.31 808.86 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.25 351.77 379.65 429.01 595.66 801.52 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.39 354.46 385.92 427.58 603.60 791.39 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.01 362.73 388.88 432.72 609.14 778.49 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.31 374.12 390.06 442.63 612.43 762.93 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.42 386.33 392.76 453.97 613.81 745.00 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.38 395.07 401.76 464.39 613.80 725.15 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.56 403.23 414.00 472.24 612.89 704.19 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.07 413.96 425.55 476.42 611.02 683.70 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.06 426.61 435.64 476.55 606.36 666.95 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.74 438.93 444.25 473.47 595.36 658.70 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.16 444.33 454.30 470.07 578.25 659.77 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 381.67 441.82 462.99 470.01 559.85 666.77 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 383.62 437.06 467.73 470.92 544.85 677.07 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 377.97 434.84 466.31 471.21 536.08 689.30 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.67 434.56 457.49 473.60 532.46 702.59 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.54 433.55 447.33 475.91 530.69 716.28 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.49 430.69 438.29 477.74 528.69 729.80 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.41 425.60 431.87 478.31 525.81 742.69 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.32 417.84 429.23 476.91 522.14 754.63 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.26 409.23 428.90 473.37 517.98 765.40 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.03 401.50 429.03 468.66 513.48 774.95 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.91 396.96 426.89 465.21 508.67 783.29 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.64 397.88 420.16 465.24 503.74 790.55 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.20 403.51 409.72 467.99 499.44 796.89 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.34 397.16 410.40 471.09 497.77 802.43 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.13 385.17 413.11 472.11 501.82 807.24 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.01 374.72 409.90 470.16 512.33 811.25 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.88 366.94 401.61 465.83 526.80 814.23 -------------------------------------------------------------------------------- K point *** = 0.203125 0.671875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.29 362.58 390.30 459.54 542.67 815.87 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.65 360.05 373.51 451.02 522.00 847.16 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.55 360.33 364.76 443.93 536.44 844.51 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.04 351.21 370.82 436.50 549.67 839.33 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.49 345.95 379.79 429.95 561.13 831.43 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.44 347.26 388.94 426.32 570.50 820.68 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.55 354.74 395.04 428.61 577.68 807.05 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.00 366.07 397.41 437.27 582.78 790.60 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.15 379.21 399.36 448.66 586.13 771.45 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.16 392.77 403.44 459.76 588.35 749.84 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.34 405.68 410.86 468.72 590.38 726.09 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.69 417.53 421.49 474.21 593.37 700.65 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.26 429.28 433.20 475.43 598.23 674.27 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.29 439.62 445.55 472.46 604.51 648.74 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.01 447.00 457.65 466.77 603.94 633.29 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 384.29 448.71 462.80 467.47 584.95 640.41 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 388.25 443.20 464.81 472.82 563.22 655.66 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 385.65 437.54 468.23 472.02 545.90 673.56 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.41 433.89 464.42 471.75 534.94 692.61 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.25 430.45 453.38 474.50 528.77 711.93 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.12 425.53 442.39 476.17 524.73 730.81 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.25 418.38 433.99 475.97 521.32 748.76 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.26 409.23 428.90 473.37 517.98 765.40 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.01 399.16 426.39 468.47 514.40 780.52 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.38 389.45 425.07 462.32 510.25 794.01 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.83 381.91 422.54 457.19 505.23 805.84 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.47 379.04 416.18 455.60 499.29 816.07 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.96 382.26 406.09 457.34 492.75 824.80 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.74 389.29 394.56 460.38 486.58 832.14 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.78 382.42 396.76 463.01 482.91 838.15 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.74 372.29 398.95 463.52 485.11 842.82 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.70 364.71 394.60 461.29 494.16 846.03 -------------------------------------------------------------------------------- K point *** = 0.203125 0.703125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.27 360.50 385.23 456.98 507.35 847.57 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.53 359.81 365.44 447.80 487.05 878.07 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.84 353.96 363.64 442.89 499.95 875.28 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.25 343.85 370.73 436.86 512.88 869.92 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.34 337.52 380.43 430.73 524.76 861.84 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.42 337.43 391.24 425.94 534.98 850.95 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.36 344.11 400.22 425.33 543.25 837.21 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.07 355.56 404.06 432.04 549.53 820.67 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.23 369.51 405.50 443.14 553.99 801.43 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.13 384.56 408.14 454.64 557.14 779.67 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.09 399.88 413.18 464.57 559.89 755.60 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.01 414.97 420.59 471.60 563.63 729.52 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.84 428.67 430.35 474.67 570.04 701.81 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.76 438.40 443.20 473.49 580.44 672.94 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.14 447.04 454.00 469.05 595.21 643.57 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 382.14 454.03 457.81 466.71 611.63 616.76 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 386.55 450.21 460.98 469.97 586.51 635.97 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 385.97 442.73 465.21 470.87 562.09 659.48 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 379.76 436.10 464.00 471.48 542.77 683.83 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.94 429.70 455.63 473.58 529.65 708.13 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.44 422.18 445.01 474.32 521.71 731.71 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.20 412.71 435.64 472.77 516.89 754.10 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.03 401.50 429.03 468.66 513.48 774.95 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.38 389.45 425.07 462.32 510.25 794.01 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.08 377.51 422.84 454.75 506.35 811.15 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.82 366.99 420.28 447.99 501.28 826.30 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.76 360.02 414.29 444.99 494.90 839.45 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.23 358.98 404.39 446.00 487.42 850.65 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.24 363.95 392.81 448.58 479.50 859.95 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.21 371.97 381.44 450.69 472.59 867.40 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.92 371.38 379.00 451.39 468.85 873.02 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.62 364.06 380.48 451.49 469.77 876.76 -------------------------------------------------------------------------------- K point *** = 0.203125 0.734375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.06 360.05 375.21 450.75 476.13 878.50 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.69 352.21 360.87 438.51 459.30 907.76 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.26 342.90 364.62 438.62 466.46 904.96 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.46 333.30 371.80 435.46 477.06 899.55 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.12 326.41 381.65 430.75 488.41 891.42 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.47 325.06 393.08 425.99 499.02 880.55 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.52 330.81 404.09 423.24 508.17 866.91 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.63 342.34 409.79 427.38 515.57 850.54 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.72 357.20 410.56 438.02 521.17 831.54 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.32 373.72 411.87 449.57 525.27 810.05 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.80 390.87 415.29 460.13 528.57 786.22 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.99 407.73 421.04 468.66 532.52 760.31 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.74 423.01 428.84 474.02 539.40 732.58 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.24 434.90 438.35 475.38 551.54 703.42 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.89 444.00 447.00 473.18 569.62 673.31 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.07 450.01 453.87 469.03 592.29 643.12 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 380.02 450.42 460.83 464.85 607.65 623.84 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 380.02 446.62 461.12 467.03 582.11 648.62 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 375.79 440.53 456.74 471.71 556.56 676.97 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 367.74 432.87 450.33 474.46 535.74 705.26 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.70 423.27 441.99 474.48 521.38 732.70 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.69 411.15 433.57 471.25 513.18 758.83 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.91 396.96 426.89 465.21 508.67 783.29 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.83 381.91 422.54 457.19 505.23 805.84 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.82 366.99 420.28 447.99 501.28 826.30 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.60 353.19 418.80 438.96 496.07 844.55 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.67 342.06 414.29 433.78 489.38 860.53 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.97 336.02 404.62 434.34 481.31 874.20 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.61 336.72 393.03 437.09 472.40 885.56 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.09 342.79 381.71 439.25 463.94 894.63 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.18 350.93 371.96 438.74 458.32 901.41 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.31 357.19 364.78 436.28 456.54 905.90 -------------------------------------------------------------------------------- K point *** = 0.203125 0.765625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.35 357.87 360.94 436.18 456.77 908.04 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.78 332.23 362.89 417.78 446.39 935.79 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.42 326.88 366.65 422.69 446.06 933.08 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.23 319.15 373.76 427.97 447.70 927.66 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.21 312.55 383.46 428.47 454.45 919.54 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.73 310.31 394.81 425.56 464.09 908.73 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.11 314.97 406.61 422.26 473.76 895.25 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.75 326.38 414.48 423.53 482.32 879.16 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.67 342.06 414.29 433.78 489.38 860.53 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.76 360.02 414.29 444.99 494.90 839.45 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.47 379.04 416.18 455.60 499.29 816.07 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.64 397.88 420.16 465.24 503.74 790.55 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.09 414.74 425.96 472.81 511.11 763.12 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.00 427.79 432.87 476.35 525.33 734.06 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.84 436.74 439.68 475.85 547.03 703.81 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 367.13 441.63 446.22 473.11 573.50 673.13 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 370.44 443.54 451.03 470.28 599.94 645.03 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 370.44 443.54 451.03 470.28 599.94 645.03 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 367.13 441.63 446.22 473.11 573.50 673.13 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.84 436.74 439.68 475.85 547.03 703.81 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.00 427.79 432.87 476.35 525.33 734.06 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.09 414.74 425.96 472.81 511.11 763.12 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.64 397.88 420.16 465.24 503.74 790.55 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.47 379.04 416.18 455.60 499.29 816.07 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.76 360.02 414.29 444.99 494.90 839.45 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.67 342.06 414.29 433.78 489.38 860.53 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.75 326.38 414.48 423.53 482.32 879.16 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.11 314.97 406.61 422.26 473.76 895.25 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.73 310.31 394.81 425.56 464.09 908.73 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.21 312.55 383.46 428.47 454.45 919.54 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.23 319.15 373.76 427.97 447.70 927.66 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.42 326.88 366.65 422.69 446.06 933.08 -------------------------------------------------------------------------------- K point *** = 0.203125 0.796875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.78 332.23 362.89 417.78 446.39 935.79 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 221.39 305.39 365.72 396.58 438.14 961.84 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.89 305.13 369.43 397.17 438.20 959.30 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.07 300.89 376.36 403.33 437.00 953.92 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.05 295.78 385.70 412.29 435.26 945.82 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.44 293.37 396.51 419.80 435.50 935.08 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.21 296.98 407.91 420.98 441.84 921.79 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.48 307.98 418.06 420.08 451.01 906.02 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.11 324.22 416.57 430.36 459.84 887.81 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.46 343.29 415.60 440.69 467.50 867.25 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.16 363.80 416.19 450.73 473.90 844.41 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.08 384.30 418.51 460.87 479.73 819.42 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.09 402.61 422.33 469.97 488.31 792.43 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.41 416.58 427.00 474.42 505.47 763.69 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.55 426.05 431.52 475.35 530.44 733.56 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.17 432.02 435.21 474.91 559.62 702.71 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.03 434.60 438.24 474.39 589.18 673.10 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.03 434.25 439.90 474.72 606.89 655.99 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.29 431.31 439.69 476.04 590.07 673.88 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.06 426.38 437.17 477.58 561.58 704.34 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.62 420.44 431.27 478.03 534.10 736.10 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.24 414.48 420.50 475.48 512.32 767.19 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.20 403.51 409.72 467.99 499.44 796.89 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.96 382.26 406.09 457.34 492.75 824.80 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.23 358.98 404.39 446.00 487.42 850.65 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.97 336.02 404.62 434.34 481.31 874.20 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.11 314.97 406.61 422.26 473.76 895.25 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.78 297.51 409.79 410.07 464.66 913.64 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.36 286.42 397.68 414.08 454.30 929.21 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.46 283.60 386.31 417.81 443.61 941.85 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.85 287.06 376.62 417.97 435.79 951.46 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.64 293.78 369.51 410.86 434.97 957.99 -------------------------------------------------------------------------------- K point *** = 0.203125 0.828125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 221.98 300.89 365.74 402.00 436.81 961.43 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 205.11 274.15 369.21 378.26 429.65 985.64 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 208.26 278.13 371.96 374.58 431.43 983.37 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.57 278.29 374.59 380.53 431.72 978.08 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.20 276.02 381.39 390.00 430.60 970.01 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.96 274.53 390.96 401.11 428.45 959.36 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.91 277.47 401.43 412.64 426.04 946.28 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.92 287.82 411.46 420.51 427.47 930.85 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.12 304.31 416.76 424.27 437.04 913.12 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.54 323.98 416.20 433.27 446.63 893.12 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.04 345.20 415.96 443.17 455.03 870.89 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.58 366.51 416.91 453.92 462.74 846.51 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.11 385.75 418.96 463.06 474.21 820.08 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.90 400.85 421.60 467.82 494.24 791.80 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.55 411.57 423.93 470.71 520.64 761.98 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.80 419.20 425.08 472.78 550.81 731.20 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.56 424.28 425.13 474.53 581.63 700.99 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.82 421.99 429.23 476.19 606.00 677.46 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.70 417.92 431.95 477.69 603.43 680.68 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.35 412.73 432.62 478.74 577.39 707.28 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.91 407.08 430.33 478.81 546.88 739.04 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.51 401.69 423.60 476.95 518.63 771.20 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.34 397.16 410.40 471.09 497.77 802.43 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.74 389.29 394.56 460.38 486.58 832.14 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.24 363.95 392.81 448.58 479.50 859.95 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.61 336.72 393.03 437.09 472.40 885.56 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.73 310.31 394.81 425.56 464.09 908.73 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.36 286.42 397.68 414.08 454.30 929.21 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.05 267.37 398.42 405.73 443.18 946.80 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 235.64 257.55 389.52 407.75 431.43 961.29 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.89 256.78 380.20 408.27 422.56 972.50 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.68 260.99 373.14 399.27 423.07 980.31 -------------------------------------------------------------------------------- K point *** = 0.203125 0.859375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 206.58 267.60 369.32 387.65 426.61 984.67 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.61 241.67 361.26 373.32 420.47 1006.92 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 192.19 247.97 352.83 376.92 423.94 1005.06 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.40 252.06 350.05 383.63 426.05 999.95 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.32 253.49 353.65 392.46 426.69 991.96 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.85 254.15 362.34 402.36 425.98 981.43 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.44 257.27 374.01 412.43 424.26 968.57 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.18 266.90 387.02 421.86 422.24 953.51 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.81 283.46 400.38 419.84 430.93 936.29 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.21 303.22 412.93 419.02 438.86 916.90 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.50 324.43 415.93 428.77 446.00 895.33 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.66 345.78 416.02 442.50 453.45 871.61 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.74 365.50 416.68 452.70 466.75 845.81 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.13 381.87 417.59 458.31 488.41 818.08 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.50 394.39 418.04 462.69 515.43 788.69 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.72 403.74 417.41 466.66 545.81 758.16 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.74 410.48 415.73 470.30 577.05 727.73 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.58 410.42 417.79 473.49 604.17 701.44 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.29 405.78 421.80 475.98 612.59 693.37 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.90 400.19 424.33 477.50 592.94 712.74 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.39 394.48 424.61 477.75 562.23 742.88 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.77 389.30 421.53 476.29 530.16 775.18 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.13 385.17 413.11 472.11 501.82 807.24 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.78 382.42 396.76 463.01 482.91 838.15 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.21 371.97 381.44 450.69 472.59 867.40 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.09 342.79 381.71 439.25 463.94 894.63 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.21 312.55 383.46 428.47 454.45 919.54 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.46 283.60 386.31 417.81 443.61 941.85 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 235.64 257.55 389.52 407.75 431.43 961.29 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.01 237.04 389.73 401.59 418.37 977.59 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.26 229.82 383.48 399.58 408.47 990.47 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 200.33 230.63 377.02 387.31 411.10 999.72 -------------------------------------------------------------------------------- K point *** = 0.203125 0.890625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 192.26 235.19 372.68 374.13 415.97 1005.20 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 175.61 210.58 344.63 377.80 410.94 1025.37 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 177.44 217.23 333.70 381.19 415.70 1024.15 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 184.36 223.86 327.48 387.64 419.46 1019.38 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 195.24 228.96 327.63 395.97 421.93 1011.57 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 208.92 232.73 334.27 404.96 423.02 1001.20 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.22 237.27 345.83 413.70 422.86 988.61 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.46 246.48 360.40 421.31 422.14 973.97 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.43 263.02 376.65 420.20 428.66 957.29 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.99 282.42 393.84 418.71 434.60 938.53 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.25 303.14 411.18 418.20 439.84 917.64 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.15 324.23 416.02 430.80 445.75 894.60 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.91 344.27 415.84 442.77 459.66 869.44 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.07 361.86 415.42 448.12 483.49 842.29 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.43 376.26 414.28 452.68 511.74 813.39 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.90 387.57 411.97 457.46 542.62 783.20 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.47 396.22 408.48 462.29 574.23 752.77 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.14 400.51 406.21 466.76 602.91 725.04 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.87 396.15 410.03 470.42 618.49 709.70 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.57 390.01 413.59 472.91 607.15 720.35 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.07 383.94 415.34 473.94 578.59 747.38 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.21 378.68 414.54 473.18 545.19 778.97 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.01 374.72 409.90 470.16 512.33 811.25 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.74 372.29 398.95 463.52 485.11 842.82 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.92 371.38 379.00 451.39 468.85 873.02 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.18 350.93 371.96 438.74 458.32 901.41 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.23 319.15 373.76 427.97 447.70 927.66 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.85 287.06 376.62 417.97 435.79 951.46 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.89 256.78 380.20 408.27 422.56 972.50 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.26 229.82 383.48 399.58 408.47 990.47 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 206.22 208.04 382.03 392.87 397.77 1005.02 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 190.40 204.45 372.15 383.09 400.48 1015.83 -------------------------------------------------------------------------------- K point *** = 0.203125 0.921875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 179.80 205.85 358.21 378.29 405.64 1022.65 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 163.96 183.16 327.88 382.59 401.91 1040.62 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 164.88 188.32 315.33 385.63 407.23 1040.35 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 171.41 195.75 306.73 391.75 412.12 1036.18 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 181.95 203.64 304.03 399.54 416.17 1028.73 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 195.17 210.88 308.45 407.56 419.07 1018.66 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.04 218.08 319.43 414.86 420.69 1006.43 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.03 227.73 335.14 420.78 421.40 992.26 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.55 244.07 353.84 420.67 426.10 976.15 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.77 262.64 374.39 419.85 430.06 958.02 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.30 282.69 396.11 419.08 433.33 937.79 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.15 303.53 415.20 421.35 437.30 915.40 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.79 323.91 416.41 433.16 451.37 890.87 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.96 342.51 415.14 437.50 477.66 864.28 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.54 358.45 412.71 441.53 507.61 835.87 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.50 371.48 408.94 446.35 539.47 806.05 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.81 381.79 403.90 451.69 571.77 775.71 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.43 389.49 398.17 456.98 601.75 747.12 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.26 389.58 397.40 461.62 622.14 727.16 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.12 382.98 401.34 465.16 619.20 729.38 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.68 376.40 403.84 467.25 594.63 752.05 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.63 370.88 404.19 467.58 561.64 782.24 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.88 366.94 401.61 465.83 526.80 814.23 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.70 364.71 394.60 461.29 494.16 846.03 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.62 364.06 380.48 451.49 469.77 876.76 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.31 357.19 364.78 436.28 456.54 905.90 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.42 326.88 366.65 422.69 446.06 933.08 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.64 293.78 369.51 410.86 434.97 957.99 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.68 260.99 373.14 399.27 423.07 980.31 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 200.33 230.63 377.02 387.31 411.10 999.72 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 190.40 204.45 372.15 383.09 400.48 1015.83 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.39 185.37 357.77 385.41 394.38 1028.25 -------------------------------------------------------------------------------- K point *** = 0.203125 0.953125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 169.96 181.66 342.53 383.26 396.78 1036.60 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 155.39 161.82 311.20 387.38 394.77 1052.18 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 155.19 163.80 297.61 389.52 399.98 1053.27 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 161.39 169.89 287.48 395.12 405.11 1050.11 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 171.43 178.99 282.82 402.44 409.90 1043.37 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 183.56 189.33 285.42 409.59 414.12 1033.83 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.97 199.92 295.69 415.40 417.47 1022.11 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.22 211.48 312.18 419.62 419.72 1008.47 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.15 226.93 332.83 420.74 422.66 992.95 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.51 244.52 356.08 421.00 424.63 975.43 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.40 264.22 380.97 420.92 425.93 955.80 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.38 285.07 405.99 420.92 427.95 933.99 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.19 305.75 417.89 423.37 441.98 910.00 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.71 325.02 416.31 426.55 470.44 883.92 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.84 342.00 412.67 430.17 502.14 855.95 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.51 356.25 407.70 434.76 535.24 826.47 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.69 367.74 401.62 440.08 568.53 796.25 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.31 376.69 394.68 445.62 599.84 767.09 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.22 383.24 387.36 450.82 623.81 744.07 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.18 379.31 388.46 455.18 628.50 738.95 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.77 372.30 391.26 458.29 609.27 756.33 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.54 366.54 392.02 459.84 577.94 784.53 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.29 362.58 390.30 459.54 542.67 815.87 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.27 360.50 385.23 456.98 507.35 847.57 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.06 360.05 375.21 450.75 476.13 878.50 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.35 357.87 360.94 436.18 456.77 908.04 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.78 332.23 362.89 417.78 446.39 935.79 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 221.98 300.89 365.74 402.00 436.81 961.43 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 206.58 267.60 369.32 387.65 426.61 984.67 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 192.26 235.19 372.68 374.13 415.97 1005.20 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 179.80 205.85 358.21 378.29 405.64 1022.65 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 169.96 181.66 342.53 383.26 396.78 1036.60 -------------------------------------------------------------------------------- K point *** = 0.203125 0.984375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 162.75 165.39 326.59 387.59 391.50 1046.57 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 169.16 173.05 342.22 385.99 390.94 1039.65 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 165.12 172.54 327.18 386.28 396.16 1043.45 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 168.02 176.36 314.07 390.31 401.75 1042.85 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 175.64 183.90 304.63 397.18 407.17 1038.28 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.92 193.63 300.82 405.04 412.19 1030.48 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.83 203.69 304.18 412.25 416.58 1020.15 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.81 213.66 314.67 418.02 420.02 1007.81 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.45 224.77 330.64 422.27 422.34 993.65 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.95 239.70 350.13 423.53 425.37 977.65 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.60 257.17 371.73 424.06 427.51 959.71 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.59 277.05 394.55 424.26 429.27 939.68 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.56 298.19 416.37 424.31 433.11 917.50 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.33 319.12 421.69 428.68 450.68 893.16 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.76 338.42 419.12 433.18 478.04 866.75 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.78 355.18 415.04 438.20 508.33 838.47 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.36 369.03 409.74 443.99 540.30 808.75 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.45 380.15 403.38 450.12 572.62 778.47 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.02 388.85 396.22 456.00 602.63 749.85 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.94 388.24 395.79 461.09 623.22 729.65 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.97 380.47 400.60 464.95 620.77 731.31 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.76 373.23 403.51 467.25 596.42 753.66 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.89 367.27 404.17 467.71 563.34 783.79 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.22 363.10 401.88 466.02 528.19 815.85 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.01 360.80 395.14 461.47 495.12 847.79 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.82 360.17 381.23 451.57 470.25 878.69 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.35 357.87 360.94 436.18 456.77 908.04 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.24 327.13 362.86 422.50 446.16 935.44 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.15 293.42 365.76 410.66 434.94 960.57 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 208.74 259.98 369.48 399.01 422.92 983.11 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 195.72 229.02 373.85 386.61 410.84 1002.69 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 184.84 202.48 372.66 378.98 399.98 1018.93 -------------------------------------------------------------------------------- K point *** = 0.234375 0.015625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 176.74 182.34 357.78 383.96 391.94 1031.39 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 165.12 172.54 327.18 386.28 396.16 1043.45 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 155.28 171.78 312.14 384.26 400.30 1049.24 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 153.07 175.27 299.10 385.44 405.23 1050.66 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 157.67 181.72 289.82 390.16 409.87 1047.92 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 167.42 189.39 286.34 397.17 413.76 1041.59 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 180.63 196.89 290.15 404.89 416.56 1032.35 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.03 204.39 301.04 412.12 418.11 1020.78 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.97 214.08 317.28 417.91 418.81 1007.15 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.56 231.33 337.05 417.72 423.36 991.51 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.15 250.45 359.12 416.58 427.21 973.82 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.38 270.62 382.79 415.36 430.20 953.98 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.21 291.26 406.35 415.36 433.20 931.95 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.98 311.37 411.83 427.78 443.47 907.76 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.35 329.86 410.78 432.23 470.17 881.50 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.15 345.96 408.80 434.93 501.41 853.38 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.31 359.31 405.63 438.33 534.34 823.78 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.79 369.92 401.18 442.60 567.58 793.49 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.52 378.00 395.72 447.32 598.86 764.32 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.40 383.12 390.33 451.91 622.73 741.43 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.20 380.84 390.20 455.82 627.03 736.75 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.58 375.03 392.14 458.62 607.50 754.53 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.18 369.92 392.46 459.95 576.20 782.85 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.86 366.31 390.39 459.53 541.15 814.16 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.89 364.36 385.02 456.92 506.21 845.76 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.83 363.92 374.72 450.71 475.49 876.54 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.31 357.19 364.78 436.28 456.54 905.90 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.98 331.73 366.67 418.10 446.33 933.44 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.48 300.88 369.46 402.41 436.87 958.87 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.49 268.22 372.92 388.18 426.77 981.91 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.77 236.48 372.70 378.23 416.23 1002.24 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.14 207.67 358.40 382.11 406.02 1019.55 -------------------------------------------------------------------------------- K point *** = 0.234375 0.046875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 176.28 183.85 342.90 386.16 397.79 1033.43 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 168.02 176.36 314.07 390.31 401.75 1042.85 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 153.07 175.27 299.10 385.44 405.23 1050.66 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 145.50 177.76 286.57 383.15 409.14 1054.41 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 145.71 182.31 278.38 384.73 412.38 1054.02 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.94 187.04 276.56 389.79 414.52 1049.78 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 165.72 191.12 282.06 397.05 415.37 1042.18 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.43 195.61 293.88 405.02 414.98 1031.75 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 200.28 203.69 310.11 411.63 414.55 1018.84 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.77 223.72 329.21 410.63 420.12 1003.63 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.67 245.90 350.37 408.11 425.81 986.14 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.19 268.32 373.29 405.63 430.53 966.40 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.28 290.03 396.81 404.58 434.61 944.41 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.02 310.09 400.67 423.24 440.60 920.24 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.72 327.74 399.44 434.04 461.78 894.00 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.91 342.62 398.36 436.71 492.99 865.91 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.32 354.62 397.22 438.39 526.62 836.34 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.74 363.87 395.65 440.21 560.77 805.96 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.07 370.56 393.36 442.52 593.36 776.26 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.18 374.84 390.48 445.25 620.07 751.25 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.87 376.55 387.69 448.03 630.54 741.03 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.91 375.68 385.67 450.42 616.57 753.77 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.07 373.46 383.71 452.00 587.71 779.98 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.31 371.38 380.51 452.41 553.50 810.45 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.91 369.82 375.34 451.29 518.14 841.65 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.34 364.49 371.49 447.93 484.54 872.19 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.18 350.93 371.96 438.74 458.32 901.41 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.02 330.77 373.73 418.82 446.23 928.90 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.50 304.67 376.31 398.43 438.32 954.37 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.32 275.02 377.83 382.24 430.11 977.58 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 202.28 244.54 363.01 384.20 421.19 998.31 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 190.30 215.42 346.59 388.36 411.91 1016.30 -------------------------------------------------------------------------------- K point *** = 0.234375 0.078125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 181.30 189.47 330.17 391.89 403.70 1031.26 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 175.64 183.90 304.63 397.18 407.17 1038.28 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 157.67 181.72 289.82 390.16 409.87 1047.92 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 145.71 182.31 278.38 384.73 412.38 1054.02 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 141.05 183.81 272.35 382.66 413.85 1056.29 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 144.18 184.61 273.38 384.57 414.02 1054.62 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 154.54 184.96 281.27 389.93 412.89 1049.18 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 170.76 186.66 294.19 397.32 410.80 1040.33 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 190.05 192.61 310.21 403.80 409.67 1028.43 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.11 215.34 328.11 402.53 415.70 1013.77 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.34 240.76 347.36 399.08 423.07 996.54 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.76 266.62 368.00 395.70 429.67 976.86 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.37 291.33 388.94 394.32 435.42 954.83 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.24 313.34 389.55 415.68 441.22 930.58 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.59 331.62 387.85 434.69 454.64 904.26 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.82 345.96 386.82 440.30 483.52 876.09 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.41 356.65 386.53 442.24 517.22 846.42 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.97 364.11 386.92 443.08 552.07 815.85 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.18 368.83 387.74 443.47 585.88 785.63 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.80 371.39 388.44 443.80 615.08 758.84 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.67 372.44 388.43 444.28 631.09 743.81 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.66 372.37 387.41 444.93 623.22 751.11 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.75 371.27 385.49 445.55 597.37 774.90 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.04 368.70 383.25 445.84 564.45 804.47 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.78 363.66 381.59 445.40 529.46 835.27 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.31 355.23 381.10 443.74 494.94 865.59 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.09 342.79 381.71 439.25 463.94 894.63 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.62 325.79 383.24 423.96 445.72 921.98 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.51 304.09 385.40 400.54 438.52 947.35 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.46 278.64 377.51 389.39 432.16 970.55 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.31 251.27 357.78 392.68 425.06 991.40 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.04 223.93 339.11 396.50 417.18 1009.76 -------------------------------------------------------------------------------- K point *** = 0.234375 0.109375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.61 198.30 321.33 399.72 409.39 1025.47 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.92 193.63 300.82 405.04 412.19 1030.48 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 167.42 189.39 286.34 397.17 413.76 1041.59 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 152.94 187.04 276.56 389.79 414.52 1049.78 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 144.18 184.61 273.38 384.57 414.02 1054.62 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 142.55 181.43 277.44 382.83 412.21 1055.69 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 148.71 178.75 287.36 385.02 409.32 1052.75 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 162.23 178.51 301.06 390.39 405.90 1045.86 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 181.83 182.03 316.84 395.68 404.34 1035.31 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.30 206.26 333.61 394.20 410.38 1021.46 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 200.05 233.74 350.87 390.25 419.00 1004.63 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.29 262.77 368.61 386.39 427.40 985.10 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.03 291.40 381.69 388.87 435.03 963.06 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.40 317.32 379.37 409.65 442.09 938.71 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.61 338.41 377.29 431.76 451.36 912.25 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.02 353.89 376.12 443.59 474.02 883.94 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.03 364.17 376.26 447.41 506.52 854.09 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.11 369.76 378.37 448.80 541.59 823.26 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.77 372.21 381.75 448.82 576.39 792.47 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.66 373.54 384.81 447.88 607.74 764.14 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.64 374.06 387.21 446.35 628.62 744.92 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.76 373.34 389.09 444.61 627.23 746.46 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.18 370.88 390.43 442.99 604.94 767.41 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.09 366.32 391.25 441.68 573.60 796.04 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.67 359.32 391.75 440.59 539.40 826.50 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.09 349.54 392.24 439.34 505.02 856.64 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.61 336.72 393.03 437.09 472.40 885.56 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.57 320.64 394.27 429.46 446.69 912.79 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.47 301.33 395.69 407.56 437.59 938.05 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.95 279.32 381.53 399.41 432.77 961.17 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.87 255.62 358.81 402.09 427.56 982.03 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.23 231.50 337.71 405.19 421.42 1000.58 -------------------------------------------------------------------------------- K point *** = 0.234375 0.140625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.91 208.26 318.28 407.89 414.63 1016.75 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.83 203.69 304.18 412.25 416.58 1020.15 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 180.63 196.89 290.15 404.89 416.56 1032.35 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 165.72 191.12 282.06 397.05 415.37 1042.18 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 154.54 184.96 281.27 389.93 412.89 1049.18 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 148.71 178.75 287.36 385.02 409.32 1052.75 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 149.80 174.19 298.47 383.63 405.01 1052.31 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 158.62 172.94 312.60 385.92 400.63 1047.61 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 173.88 176.89 328.18 389.12 398.68 1038.74 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.34 198.11 344.15 386.99 404.50 1026.03 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 192.79 225.56 359.89 382.76 413.86 1009.91 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 205.78 256.10 374.43 379.45 423.75 990.73 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 220.40 287.79 374.13 391.58 433.25 968.84 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 235.83 318.19 371.10 408.37 442.06 944.49 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.34 344.15 368.79 427.76 451.00 917.95 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.27 363.00 367.56 444.97 466.47 889.49 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.99 366.93 375.51 452.37 495.30 859.45 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.87 367.91 382.64 455.36 529.71 828.31 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.33 370.26 386.37 456.16 565.08 796.94 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.96 373.89 387.71 455.29 598.18 767.23 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.66 378.01 387.64 453.09 623.25 744.38 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.67 379.68 388.72 449.91 628.53 739.90 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.31 376.50 392.70 446.17 610.37 757.42 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.83 370.27 397.04 442.39 580.80 785.04 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.40 361.53 400.55 439.08 547.61 815.23 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.09 350.15 403.01 436.49 513.90 845.31 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.97 336.02 404.62 434.34 481.31 874.20 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.18 319.23 405.82 431.02 451.97 901.40 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.92 300.21 406.34 416.74 436.28 926.62 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.61 279.71 389.83 409.84 432.18 949.71 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 235.97 258.61 365.70 411.47 428.68 970.59 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.98 237.72 343.01 413.42 424.41 989.27 -------------------------------------------------------------------------------- K point *** = 0.234375 0.171875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.60 217.72 322.26 415.06 419.16 1005.78 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.81 213.66 314.67 418.02 420.02 1007.81 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.03 204.39 301.04 412.12 418.11 1020.78 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.43 195.61 293.88 405.02 414.98 1031.75 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 170.76 186.66 294.19 397.32 410.80 1040.33 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 162.23 178.51 301.06 390.39 405.90 1045.86 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 158.62 172.94 312.60 385.92 400.63 1047.61 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 161.79 171.27 326.88 385.05 395.47 1045.06 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 171.64 175.20 342.36 385.91 392.87 1038.06 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 179.64 192.74 357.86 382.42 398.45 1026.83 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.65 218.03 372.31 378.03 408.07 1011.77 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 202.13 248.00 372.79 386.85 419.14 993.30 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.32 280.73 368.89 399.82 430.40 971.84 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.46 314.06 365.64 412.84 441.11 947.72 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.85 345.03 363.23 427.42 451.20 921.27 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.83 361.85 369.64 444.24 462.94 892.79 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.76 361.69 385.41 456.19 485.09 862.61 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.99 363.00 393.87 461.51 517.19 831.20 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.86 366.05 397.61 463.69 552.39 799.28 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.93 370.90 398.21 463.70 586.71 768.35 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.16 377.24 396.49 461.88 615.24 742.33 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.86 384.26 392.99 458.52 627.14 731.70 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.42 386.33 392.76 453.97 613.81 745.00 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.15 379.21 399.36 448.66 586.13 771.45 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.23 369.51 405.50 443.14 553.99 801.43 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.72 357.20 410.56 438.02 521.17 831.54 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.67 342.06 414.29 433.78 489.38 860.53 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.11 324.22 416.57 430.36 459.84 887.81 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.12 304.31 416.76 424.27 437.04 913.12 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.81 283.46 400.38 419.84 430.93 936.29 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.43 263.02 376.65 420.20 428.66 957.29 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.55 244.07 353.84 420.67 426.10 976.15 -------------------------------------------------------------------------------- K point *** = 0.234375 0.203125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.15 226.93 332.83 420.74 422.66 992.95 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.45 224.77 330.64 422.27 422.34 993.65 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.97 214.08 317.28 417.91 418.81 1007.15 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 200.28 203.69 310.11 411.63 414.55 1018.84 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 190.05 192.61 310.21 403.80 409.67 1028.43 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 181.83 182.03 316.84 395.68 404.34 1035.31 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 173.88 176.89 328.18 389.12 398.68 1038.74 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 171.64 175.20 342.36 385.91 392.87 1038.06 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 177.22 177.22 357.80 387.06 387.06 1032.94 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.85 191.27 373.09 381.42 392.73 1023.40 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 191.69 212.93 376.11 386.86 402.53 1009.74 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 203.11 240.54 371.29 398.74 415.11 992.36 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.39 272.25 367.10 409.55 428.33 971.71 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 230.81 306.15 363.71 420.03 440.84 948.17 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.69 339.92 361.25 431.09 452.20 922.09 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.38 359.89 370.00 444.24 463.11 893.82 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.20 359.84 391.77 458.23 478.46 863.69 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.49 361.37 403.80 466.48 505.47 832.15 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.59 364.72 409.01 470.28 539.15 799.81 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.07 369.96 410.07 471.44 573.90 767.82 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.86 376.80 408.32 470.49 605.04 739.11 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.27 384.60 404.38 467.74 623.23 722.39 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.69 392.67 398.52 463.43 615.60 730.34 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.41 390.75 400.44 457.91 589.92 755.33 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.59 380.86 407.54 451.62 558.70 785.14 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.31 368.46 413.70 445.12 526.77 815.37 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.60 353.19 418.80 438.96 496.07 844.55 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.49 335.02 422.73 433.44 467.68 872.04 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.01 314.59 425.48 427.27 443.34 897.56 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.26 293.15 411.64 427.05 431.57 920.94 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.38 272.26 389.80 427.46 428.45 942.17 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.58 253.39 368.29 426.75 426.76 961.28 -------------------------------------------------------------------------------- K point *** = 0.234375 0.234375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.14 237.53 348.21 424.99 425.03 978.39 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.95 239.70 350.13 423.53 425.37 977.65 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.56 231.33 337.05 417.72 423.36 991.51 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.77 223.72 329.21 410.63 420.12 1003.63 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.11 215.34 328.11 402.53 415.70 1013.77 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.30 206.26 333.61 394.20 410.38 1021.46 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.34 198.11 344.15 386.99 404.50 1026.03 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 179.64 192.74 357.86 382.42 398.45 1026.83 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.85 191.27 373.09 381.42 392.73 1023.40 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 192.31 194.81 381.35 389.53 389.61 1015.60 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.72 211.42 378.15 393.99 405.05 1003.57 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.13 235.54 373.47 402.49 419.94 987.63 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 220.80 264.68 369.16 412.46 433.72 968.17 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.01 297.13 365.63 422.88 446.15 945.59 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.02 331.04 363.10 433.50 457.19 920.27 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.11 361.69 363.93 444.94 467.19 892.54 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.59 361.83 391.39 458.15 478.14 862.77 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.78 363.52 409.33 469.45 497.17 831.35 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.05 367.04 418.05 475.11 526.84 798.82 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.97 372.38 420.87 477.38 560.65 766.07 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.44 379.23 419.99 477.39 593.28 735.18 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.70 386.98 416.50 475.53 616.97 712.72 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.07 394.95 410.90 472.02 616.17 713.86 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.77 401.84 404.14 467.11 592.72 736.84 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.94 393.63 409.72 461.13 562.17 766.45 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.62 381.74 415.60 454.54 530.90 796.86 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.82 366.99 420.28 447.99 501.28 826.30 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.52 349.19 423.59 442.02 474.48 854.08 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.75 328.89 425.42 436.24 451.62 879.90 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.58 307.44 422.27 427.65 438.83 903.60 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.15 286.60 403.92 426.96 434.79 925.15 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.76 267.88 384.75 426.78 431.73 944.60 -------------------------------------------------------------------------------- K point *** = 0.234375 0.265625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.18 251.90 366.51 426.38 428.13 962.05 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.60 257.17 371.73 424.06 427.51 959.71 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.15 250.45 359.12 416.58 427.21 973.82 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.67 245.90 350.37 408.11 425.81 986.14 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.34 240.76 347.36 399.08 423.07 996.54 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 200.05 233.74 350.87 390.25 419.00 1004.63 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 192.79 225.56 359.89 382.76 413.86 1009.91 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.65 218.03 372.31 378.03 408.07 1011.77 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 191.69 212.93 376.11 386.86 402.53 1009.74 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.72 211.42 378.15 393.99 405.05 1003.57 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.45 214.51 380.89 392.62 419.01 993.25 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 220.03 234.50 378.89 398.33 433.02 978.98 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.27 260.04 374.89 408.37 445.89 961.06 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.71 289.55 371.27 419.72 457.27 939.84 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.47 321.57 368.65 431.43 467.12 915.67 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.74 354.13 367.38 443.35 475.66 888.90 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.74 367.38 384.63 456.04 483.92 859.87 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.77 369.28 408.29 468.97 495.70 828.95 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.20 372.94 422.49 477.37 517.84 796.60 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.61 378.31 428.82 480.82 548.33 763.50 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.88 385.03 430.02 481.58 580.81 731.06 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.13 392.52 427.74 480.55 608.57 703.69 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.56 400.13 422.89 478.03 615.87 696.32 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.32 407.20 416.03 474.18 595.29 716.26 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.46 406.66 413.94 469.19 565.12 745.56 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.98 395.70 418.89 463.37 534.10 776.12 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.83 381.91 422.54 457.19 505.23 805.84 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.97 364.98 424.72 451.21 479.98 833.95 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.40 345.28 425.58 445.25 459.15 860.13 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.18 324.24 425.52 435.09 446.22 884.21 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.56 303.75 418.19 426.58 440.63 906.15 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.17 285.25 402.22 426.64 435.86 925.98 -------------------------------------------------------------------------------- K point *** = 0.234375 0.296875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.07 269.24 386.46 427.14 430.47 943.79 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.59 277.05 394.55 424.26 429.27 939.68 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.38 270.62 382.79 415.36 430.20 953.98 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.19 268.32 373.29 405.63 430.53 966.40 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.76 266.62 368.00 395.70 429.67 976.86 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.29 262.77 368.61 386.39 427.40 985.10 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 205.78 256.10 374.43 379.45 423.75 990.73 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 202.13 248.00 372.79 386.85 419.14 993.30 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 203.11 240.54 371.29 398.74 415.11 992.36 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.13 235.54 373.47 402.49 419.94 987.63 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 220.03 234.50 378.89 398.33 433.02 978.98 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.29 241.26 384.57 396.05 446.49 966.48 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.40 260.67 383.54 402.98 458.86 950.34 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.84 285.84 380.08 414.44 469.69 930.81 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.12 314.33 377.33 426.89 478.81 908.19 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.45 344.55 375.98 439.55 486.36 882.81 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.95 373.31 377.46 452.41 492.95 854.97 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.85 377.94 401.46 465.48 500.63 825.01 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.51 381.83 420.96 476.30 514.60 793.32 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.50 387.30 432.26 481.52 538.71 760.42 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.64 393.97 437.01 482.82 568.68 727.23 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.97 401.23 437.06 482.22 598.28 696.33 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.55 408.44 433.67 480.48 614.43 679.19 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.40 415.02 427.69 477.82 598.42 694.02 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.48 419.38 420.73 474.30 568.50 722.75 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.68 409.48 424.56 470.04 537.35 753.37 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.91 396.96 426.89 465.21 508.67 783.29 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.08 381.40 427.58 460.05 484.42 811.69 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.17 362.88 427.08 454.49 465.41 838.22 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.31 342.79 426.19 446.08 452.94 862.71 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.95 323.08 425.47 433.79 446.21 885.06 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.15 305.05 419.70 426.95 439.88 905.31 -------------------------------------------------------------------------------- K point *** = 0.234375 0.328125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.15 289.25 407.17 427.47 432.89 923.48 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.56 298.19 416.37 424.31 433.11 917.50 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.21 291.26 406.35 415.36 433.20 931.95 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.28 290.03 396.81 404.58 434.61 944.41 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.37 291.33 388.94 394.32 435.42 954.83 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.03 291.40 381.69 388.87 435.03 963.06 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 220.40 287.79 374.13 391.58 433.25 968.84 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.32 280.73 368.89 399.82 430.40 971.84 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.39 272.25 367.10 409.55 428.33 971.71 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 220.80 264.68 369.16 412.46 433.72 968.17 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.27 260.04 374.89 408.37 445.89 961.06 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.40 260.67 383.54 402.98 458.86 950.34 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.61 270.28 392.43 399.78 470.91 936.09 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.38 288.75 391.27 408.85 481.43 918.50 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.36 312.09 388.27 421.69 490.16 897.78 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.80 338.18 386.68 434.89 497.15 874.20 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.95 365.27 387.03 448.03 502.79 848.01 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.92 387.37 393.32 460.96 508.29 819.52 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.00 392.61 414.47 472.58 516.80 789.05 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.73 398.40 430.32 479.78 533.25 757.01 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.87 405.23 439.58 481.76 558.07 723.99 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.34 412.48 443.28 480.97 586.61 691.33 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.09 419.44 442.47 479.29 610.22 665.20 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.99 425.45 438.18 477.49 602.62 670.77 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.87 429.38 431.92 475.63 573.31 698.41 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.49 422.10 432.99 473.60 542.01 728.87 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.69 411.15 433.57 471.25 513.18 758.83 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.35 397.47 432.31 468.34 489.17 787.41 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.53 380.81 429.94 464.29 471.34 814.23 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.54 362.28 427.54 456.18 461.32 839.08 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.22 343.70 426.00 446.01 454.82 861.85 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.98 326.28 425.56 436.50 447.41 882.49 -------------------------------------------------------------------------------- K point *** = 0.234375 0.359375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.13 310.67 424.81 427.98 439.17 901.03 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.33 319.12 421.69 428.68 450.68 893.16 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.98 311.37 411.83 427.78 443.47 907.76 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.02 310.09 400.67 423.24 440.60 920.24 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.24 313.34 389.55 415.68 441.22 930.58 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.40 317.32 379.37 409.65 442.09 938.71 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 235.83 318.19 371.10 408.37 442.06 944.49 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.46 314.06 365.64 412.84 441.11 947.72 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 230.81 306.15 363.71 420.03 440.84 948.17 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.01 297.13 365.63 422.88 446.15 945.59 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.71 289.55 371.27 419.72 457.27 939.84 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.84 285.84 380.08 414.44 469.69 930.81 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.38 288.75 391.27 408.85 481.43 918.50 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.83 299.81 403.73 404.09 491.72 903.00 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.62 317.02 400.11 417.37 500.24 884.44 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.06 337.78 398.08 430.90 506.92 863.01 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.89 360.48 398.12 444.13 512.03 838.91 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.21 383.56 400.50 456.77 516.34 812.40 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.11 402.63 407.59 468.17 521.79 783.74 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.93 410.15 424.34 476.39 532.03 753.25 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.32 417.52 437.24 479.45 550.11 721.37 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.11 425.11 445.04 478.36 574.62 688.78 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.10 432.07 448.19 475.68 600.89 657.70 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.00 437.28 447.23 473.62 607.59 647.84 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.45 438.18 444.73 473.13 580.27 673.07 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.09 432.31 443.96 473.74 549.58 702.98 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.70 423.27 441.99 474.48 521.38 732.70 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.30 411.80 438.24 474.09 498.40 761.27 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.16 397.54 433.51 470.40 483.46 788.25 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.93 381.05 429.14 461.99 476.68 813.39 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.81 363.86 426.15 452.82 471.72 836.51 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.35 347.18 424.83 443.81 465.84 857.54 -------------------------------------------------------------------------------- K point *** = 0.234375 0.390625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.85 331.83 424.72 434.73 458.69 876.42 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.76 338.42 419.12 433.18 478.04 866.75 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.35 329.86 410.78 432.23 470.17 881.50 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.72 327.74 399.44 434.04 461.78 894.00 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.59 331.62 387.85 434.69 454.64 904.26 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.61 338.41 377.29 431.76 451.36 912.25 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.34 344.15 368.79 427.76 451.00 917.95 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.85 345.03 363.23 427.42 451.20 921.27 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.69 339.92 361.25 431.09 452.20 922.09 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.02 331.04 363.10 433.50 457.19 920.27 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.47 321.57 368.65 431.43 467.12 915.67 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.12 314.33 377.33 426.89 478.81 908.19 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.36 312.09 388.27 421.69 490.16 897.78 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.62 317.02 400.11 417.37 500.24 884.44 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.50 328.55 407.78 418.99 508.61 868.22 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.89 344.22 407.55 430.21 515.14 849.22 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.52 362.14 407.65 442.77 519.98 827.60 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.80 381.10 409.87 454.65 523.69 803.53 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.65 400.01 414.43 465.08 527.52 777.25 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.01 417.42 421.06 472.89 533.83 749.02 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.17 428.87 431.98 476.56 545.61 719.18 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.70 437.31 442.33 475.84 564.03 688.19 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.21 444.68 449.15 472.25 587.46 656.86 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.20 447.76 454.74 468.20 609.13 630.52 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 375.04 445.75 457.28 467.60 589.86 647.51 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.26 440.35 454.93 471.17 561.27 676.23 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 367.74 432.87 450.33 474.46 535.74 705.26 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.86 423.47 443.95 475.39 516.06 733.50 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.31 411.59 436.62 472.65 504.00 760.45 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.09 397.30 430.04 466.49 497.93 785.75 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.53 381.72 425.35 458.53 494.05 809.17 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.18 366.05 422.77 449.59 489.94 830.54 -------------------------------------------------------------------------------- K point *** = 0.234375 0.421875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.21 351.20 421.64 440.30 484.68 849.75 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.78 355.18 415.04 438.20 508.33 838.47 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.15 345.96 408.80 434.93 501.41 853.38 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.91 342.62 398.36 436.71 492.99 865.91 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.82 345.96 386.82 440.30 483.52 876.09 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.02 353.89 376.12 443.59 474.02 883.94 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.27 363.00 367.56 444.97 466.47 889.49 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.83 361.85 369.64 444.24 462.94 892.79 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.38 359.89 370.00 444.24 463.11 893.82 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.11 361.69 363.93 444.94 467.19 892.54 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.74 354.13 367.38 443.35 475.66 888.90 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.45 344.55 375.98 439.55 486.36 882.81 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.80 338.18 386.68 434.89 497.15 874.20 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.06 337.78 398.08 430.90 506.92 863.01 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.89 344.22 407.55 430.21 515.14 849.22 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.25 355.65 411.78 436.17 521.59 832.87 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.97 369.71 413.22 446.27 526.38 814.03 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.49 384.90 415.61 456.59 529.90 792.82 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.11 400.32 420.21 465.39 533.05 769.43 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.63 415.12 427.24 471.57 537.31 744.09 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.83 427.87 436.65 474.29 544.66 717.13 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.69 437.78 447.06 473.52 556.79 688.96 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.37 445.66 455.31 470.43 574.20 660.15 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 382.90 451.33 459.07 467.82 596.00 631.64 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 385.23 451.63 460.53 467.73 602.35 622.86 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 382.74 446.89 461.25 468.86 577.72 649.30 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 375.79 440.53 456.74 471.71 556.56 676.97 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.40 432.71 448.23 473.89 540.76 704.48 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.73 422.83 438.19 473.71 530.52 731.13 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.95 410.45 429.42 470.44 524.56 756.45 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.38 396.43 423.11 464.26 520.87 780.06 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.42 381.92 419.26 455.90 517.63 801.72 -------------------------------------------------------------------------------- K point *** = 0.234375 0.453125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.15 367.79 417.24 446.47 513.66 821.23 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.36 369.03 409.74 443.99 540.30 808.75 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.31 359.31 405.63 438.33 534.34 823.78 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.32 354.62 397.22 438.39 526.62 836.34 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.41 356.65 386.53 442.24 517.22 846.42 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.03 364.17 376.26 447.41 506.52 854.09 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.99 366.93 375.51 452.37 495.30 859.45 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.76 361.69 385.41 456.19 485.09 862.61 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.20 359.84 391.77 458.23 478.46 863.69 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.59 361.83 391.39 458.15 478.14 862.77 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.74 367.38 384.63 456.04 483.92 859.87 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.95 373.31 377.46 452.41 492.95 854.97 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.95 365.27 387.03 448.03 502.79 848.01 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.89 360.48 398.12 444.13 512.03 838.91 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.52 362.14 407.65 442.77 519.98 827.60 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.97 369.71 413.22 446.27 526.38 814.03 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.81 380.77 415.55 453.88 531.26 798.21 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.67 393.31 417.74 462.36 534.95 780.21 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.80 406.10 421.73 469.37 538.12 760.17 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.49 418.26 428.39 473.63 541.68 738.31 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.49 428.50 438.31 474.58 546.65 714.96 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.36 436.41 450.41 472.49 554.04 690.57 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 378.62 442.65 461.43 468.69 564.87 665.78 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 387.48 447.78 462.06 470.99 580.11 641.44 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 390.95 452.86 457.22 473.63 599.87 618.64 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 388.10 452.25 458.70 470.92 598.54 623.19 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 380.02 446.62 461.12 467.03 582.11 648.62 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.61 439.78 450.63 471.54 569.64 674.85 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.38 431.52 437.98 474.43 560.80 700.89 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.57 421.03 426.94 473.92 554.90 726.01 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.39 408.22 419.32 469.70 551.02 749.70 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.09 394.76 414.38 462.36 547.99 771.55 -------------------------------------------------------------------------------- K point *** = 0.234375 0.484375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.65 381.39 411.65 453.11 544.69 791.30 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.45 380.15 403.38 450.12 572.62 778.47 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.79 369.92 401.18 442.60 567.58 793.49 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.74 363.87 395.65 440.21 560.77 805.96 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.97 364.11 386.92 443.08 552.07 815.85 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.11 369.76 378.37 448.80 541.59 823.26 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.87 367.91 382.64 455.36 529.71 828.31 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.99 363.00 393.87 461.51 517.19 831.20 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.49 361.37 403.80 466.48 505.47 832.15 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.78 363.52 409.33 469.45 497.17 831.35 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.77 369.28 408.29 468.97 495.70 828.95 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.85 377.94 401.46 465.48 500.63 825.01 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.92 387.37 393.32 460.96 508.29 819.52 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.21 383.56 400.50 456.77 516.34 812.40 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.80 381.10 409.87 454.65 523.69 803.53 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.49 384.90 415.61 456.59 529.90 792.82 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.67 393.31 417.74 462.36 534.95 780.21 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.01 403.90 418.89 469.16 539.11 765.72 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.88 415.02 421.33 474.49 542.82 749.44 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.38 424.98 426.87 477.02 546.56 731.59 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.75 431.86 437.03 476.46 550.59 712.54 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.64 438.32 448.12 473.35 555.12 692.81 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.31 443.02 459.56 468.90 560.71 673.09 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 384.44 445.71 464.59 469.05 568.82 654.27 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 390.04 448.27 461.14 473.36 581.33 637.29 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 388.10 452.25 458.70 470.92 598.54 623.19 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 380.02 450.42 460.83 464.85 607.65 623.84 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.49 443.32 451.31 470.38 599.22 646.67 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.41 433.30 440.44 475.31 591.78 671.39 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.07 422.66 429.59 476.87 586.18 695.91 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.62 413.69 418.11 474.46 582.19 719.36 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.20 404.71 408.66 468.35 579.18 741.18 -------------------------------------------------------------------------------- K point *** = 0.234375 0.515625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.70 392.30 405.03 459.64 576.28 760.97 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.02 388.85 396.22 456.00 602.63 749.85 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.52 378.00 395.72 447.32 598.86 764.32 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.07 370.56 393.36 442.52 593.36 776.26 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.18 368.83 387.74 443.47 585.88 785.63 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.77 372.21 381.75 448.82 576.39 792.47 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.33 370.26 386.37 456.16 565.08 796.94 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.86 366.05 397.61 463.69 552.39 799.28 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.59 364.72 409.01 470.28 539.15 799.81 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.05 367.04 418.05 475.11 526.84 798.82 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.20 372.94 422.49 477.37 517.84 796.60 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.51 381.83 420.96 476.30 514.60 793.32 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.00 392.61 414.47 472.58 516.80 789.05 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.11 402.63 407.59 468.17 521.79 783.74 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.65 400.01 414.43 465.08 527.52 777.25 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.11 400.32 420.21 465.39 533.05 769.43 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.80 406.10 421.73 469.37 538.12 760.17 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.88 415.02 421.33 474.49 542.82 749.44 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.77 421.58 424.96 478.13 547.32 737.31 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.56 423.92 434.56 479.07 551.57 724.02 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.20 428.85 443.01 477.29 555.25 709.96 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.80 435.86 449.82 473.67 558.00 695.69 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.75 442.54 455.41 469.91 559.95 681.89 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.74 444.74 461.75 467.51 562.28 669.24 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 382.44 444.55 465.33 467.24 567.46 658.25 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 382.74 446.89 461.25 468.86 577.72 649.30 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.07 450.01 453.87 469.03 592.29 643.12 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.39 441.22 450.63 472.08 606.11 642.77 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.07 428.69 444.77 476.71 611.60 653.80 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.61 416.94 436.06 479.29 610.81 672.82 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.16 407.43 425.48 478.24 608.81 693.73 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.76 400.90 413.64 473.38 606.97 714.13 -------------------------------------------------------------------------------- K point *** = 0.234375 0.546875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.27 397.38 401.17 465.46 605.12 733.01 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.94 388.24 395.79 461.09 623.22 729.65 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.40 383.12 390.33 451.91 622.73 741.43 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.18 374.84 390.48 445.25 620.07 751.25 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.80 371.39 388.44 443.80 615.08 758.84 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.66 373.54 384.81 447.88 607.74 764.14 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.96 373.89 387.71 455.29 598.18 767.23 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.93 370.90 398.21 463.70 586.71 768.35 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.07 369.96 410.07 471.44 573.90 767.82 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.97 372.38 420.87 477.38 560.65 766.07 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.61 378.31 428.82 480.82 548.33 763.50 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.50 387.30 432.26 481.52 538.71 760.42 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.73 398.40 430.32 479.78 533.25 757.01 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.93 410.15 424.34 476.39 532.03 753.25 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.01 417.42 421.06 472.89 533.83 749.02 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.63 415.12 427.24 471.57 537.31 744.09 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.49 418.26 428.39 473.63 541.68 738.31 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.38 424.98 426.87 477.02 546.56 731.59 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.56 423.92 434.56 479.07 551.57 724.02 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.07 423.40 443.24 478.69 556.07 715.83 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.71 425.43 450.40 476.19 559.25 707.44 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.26 430.10 454.43 473.13 560.50 699.34 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.61 436.53 453.83 471.78 559.82 691.99 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.71 441.15 452.46 471.54 558.22 685.65 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 370.48 440.07 455.70 470.76 557.85 680.40 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.26 440.35 454.93 471.17 561.27 676.23 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.89 444.00 447.00 473.18 569.62 673.31 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.78 435.15 447.21 475.54 581.55 672.24 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.66 422.28 445.86 478.70 594.30 674.07 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.32 410.19 439.94 481.17 605.28 679.94 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.01 400.24 430.91 480.92 613.26 689.94 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.73 393.26 419.91 477.12 618.55 702.73 -------------------------------------------------------------------------------- K point *** = 0.234375 0.578125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.25 389.47 407.82 470.12 621.79 716.45 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.97 380.47 400.60 464.95 620.77 731.31 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.20 380.84 390.20 455.82 627.03 736.75 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.87 376.55 387.69 448.03 630.54 741.03 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.67 372.44 388.43 444.28 631.09 743.81 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.64 374.06 387.21 446.35 628.62 744.92 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.66 378.01 387.64 453.09 623.25 744.38 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.16 377.24 396.49 461.88 615.24 742.33 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.86 376.80 408.32 470.49 605.04 739.11 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.44 379.23 419.99 477.39 593.28 735.18 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.88 385.03 430.02 481.58 580.81 731.06 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.64 393.97 437.01 482.82 568.68 727.23 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.87 405.23 439.58 481.76 558.07 723.99 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.32 417.52 437.24 479.45 550.11 721.37 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.17 428.87 431.98 476.56 545.61 719.18 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.83 427.87 436.65 474.29 544.66 717.13 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.49 428.50 438.31 474.58 546.65 714.96 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.75 431.86 437.03 476.46 550.59 712.54 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.20 428.85 443.01 477.29 555.25 709.96 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.71 425.43 450.40 476.19 559.25 707.44 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.91 424.22 455.45 474.22 561.43 705.30 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.34 425.73 455.17 473.95 561.17 703.81 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.58 429.68 449.93 475.24 558.61 703.00 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.18 434.45 443.72 475.60 554.73 702.72 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.56 434.03 443.32 474.47 551.11 702.77 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.09 432.31 443.96 473.74 549.58 702.98 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.24 434.90 438.35 475.38 551.54 703.42 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.10 427.48 439.97 478.00 557.49 704.33 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.42 415.04 442.52 480.48 566.76 706.12 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.30 402.97 440.35 482.36 578.03 709.14 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.14 392.78 433.77 482.36 590.00 713.53 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.95 385.46 424.11 479.36 601.65 719.06 -------------------------------------------------------------------------------- K point *** = 0.234375 0.609375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.45 381.44 412.64 473.29 612.13 725.21 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.76 373.23 403.51 467.25 596.42 753.66 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.58 375.03 392.14 458.62 607.50 754.53 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.91 375.68 385.67 450.42 616.57 753.77 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.66 372.37 387.41 444.93 623.22 751.11 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.76 373.34 389.09 444.61 627.23 746.46 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.67 379.68 388.72 449.91 628.53 739.90 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.86 384.26 392.99 458.52 627.14 731.70 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.27 384.60 404.38 467.74 623.23 722.39 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.70 386.98 416.50 475.53 616.97 712.72 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.13 392.52 427.74 480.55 608.57 703.69 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.97 401.23 437.06 482.22 598.28 696.33 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.34 412.48 443.28 480.97 586.61 691.33 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.11 425.11 445.04 478.36 574.62 688.78 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.70 437.31 442.33 475.84 564.03 688.19 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.69 437.78 447.06 473.52 556.79 688.96 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.36 436.41 450.41 472.49 554.04 690.57 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.64 438.32 448.12 473.35 555.12 692.81 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.80 435.86 449.82 473.67 558.00 695.69 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.26 430.10 454.43 473.13 560.50 699.34 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.34 425.73 455.17 473.95 561.17 703.81 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.29 423.94 450.61 476.51 559.50 708.93 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.45 424.82 443.14 478.33 555.83 714.35 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.14 427.58 434.88 478.05 551.03 719.68 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.52 426.29 432.02 475.83 546.13 724.57 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.49 422.10 432.99 473.60 542.01 728.87 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.74 423.01 428.84 474.02 539.40 732.58 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.68 419.50 428.37 476.92 539.07 735.89 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.50 407.75 434.04 480.07 541.98 739.00 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.55 395.92 436.18 482.12 548.67 742.15 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.42 385.68 433.19 482.30 558.73 745.41 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.18 378.17 425.74 479.90 570.97 748.65 -------------------------------------------------------------------------------- K point *** = 0.234375 0.640625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.53 374.00 415.33 474.71 583.94 751.54 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.89 367.27 404.17 467.71 563.34 783.79 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.18 369.92 392.46 459.95 576.20 782.85 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.07 373.46 383.71 452.00 587.71 779.98 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.75 371.27 385.49 445.55 597.37 774.90 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.18 370.88 390.43 442.99 604.94 767.41 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.31 376.50 392.70 446.17 610.37 757.42 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.42 386.33 392.76 453.97 613.81 745.00 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.69 392.67 398.52 463.43 615.60 730.34 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.07 394.95 410.90 472.02 616.17 713.86 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.56 400.13 422.89 478.03 615.87 696.32 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.55 408.44 433.67 480.48 614.43 679.19 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.09 419.44 442.47 479.29 610.22 665.20 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.10 432.07 448.19 475.68 600.89 657.70 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.21 444.68 449.15 472.25 587.46 656.86 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.37 445.66 455.31 470.43 574.20 660.15 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 378.62 442.65 461.43 468.69 564.87 665.78 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.31 443.02 459.56 468.90 560.71 673.09 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.75 442.54 455.41 469.91 559.95 681.89 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.61 436.53 453.83 471.78 559.82 691.99 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.58 429.68 449.93 475.24 558.61 703.00 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.45 424.82 443.14 478.33 555.83 714.35 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.23 422.61 434.53 479.42 551.79 725.48 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.04 422.72 425.15 477.84 547.10 735.87 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.94 416.08 424.19 474.07 542.22 745.22 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.68 409.48 424.56 470.04 537.35 753.37 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.99 407.73 421.04 468.66 532.52 760.31 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.76 410.47 414.09 470.91 527.97 766.14 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.01 401.12 419.75 474.94 524.57 771.04 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.06 389.70 425.99 478.53 524.06 775.17 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.72 379.58 427.74 479.94 528.36 778.62 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.18 372.03 423.81 478.39 537.65 781.35 -------------------------------------------------------------------------------- K point *** = 0.234375 0.671875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.14 367.84 415.32 474.13 550.00 783.17 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.22 363.10 401.88 466.02 528.19 815.85 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.86 366.31 390.39 459.53 541.15 814.16 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.31 371.38 380.51 452.41 553.50 810.45 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.04 368.70 383.25 445.84 564.45 804.47 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.09 366.32 391.25 441.68 573.60 796.04 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.83 370.27 397.04 442.39 580.80 785.04 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.15 379.21 399.36 448.66 586.13 771.45 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.41 390.75 400.44 457.91 589.92 755.33 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.77 401.84 404.14 467.11 592.72 736.84 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.32 407.20 416.03 474.18 595.29 716.26 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.40 415.02 427.69 477.82 598.42 694.02 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.99 425.45 438.18 477.49 602.62 670.77 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.00 437.28 447.23 473.62 607.59 647.84 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.20 447.76 454.74 468.20 609.13 630.52 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 382.90 451.33 459.07 467.82 596.00 631.64 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 387.48 447.78 462.06 470.99 580.11 641.44 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 384.44 445.71 464.59 469.05 568.82 654.27 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.74 444.74 461.75 467.51 562.28 669.24 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.71 441.15 452.46 471.54 558.22 685.65 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.18 434.45 443.72 475.60 554.73 702.72 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.14 427.58 434.88 478.05 551.03 719.68 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.04 422.72 425.15 477.84 547.10 735.87 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.70 414.71 420.33 474.65 543.06 750.85 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.09 404.41 419.65 469.18 538.83 764.32 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.98 395.70 418.89 463.37 534.10 776.12 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.80 390.87 415.29 460.13 528.57 786.22 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.70 391.97 407.53 461.05 522.17 794.68 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.14 394.81 400.75 464.81 515.24 801.59 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.94 384.83 408.41 469.39 508.80 807.10 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.08 374.97 415.10 473.10 505.08 811.30 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.89 367.55 416.40 473.86 507.36 814.22 -------------------------------------------------------------------------------- K point *** = 0.234375 0.703125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.17 363.45 411.42 471.09 516.08 815.79 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.01 360.80 395.14 461.47 495.12 847.79 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.89 364.36 385.02 456.92 506.21 845.76 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.91 369.82 375.34 451.29 518.14 841.65 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.78 363.66 381.59 445.40 529.46 835.27 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.67 359.32 391.75 440.59 539.40 826.50 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.40 361.53 400.55 439.08 547.61 815.23 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.23 369.51 405.50 443.14 553.99 801.43 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.59 380.86 407.54 451.62 558.70 785.14 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.94 393.63 409.72 461.13 562.17 766.45 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.46 406.66 413.94 469.19 565.12 745.56 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.48 419.38 420.73 474.30 568.50 722.75 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.87 429.38 431.92 475.63 573.31 698.41 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.45 438.18 444.73 473.13 580.27 673.07 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 375.04 445.75 457.28 467.60 589.86 647.51 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 385.23 451.63 460.53 467.73 602.35 622.86 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 390.95 452.86 457.22 473.63 599.87 618.64 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 390.04 448.27 461.14 473.36 581.33 637.29 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 382.44 444.55 465.33 467.24 567.46 658.25 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 370.48 440.07 455.70 470.76 557.85 680.40 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.56 434.03 443.32 474.47 551.11 702.77 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.52 426.29 432.02 475.83 546.13 724.57 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.94 416.08 424.19 474.07 542.22 745.22 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.09 404.41 419.65 469.18 538.83 764.32 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.71 392.59 417.29 462.06 535.27 781.59 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.62 381.74 415.60 454.54 530.90 796.86 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.32 373.72 411.87 449.57 525.27 810.05 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.15 370.99 404.08 449.26 518.22 821.15 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.27 374.69 393.58 452.39 509.91 830.23 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.50 380.40 385.32 456.78 500.87 837.37 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.77 372.08 393.55 460.98 492.32 842.65 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.59 364.88 400.41 463.96 486.67 846.15 -------------------------------------------------------------------------------- K point *** = 0.234375 0.734375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.87 360.95 401.14 464.21 487.48 847.88 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.82 360.17 381.23 451.57 470.25 878.69 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.83 363.92 374.72 450.71 475.49 876.54 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.34 364.49 371.49 447.93 484.54 872.19 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.31 355.23 381.10 443.74 494.94 865.59 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.09 349.54 392.24 439.34 505.02 856.64 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.09 350.15 403.01 436.49 513.90 845.31 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.72 357.20 410.56 438.02 521.17 831.54 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.31 368.46 413.70 445.12 526.77 815.37 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.62 381.74 415.60 454.54 530.90 796.86 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.98 395.70 418.89 463.37 534.10 776.12 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.68 409.48 424.56 470.04 537.35 753.37 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.49 422.10 432.99 473.60 542.01 728.87 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.09 432.31 443.96 473.74 549.58 702.98 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.26 440.35 454.93 471.17 561.27 676.23 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 382.74 446.89 461.25 468.86 577.72 649.30 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 388.10 452.25 458.70 470.92 598.54 623.19 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 388.10 452.25 458.70 470.92 598.54 623.19 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 382.74 446.89 461.25 468.86 577.72 649.30 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.26 440.35 454.93 471.17 561.27 676.23 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.09 432.31 443.96 473.74 549.58 702.98 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.49 422.10 432.99 473.60 542.01 728.87 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.68 409.48 424.56 470.04 537.35 753.37 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.98 395.70 418.89 463.37 534.10 776.12 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.62 381.74 415.60 454.54 530.90 796.86 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.31 368.46 413.70 445.12 526.77 815.37 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.72 357.20 410.56 438.02 521.17 831.54 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.09 350.15 403.01 436.49 513.90 845.31 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.09 349.54 392.24 439.34 505.02 856.64 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.31 355.23 381.10 443.74 494.94 865.59 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.34 364.49 371.49 447.93 484.54 872.19 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.83 363.92 374.72 450.71 475.49 876.54 -------------------------------------------------------------------------------- K point *** = 0.234375 0.765625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.82 360.17 381.23 451.57 470.25 878.69 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.35 357.87 360.94 436.18 456.77 908.04 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.31 357.19 364.78 436.28 456.54 905.90 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.18 350.93 371.96 438.74 458.32 901.41 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.09 342.79 381.71 439.25 463.94 894.63 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.61 336.72 393.03 437.09 472.40 885.56 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.97 336.02 404.62 434.34 481.31 874.20 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.67 342.06 414.29 433.78 489.38 860.53 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.60 353.19 418.80 438.96 496.07 844.55 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.82 366.99 420.28 447.99 501.28 826.30 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.83 381.91 422.54 457.19 505.23 805.84 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.91 396.96 426.89 465.21 508.67 783.29 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.69 411.15 433.57 471.25 513.18 758.83 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.70 423.27 441.99 474.48 521.38 732.70 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 367.74 432.87 450.33 474.46 535.74 705.26 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 375.79 440.53 456.74 471.71 556.56 676.97 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 380.02 446.62 461.12 467.03 582.11 648.62 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 380.02 450.42 460.83 464.85 607.65 623.84 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.07 450.01 453.87 469.03 592.29 643.12 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.89 444.00 447.00 473.18 569.62 673.31 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.24 434.90 438.35 475.38 551.54 703.42 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.74 423.01 428.84 474.02 539.40 732.58 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.99 407.73 421.04 468.66 532.52 760.31 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.80 390.87 415.29 460.13 528.57 786.22 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.32 373.72 411.87 449.57 525.27 810.05 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.72 357.20 410.56 438.02 521.17 831.54 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.63 342.34 409.79 427.38 515.57 850.54 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.52 330.81 404.09 423.24 508.17 866.91 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.47 325.06 393.08 425.99 499.02 880.55 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.12 326.41 381.65 430.75 488.41 891.42 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.46 333.30 371.80 435.46 477.06 899.55 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.26 342.90 364.62 438.62 466.46 904.96 -------------------------------------------------------------------------------- K point *** = 0.234375 0.796875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.69 352.21 360.87 438.51 459.30 907.76 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.24 327.13 362.86 422.50 446.16 935.44 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.98 331.73 366.67 418.10 446.33 933.44 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.02 330.77 373.73 418.82 446.23 928.90 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.62 325.79 383.24 423.96 445.72 921.98 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.57 320.64 394.27 429.46 446.69 912.79 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.18 319.23 405.82 431.02 451.97 901.40 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.11 324.22 416.57 430.36 459.84 887.81 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.49 335.02 422.73 433.44 467.68 872.04 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.52 349.19 423.59 442.02 474.48 854.08 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.97 364.98 424.72 451.21 479.98 833.95 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.08 381.40 427.58 460.05 484.42 811.69 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.35 397.47 432.31 468.34 489.17 787.41 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.30 411.80 438.24 474.09 498.40 761.27 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.86 423.47 443.95 475.39 516.06 733.50 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.40 432.71 448.23 473.89 540.76 704.48 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.61 439.78 450.63 471.54 569.64 674.85 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.49 443.32 451.31 470.38 599.22 646.67 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.39 441.22 450.63 472.08 606.11 642.77 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.78 435.15 447.21 475.54 581.55 672.24 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.10 427.48 439.97 478.00 557.49 704.33 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.68 419.50 428.37 476.92 539.07 735.89 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.76 410.47 414.09 470.91 527.97 766.14 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.70 391.97 407.53 461.05 522.17 794.68 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.15 370.99 404.08 449.26 518.22 821.15 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.09 350.15 403.01 436.49 513.90 845.31 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.52 330.81 404.09 423.24 508.17 866.91 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.89 314.34 405.75 411.18 500.66 885.75 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.23 302.95 395.73 412.65 491.32 901.68 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.79 298.98 383.87 417.88 480.37 914.58 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.94 302.01 373.84 423.23 468.40 924.37 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.60 309.47 366.58 427.33 456.70 931.06 -------------------------------------------------------------------------------- K point *** = 0.234375 0.828125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 239.15 318.74 362.81 427.54 448.40 934.70 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.15 293.42 365.76 410.66 434.94 960.57 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.48 300.88 369.46 402.41 436.87 958.87 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.50 304.67 376.31 398.43 438.32 954.37 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.51 304.09 385.40 400.54 438.52 947.35 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.47 301.33 395.69 407.56 437.59 938.05 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.92 300.21 406.34 416.74 436.28 926.62 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.12 304.31 416.76 424.27 437.04 913.12 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.01 314.59 425.48 427.27 443.34 897.56 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.75 328.89 425.42 436.24 451.62 879.90 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.40 345.28 425.58 445.25 459.15 860.13 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.17 362.88 427.08 454.49 465.41 838.22 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.53 380.81 429.94 464.29 471.34 814.23 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.16 397.54 433.51 470.40 483.46 788.25 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.31 411.59 436.62 472.65 504.00 760.45 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.73 422.83 438.19 473.71 530.52 731.13 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.38 431.52 437.98 474.43 560.80 700.89 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.41 433.30 440.44 475.31 591.78 671.39 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.07 428.69 444.77 476.71 611.60 653.80 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.66 422.28 445.86 478.70 594.30 674.07 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.42 415.04 442.52 480.48 566.76 706.12 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.50 407.75 434.04 480.07 541.98 739.00 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.01 401.12 419.75 474.94 524.57 771.04 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.14 394.81 400.75 464.81 515.24 801.59 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.27 374.69 393.58 452.39 509.91 830.23 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.09 349.54 392.24 439.34 505.02 856.64 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.47 325.06 393.08 425.99 499.02 880.55 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.23 302.95 395.73 412.65 491.32 901.68 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.39 285.08 397.82 401.74 481.79 919.82 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.09 274.59 387.11 405.70 470.59 934.76 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 239.61 272.83 377.05 411.30 458.16 946.34 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 230.59 277.07 369.69 416.24 445.59 954.47 -------------------------------------------------------------------------------- K point *** = 0.234375 0.859375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.88 284.68 365.81 417.37 436.25 959.18 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 208.74 259.98 369.48 399.01 422.92 983.11 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.49 268.22 372.92 388.18 426.77 981.91 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.32 275.02 377.83 382.24 430.11 977.58 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.46 278.64 377.51 389.39 432.16 970.55 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.95 279.32 381.53 399.41 432.77 961.17 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.61 279.71 389.83 409.84 432.18 949.71 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.81 283.46 400.38 419.84 430.93 936.29 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.26 293.15 411.64 427.05 431.57 920.94 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.58 307.44 422.27 427.65 438.83 903.60 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.18 324.24 425.52 435.09 446.22 884.21 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.31 342.79 426.19 446.08 452.94 862.71 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.54 362.28 427.54 456.18 461.32 839.08 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.93 381.05 429.14 461.99 476.68 813.39 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.09 397.30 430.04 466.49 497.93 785.75 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.95 410.45 429.42 470.44 524.56 756.45 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.57 421.03 426.94 473.92 554.90 726.01 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.07 422.66 429.59 476.87 586.18 695.91 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.61 416.94 436.06 479.29 610.81 672.82 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.32 410.19 439.94 481.17 605.28 679.94 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.30 402.97 440.35 482.36 578.03 709.14 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.55 395.92 436.18 482.12 548.67 742.15 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.06 389.70 425.99 478.53 524.06 775.17 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.94 384.83 408.41 469.39 508.80 807.10 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.50 380.40 385.32 456.78 500.87 837.37 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.31 355.23 381.10 443.74 494.94 865.59 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.12 326.41 381.65 430.75 488.41 891.42 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.79 298.98 383.87 417.88 480.37 914.58 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.09 274.59 387.11 405.70 470.59 934.76 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.55 255.61 388.00 397.88 459.12 951.69 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 230.34 247.24 380.76 400.55 446.31 965.11 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 219.02 247.59 373.68 405.54 433.02 974.86 -------------------------------------------------------------------------------- K point *** = 0.234375 0.890625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.56 252.46 369.69 407.38 422.77 980.83 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 195.72 229.02 373.85 386.61 410.84 1002.69 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.77 236.48 372.70 378.23 416.23 1002.24 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 202.28 244.54 363.01 384.20 421.19 998.31 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.31 251.27 357.78 392.68 425.06 991.40 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.87 255.62 358.81 402.09 427.56 982.03 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 235.97 258.61 365.70 411.47 428.68 970.59 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.43 263.02 376.65 420.20 428.66 957.29 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.38 272.26 389.80 427.46 428.45 942.17 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.15 286.60 403.92 426.96 434.79 925.15 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.56 303.75 418.19 426.58 440.63 906.15 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.95 323.08 425.47 433.79 446.21 885.06 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.22 343.70 426.00 446.01 454.82 861.85 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.81 363.86 426.15 452.82 471.72 836.51 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.53 381.72 425.35 458.53 494.05 809.17 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.38 396.43 423.11 464.26 520.87 780.06 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.39 408.22 419.32 469.70 551.02 749.70 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.62 413.69 418.11 474.46 582.19 719.36 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.16 407.43 425.48 478.24 608.81 693.73 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.01 400.24 430.91 480.92 613.26 689.94 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.14 392.78 433.77 482.36 590.00 713.53 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.42 385.68 433.19 482.30 558.73 745.41 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.72 379.58 427.74 479.94 528.36 778.62 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.08 374.97 415.10 473.10 505.08 811.30 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.77 372.08 393.55 460.98 492.32 842.65 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.34 364.49 371.49 447.93 484.54 872.19 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.46 333.30 371.80 435.46 477.06 899.55 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.94 302.01 373.84 423.23 468.40 924.37 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 239.61 272.83 377.05 411.30 458.16 946.34 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 230.34 247.24 380.76 400.55 446.31 965.11 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.90 227.47 382.19 394.29 433.09 980.37 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.69 222.56 378.01 396.24 419.14 991.83 -------------------------------------------------------------------------------- K point *** = 0.234375 0.921875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.90 223.97 374.29 397.60 408.40 999.28 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 184.84 202.48 372.66 378.98 399.98 1018.93 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.14 207.67 358.40 382.11 406.02 1019.55 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 190.30 215.42 346.59 388.36 411.91 1016.30 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.04 223.93 339.11 396.50 417.18 1009.76 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.23 231.50 337.71 405.19 421.42 1000.58 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.98 237.72 343.01 413.42 424.41 989.27 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.55 244.07 353.84 420.67 426.10 976.15 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.58 253.39 368.29 426.75 426.76 961.28 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.76 267.88 384.75 426.78 431.73 944.60 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.17 285.25 402.22 426.64 435.86 925.98 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.15 305.05 419.70 426.95 439.88 905.31 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.98 326.28 425.56 436.50 447.41 882.49 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.35 347.18 424.83 443.81 465.84 857.54 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.18 366.05 422.77 449.59 489.94 830.54 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.42 381.92 419.26 455.90 517.63 801.72 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.09 394.76 414.38 462.36 547.99 771.55 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.20 404.71 408.66 468.35 579.18 741.18 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.76 400.90 413.64 473.38 606.97 714.13 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.73 393.26 419.91 477.12 618.55 702.73 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.95 385.46 424.11 479.36 601.65 719.06 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.18 378.17 425.74 479.90 570.97 748.65 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.18 372.03 423.81 478.39 537.65 781.35 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.89 367.55 416.40 473.86 507.36 814.22 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.59 364.88 400.41 463.96 486.67 846.15 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.83 363.92 374.72 450.71 475.49 876.54 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.26 342.90 364.62 438.62 466.46 904.96 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.60 309.47 366.58 427.33 456.70 931.06 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 230.59 277.07 369.69 416.24 445.59 954.47 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 219.02 247.59 373.68 405.54 433.02 974.86 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.69 222.56 378.01 396.24 419.14 991.83 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 202.68 204.06 380.68 391.06 404.38 1005.02 -------------------------------------------------------------------------------- K point *** = 0.234375 0.953125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 190.62 201.00 379.29 387.46 395.02 1014.11 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 176.74 182.34 357.78 383.96 391.94 1031.39 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 176.28 183.85 342.90 386.16 397.79 1033.43 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 181.30 189.47 330.17 391.89 403.70 1031.26 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.61 198.30 321.33 399.72 409.39 1025.47 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.91 208.26 318.28 407.89 414.63 1016.75 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.60 217.72 322.26 415.06 419.16 1005.78 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.15 226.93 332.83 420.74 422.66 992.95 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.14 237.53 348.21 424.99 425.03 978.39 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.18 251.90 366.51 426.38 428.13 962.05 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.07 269.24 386.46 427.14 430.47 943.79 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.15 289.25 407.17 427.47 432.89 923.48 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.13 310.67 424.81 427.98 439.17 901.03 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.85 331.83 424.72 434.73 458.69 876.42 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.21 351.20 421.64 440.30 484.68 849.75 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.15 367.79 417.24 446.47 513.66 821.23 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.65 381.39 411.65 453.11 544.69 791.30 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.70 392.30 405.03 459.64 576.28 760.97 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.27 397.38 401.17 465.46 605.12 733.01 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.25 389.47 407.82 470.12 621.79 716.45 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.45 381.44 412.64 473.29 612.13 725.21 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.53 374.00 415.33 474.71 583.94 751.54 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.14 367.84 415.32 474.13 550.00 783.17 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.17 363.45 411.42 471.09 516.08 815.79 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.87 360.95 401.14 464.21 487.48 847.88 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.82 360.17 381.23 451.57 470.25 878.69 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.69 352.21 360.87 438.51 459.30 907.76 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 239.15 318.74 362.81 427.54 448.40 934.70 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.88 284.68 365.81 417.37 436.25 959.18 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.56 252.46 369.69 407.38 422.77 980.83 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.90 223.97 374.29 397.60 408.40 999.28 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 190.62 201.00 379.29 387.46 395.02 1014.11 -------------------------------------------------------------------------------- K point *** = 0.234375 0.984375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 183.72 185.82 373.25 384.20 388.27 1024.92 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.76 193.08 382.33 386.80 389.59 1017.15 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.99 192.32 372.66 383.14 393.40 1021.83 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 188.28 195.81 358.07 387.15 399.61 1022.19 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.49 203.26 345.73 394.22 405.82 1018.62 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 203.07 213.01 337.46 402.69 411.78 1011.76 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.37 222.75 335.09 410.96 417.22 1002.31 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.83 231.35 339.58 417.99 421.85 990.83 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.95 239.70 350.13 423.53 425.37 977.65 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.28 249.72 364.85 427.75 427.75 962.84 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.79 263.51 381.95 429.25 430.92 946.29 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.89 280.67 400.25 430.19 433.52 927.85 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.06 300.78 418.79 430.53 436.80 907.36 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.05 322.43 429.31 434.07 445.91 884.74 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.73 343.83 427.38 441.12 465.86 859.97 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.03 363.31 423.98 447.62 490.43 833.12 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.91 379.84 419.29 454.63 518.27 804.40 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.37 393.34 413.43 461.67 548.64 774.30 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.42 404.16 406.60 468.11 579.82 743.92 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.04 398.74 412.98 473.47 607.72 716.73 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.17 390.51 419.65 477.43 619.84 704.74 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.62 382.25 424.15 479.79 603.45 720.47 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.10 374.60 426.01 480.38 572.78 749.94 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.31 368.23 424.28 478.87 539.21 782.72 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.14 363.63 417.05 474.27 508.54 815.75 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.87 360.95 401.14 464.21 487.48 847.88 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.06 360.05 375.21 450.75 476.13 878.50 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.37 342.98 360.73 438.52 467.03 907.16 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.50 308.93 362.73 427.12 457.23 933.50 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.14 275.88 365.87 415.93 446.07 957.14 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 214.98 245.84 369.96 405.12 433.43 977.72 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 204.73 220.55 374.80 395.46 419.44 994.84 -------------------------------------------------------------------------------- K point *** = 0.265625 0.015625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.00 201.69 379.99 388.24 404.41 1008.10 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.99 192.32 372.66 383.14 393.40 1021.83 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 176.60 191.72 357.85 380.63 398.11 1028.42 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 174.05 195.16 343.39 381.84 403.82 1030.69 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 177.41 201.74 331.22 386.61 409.46 1028.86 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.26 209.85 323.20 393.89 414.56 1023.42 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.26 217.70 321.19 402.22 418.73 1015.03 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.30 224.51 326.10 410.41 421.69 1004.26 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.56 231.33 337.05 417.72 423.36 991.51 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.58 240.85 352.16 423.73 424.06 976.92 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.96 256.27 369.75 423.70 428.90 960.46 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.79 274.26 388.77 423.21 432.95 942.03 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.57 294.19 408.47 422.92 436.55 921.52 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.42 315.23 421.01 429.07 441.98 898.86 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.92 335.87 420.78 438.39 458.94 874.07 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.91 354.59 419.16 443.33 484.23 847.24 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.31 370.44 416.19 448.64 512.97 818.59 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.10 383.30 411.84 454.53 543.94 788.58 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.28 393.45 406.32 460.47 575.53 758.22 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.84 398.34 402.94 465.85 604.32 730.34 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.70 391.79 408.50 470.19 620.64 714.17 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.70 384.39 412.92 473.14 610.44 723.54 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.54 377.42 415.31 474.43 582.14 750.11 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.96 371.58 415.05 473.79 548.38 781.73 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.89 367.34 410.91 470.76 514.81 814.23 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.59 364.88 400.41 463.96 486.67 846.15 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.62 364.06 380.48 451.49 469.77 876.76 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.63 351.76 364.73 438.57 458.95 905.60 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.30 318.86 366.62 427.67 448.14 932.31 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.35 285.45 369.59 417.56 436.07 956.55 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.54 253.86 373.39 407.66 422.67 978.00 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 204.66 225.83 377.64 398.16 408.39 996.29 -------------------------------------------------------------------------------- K point *** = 0.265625 0.046875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.46 202.98 380.58 389.46 395.53 1011.02 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 188.28 195.81 358.07 387.15 399.61 1022.19 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 174.05 195.16 343.39 381.84 403.82 1030.69 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 166.55 198.19 329.55 379.44 408.75 1035.12 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 165.78 203.74 318.24 380.95 413.29 1035.47 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 171.02 209.96 311.48 385.99 416.91 1032.01 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 181.12 215.15 311.09 393.46 419.31 1025.23 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.79 219.16 317.46 402.04 420.34 1015.63 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.77 223.72 329.21 410.63 420.12 1003.63 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.20 232.71 344.41 417.92 419.54 989.44 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.12 250.38 361.66 416.90 425.72 973.12 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.76 270.80 380.21 415.01 431.61 954.68 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.44 292.14 399.65 413.59 436.69 934.06 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.11 313.44 410.98 421.52 441.80 911.27 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.90 333.47 410.62 437.30 452.99 886.36 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.27 351.04 410.07 443.21 477.06 859.44 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.90 365.50 409.19 446.97 506.29 830.75 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.66 376.88 407.49 450.79 537.95 800.72 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.47 385.56 404.71 454.92 570.23 770.26 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.31 391.56 401.32 459.08 600.17 741.70 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.10 392.24 400.59 462.82 620.12 722.26 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.72 387.71 403.02 465.69 616.15 725.63 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.98 382.42 404.63 467.31 591.12 748.97 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.69 377.72 404.31 467.37 558.33 779.27 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.86 374.20 401.14 465.50 524.07 811.12 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.77 372.08 393.55 460.98 492.32 842.65 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.92 371.38 379.00 451.39 468.85 873.02 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.91 355.87 371.98 436.56 456.10 901.76 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.42 326.41 373.74 423.13 445.90 928.50 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.19 294.53 376.47 411.36 435.06 952.97 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 220.02 263.09 379.83 399.95 423.39 974.89 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 208.80 233.97 381.68 389.88 411.63 993.95 -------------------------------------------------------------------------------- K point *** = 0.265625 0.078125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 200.47 208.62 372.12 389.60 401.66 1009.83 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.49 203.26 345.73 394.22 405.82 1018.62 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 177.41 201.74 331.22 386.61 409.46 1028.86 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 165.78 203.74 318.24 380.95 413.29 1035.47 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 160.58 207.45 308.55 378.77 416.32 1038.26 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 162.05 210.77 304.28 380.55 418.15 1037.23 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 169.71 212.39 306.77 385.85 418.58 1032.58 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.51 213.14 315.36 393.61 417.67 1024.64 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.11 215.34 328.11 402.53 415.70 1013.77 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.69 223.43 343.18 410.29 414.32 1000.23 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.86 243.56 359.48 408.92 421.24 984.19 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.97 267.15 376.52 405.95 429.02 965.77 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.80 291.52 394.03 403.72 435.97 945.03 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.39 315.13 400.27 414.69 442.33 922.04 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.81 336.31 399.20 433.88 450.40 896.90 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.28 353.72 398.69 444.76 469.74 869.77 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.26 366.94 398.79 449.07 498.41 840.91 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.34 376.40 399.25 451.83 530.50 810.72 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.27 382.80 399.64 454.08 563.56 780.02 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.88 386.78 399.64 456.15 594.80 750.75 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.05 388.62 399.24 458.08 618.03 728.57 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.68 388.43 398.66 459.70 620.17 726.31 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.71 386.75 397.73 460.74 599.02 746.14 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.09 384.47 395.74 460.86 567.78 775.08 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.94 382.34 391.85 459.70 533.87 806.27 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.50 380.40 385.32 456.78 500.87 837.37 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.21 371.97 381.44 450.69 472.59 867.40 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.59 353.96 381.72 437.13 455.51 895.87 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.29 329.42 383.20 420.06 446.10 922.44 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.03 301.00 385.51 404.93 437.23 946.85 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.66 271.58 386.39 393.09 427.66 968.90 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.13 243.27 375.00 394.07 417.57 988.37 -------------------------------------------------------------------------------- K point *** = 0.265625 0.109375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 207.23 217.70 360.58 397.27 408.14 1005.03 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 203.07 213.01 337.46 402.69 411.78 1011.76 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.26 209.85 323.20 393.89 414.56 1023.42 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 171.02 209.96 311.48 385.99 416.91 1032.01 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 162.05 210.77 304.28 380.55 418.15 1037.23 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 159.35 210.23 303.47 378.64 418.00 1038.83 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 163.31 208.08 309.27 380.68 416.47 1036.67 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 173.61 206.01 320.01 386.25 413.76 1030.81 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.30 206.26 333.61 394.20 410.38 1021.46 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 206.70 212.75 348.49 401.50 408.55 1008.89 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.75 234.84 363.73 400.18 415.67 993.36 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.28 261.16 378.80 396.68 425.06 975.10 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.96 288.90 390.58 396.93 433.99 954.28 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.87 316.25 389.47 411.68 442.17 931.09 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.07 340.86 387.76 429.58 450.34 905.69 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.78 360.36 386.96 445.42 464.01 878.28 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.33 373.79 387.40 452.59 489.91 849.14 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.19 381.41 389.65 455.96 521.77 818.67 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.93 384.76 393.29 457.68 555.45 787.59 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.24 386.51 396.36 458.35 587.99 757.51 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.95 387.54 398.23 458.31 614.21 732.89 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.97 387.79 398.92 457.85 622.25 725.31 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.32 387.10 398.48 457.12 605.46 741.33 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.06 385.19 397.06 456.11 576.06 768.90 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.31 381.41 395.17 454.65 542.97 799.51 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.27 374.69 393.58 452.39 509.91 830.23 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.24 363.95 392.81 448.58 479.50 859.95 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.63 348.35 392.99 439.86 456.55 888.12 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.00 327.80 394.06 422.00 445.99 914.41 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.04 303.52 395.42 403.90 438.82 938.62 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.63 277.53 385.03 399.83 431.28 960.58 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.74 251.73 368.86 402.92 422.94 980.17 -------------------------------------------------------------------------------- K point *** = 0.265625 0.140625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.00 227.86 352.91 406.03 414.33 997.28 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.37 222.75 335.09 410.96 417.22 1002.31 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.26 217.70 321.19 402.22 418.73 1015.03 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 181.12 215.15 311.09 393.46 419.31 1025.23 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 169.71 212.39 306.77 385.85 418.58 1032.58 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 163.31 208.08 309.27 380.68 416.47 1036.67 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 163.00 202.99 317.67 379.04 413.13 1037.07 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 169.39 199.08 329.94 381.34 408.93 1033.53 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.34 198.11 344.15 386.99 404.50 1026.03 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.86 202.31 358.84 392.96 402.39 1014.78 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 207.46 225.24 372.96 391.83 409.40 1000.07 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 217.51 252.77 383.49 390.96 420.04 982.23 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.96 282.78 382.27 401.40 430.89 961.53 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.85 313.59 379.42 414.18 441.13 938.26 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.31 342.72 377.28 428.43 450.70 912.65 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.56 366.77 376.20 444.44 461.64 884.97 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.89 376.06 383.45 455.86 482.07 855.51 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.70 377.32 393.08 461.12 512.28 824.67 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.45 379.72 398.08 463.55 546.10 793.11 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.76 383.09 400.10 464.11 579.75 762.13 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.48 386.91 400.20 463.22 608.65 735.28 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.64 390.00 399.51 461.23 622.33 722.57 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.39 390.03 399.97 458.50 610.34 734.35 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.83 386.30 401.78 455.42 582.90 760.53 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.05 379.93 403.30 452.30 550.78 790.67 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.15 370.99 404.08 449.26 518.22 821.15 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.23 358.98 404.39 446.00 487.42 850.65 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.49 343.47 404.71 441.06 460.81 878.58 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.30 324.57 405.35 427.59 445.57 904.61 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.22 303.14 404.36 409.68 439.25 928.58 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.06 280.52 386.93 409.46 433.58 950.37 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.86 258.02 368.58 411.79 427.17 969.93 -------------------------------------------------------------------------------- K point *** = 0.265625 0.171875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.27 236.99 351.19 414.19 419.95 987.25 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.83 231.35 339.58 417.99 421.85 990.83 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.30 224.51 326.10 410.41 421.69 1004.26 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.79 219.16 317.46 402.04 420.34 1015.63 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.51 213.14 315.36 393.61 417.67 1024.64 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 173.61 206.01 320.01 386.25 413.76 1030.81 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 169.39 199.08 329.94 381.34 408.93 1033.53 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 171.12 194.18 343.17 379.97 403.60 1032.28 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 179.64 192.74 357.86 382.42 398.45 1026.83 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.65 195.75 372.11 386.66 396.02 1017.21 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 201.75 216.81 380.72 389.49 403.16 1003.68 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.50 243.57 378.25 399.38 415.39 986.60 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.65 274.05 374.43 409.92 428.38 966.33 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.33 306.63 371.14 420.34 440.66 943.22 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.70 339.22 368.77 431.34 451.80 917.60 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.03 367.44 368.61 444.28 462.43 889.77 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.62 367.56 390.27 457.91 477.20 860.06 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.79 369.08 402.75 465.99 503.26 828.87 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.95 372.21 408.48 469.78 536.14 796.78 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.69 376.91 410.08 471.05 570.40 764.89 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.88 382.84 408.94 470.36 601.53 735.92 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.69 389.34 405.84 468.04 620.50 718.24 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.38 395.07 401.76 464.39 613.80 725.15 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.16 392.77 403.44 459.76 588.35 749.84 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.13 384.56 408.14 454.64 557.14 779.67 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.32 373.72 411.87 449.57 525.27 810.05 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.76 360.02 414.29 444.99 494.90 839.45 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.46 343.29 415.60 440.69 467.50 867.25 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.54 323.98 416.20 433.27 446.63 893.12 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.21 303.22 412.93 419.02 438.86 916.90 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.99 282.42 393.84 418.71 434.60 938.53 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.77 262.64 374.39 419.85 430.06 958.02 -------------------------------------------------------------------------------- K point *** = 0.265625 0.203125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.51 244.52 356.08 421.00 424.63 975.43 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.95 239.70 350.13 423.53 425.37 977.65 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.56 231.33 337.05 417.72 423.36 991.51 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.77 223.72 329.21 410.63 420.12 1003.63 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.11 215.34 328.11 402.53 415.70 1013.77 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.30 206.26 333.61 394.20 410.38 1021.46 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.34 198.11 344.15 386.99 404.50 1026.03 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 179.64 192.74 357.86 382.42 398.45 1026.83 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.85 191.27 373.09 381.42 392.73 1023.40 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 192.31 194.81 381.35 389.53 389.61 1015.60 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.72 211.42 378.15 393.99 405.05 1003.57 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.13 235.54 373.47 402.49 419.94 987.63 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 220.80 264.68 369.16 412.46 433.72 968.17 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.01 297.13 365.63 422.88 446.15 945.59 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.02 331.04 363.10 433.50 457.19 920.27 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.11 361.69 363.93 444.94 467.19 892.54 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.59 361.83 391.39 458.15 478.14 862.77 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.78 363.52 409.33 469.45 497.17 831.35 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.05 367.04 418.05 475.11 526.84 798.82 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.97 372.38 420.87 477.38 560.65 766.07 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.44 379.23 419.99 477.39 593.28 735.18 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.70 386.98 416.50 475.53 616.97 712.72 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.07 394.95 410.90 472.02 616.17 713.86 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.77 401.84 404.14 467.11 592.72 736.84 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.94 393.63 409.72 461.13 562.17 766.45 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.62 381.74 415.60 454.54 530.90 796.86 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.82 366.99 420.28 447.99 501.28 826.30 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.52 349.19 423.59 442.02 474.48 854.08 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.75 328.89 425.42 436.24 451.62 879.90 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.58 307.44 422.27 427.65 438.83 903.60 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.15 286.60 403.92 426.96 434.79 925.15 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.76 267.88 384.75 426.78 431.73 944.60 -------------------------------------------------------------------------------- K point *** = 0.265625 0.234375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.18 251.90 366.51 426.38 428.13 962.05 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.28 249.72 364.85 427.75 427.75 962.84 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.58 240.85 352.16 423.73 424.06 976.92 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.20 232.71 344.41 417.92 419.54 989.44 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.69 223.43 343.18 410.29 414.32 1000.23 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 206.70 212.75 348.49 401.50 408.55 1008.89 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.86 202.31 358.84 392.96 402.39 1014.78 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.65 195.75 372.11 386.66 396.02 1017.21 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 192.31 194.81 381.35 389.53 389.61 1015.60 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.20 197.20 383.35 383.35 404.35 1009.63 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 202.80 210.04 377.44 388.66 419.57 999.31 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.26 230.30 372.06 397.09 433.94 984.85 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 221.99 256.63 367.41 407.59 447.00 966.61 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.36 287.35 363.66 419.13 458.51 944.97 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.67 320.68 361.00 431.03 468.45 920.33 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.25 354.50 359.61 443.20 477.08 893.07 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.39 359.71 385.68 456.24 485.50 863.55 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.40 361.53 409.67 469.62 497.67 832.18 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.66 365.27 423.70 478.33 520.53 799.42 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.73 370.92 429.71 481.90 551.71 766.02 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.54 378.14 430.53 482.67 584.56 733.50 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.30 386.34 427.80 481.54 612.00 706.63 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.33 394.83 422.36 478.76 617.84 700.84 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.84 403.07 414.67 474.46 596.52 721.62 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.96 404.82 410.64 468.80 566.24 751.07 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.71 392.59 417.29 462.06 535.27 781.59 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.08 377.51 422.84 454.75 506.35 811.15 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.06 359.33 427.19 447.51 480.65 839.02 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.65 338.54 430.30 440.69 458.56 864.88 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.89 316.60 431.66 432.15 442.31 888.60 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.88 295.39 415.45 432.77 435.95 910.16 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.78 276.59 397.71 432.20 432.92 929.62 -------------------------------------------------------------------------------- K point *** = 0.265625 0.265625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.81 261.31 380.52 430.50 430.54 947.12 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.79 263.51 381.95 429.25 430.92 946.29 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.96 256.27 369.75 423.70 428.90 960.46 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.12 250.38 361.66 416.90 425.72 973.12 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.86 243.56 359.48 408.92 421.24 984.19 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.75 234.84 363.73 400.18 415.67 993.36 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 207.46 225.24 372.96 391.83 409.40 1000.07 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 201.75 216.81 380.72 389.49 403.16 1003.68 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.72 211.42 378.15 393.99 405.05 1003.57 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 202.80 210.04 377.44 388.66 419.57 999.31 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.81 213.16 377.96 385.73 434.67 990.76 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 218.59 228.87 374.21 391.21 448.91 978.02 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.49 251.55 369.57 401.08 461.74 961.32 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.44 279.30 365.64 412.92 472.87 941.02 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.68 310.52 362.81 425.68 482.22 917.50 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.48 343.39 361.37 438.84 489.95 891.12 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.11 361.40 375.64 452.38 496.79 862.27 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.85 363.35 403.54 466.35 504.91 831.31 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.09 367.23 423.40 478.08 519.85 798.70 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.40 373.02 434.42 483.84 545.26 765.01 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.68 380.36 438.64 485.38 576.25 731.33 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.11 388.63 437.95 484.82 605.85 700.77 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.94 397.18 433.57 482.87 619.02 686.79 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.34 405.45 426.30 479.62 600.34 704.39 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.39 413.00 416.61 475.04 569.94 733.68 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.09 404.41 419.65 469.18 538.83 764.32 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.38 389.45 425.07 462.32 510.25 794.01 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.23 371.36 429.18 455.03 485.62 821.99 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.62 350.59 431.89 448.03 465.10 847.96 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.55 328.66 433.11 440.75 448.95 871.77 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.09 307.58 427.23 433.73 441.25 893.41 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.37 289.19 411.84 432.99 437.40 912.94 -------------------------------------------------------------------------------- K point *** = 0.265625 0.296875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.76 274.49 396.41 432.13 433.72 930.51 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.89 280.67 400.25 430.19 433.52 927.85 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.79 274.26 388.77 423.21 432.95 942.03 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.76 270.80 380.21 415.01 431.61 954.68 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.97 267.15 376.52 405.95 429.02 965.77 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.28 261.16 378.80 396.68 425.06 975.10 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 217.51 252.77 383.49 390.96 420.04 982.23 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.50 243.57 378.25 399.38 415.39 986.60 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.13 235.54 373.47 402.49 419.94 987.63 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.26 230.30 372.06 397.09 433.94 984.85 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 218.59 228.87 374.21 391.21 448.91 978.02 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.87 233.20 377.31 388.50 463.13 967.07 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.83 251.09 375.27 394.81 475.94 952.16 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.72 274.92 371.47 406.07 486.98 933.54 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.50 302.77 368.47 419.12 496.11 911.53 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.31 333.11 366.89 432.92 503.41 886.48 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.34 363.24 367.88 447.05 509.36 858.74 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.83 368.66 393.53 461.34 515.31 828.67 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.12 372.70 417.32 474.53 524.73 796.67 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.79 378.58 433.62 482.93 542.76 763.20 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.73 385.94 442.60 485.56 569.31 729.02 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.02 394.16 445.50 485.13 598.73 695.92 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.83 402.60 443.36 483.58 619.16 673.12 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.26 410.69 437.19 481.37 604.66 685.56 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.32 418.00 427.95 478.29 573.83 714.57 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.94 416.08 424.19 474.07 542.22 745.22 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.03 401.50 429.03 468.66 513.48 774.95 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.48 383.91 432.34 462.32 489.43 803.00 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.23 363.68 434.04 455.75 470.42 829.05 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.19 342.38 434.30 449.41 455.49 852.97 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.33 322.27 433.58 439.75 446.63 874.72 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.86 305.20 426.14 433.64 441.65 894.36 -------------------------------------------------------------------------------- K point *** = 0.265625 0.328125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.05 291.43 413.07 433.18 436.63 912.02 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.06 300.78 418.79 430.53 436.80 907.36 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.57 294.19 408.47 422.92 436.55 921.52 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.44 292.14 399.65 413.59 436.69 934.06 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.80 291.52 394.03 403.72 435.97 945.03 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.96 288.90 390.58 396.93 433.99 954.28 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.96 282.78 382.27 401.40 430.89 961.53 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.65 274.05 374.43 409.92 428.38 966.33 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 220.80 264.68 369.16 412.46 433.72 968.17 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 221.99 256.63 367.41 407.59 447.00 966.61 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.49 251.55 369.57 401.08 461.74 961.32 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.83 251.09 375.27 394.81 475.94 952.16 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.58 258.92 381.74 391.63 488.80 939.15 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.55 276.64 380.61 399.51 499.88 922.45 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.84 299.76 377.44 412.37 508.97 902.30 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.61 326.14 375.56 426.49 516.10 878.98 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.10 354.05 375.68 441.02 521.57 852.80 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.46 375.76 383.81 455.55 526.30 824.11 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.98 380.85 407.91 469.24 532.49 793.24 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.23 386.93 427.73 479.57 544.23 760.60 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.01 394.39 441.36 483.88 564.54 726.71 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.35 402.63 448.93 483.40 591.07 692.52 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.31 411.00 450.61 481.27 616.50 662.34 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.90 418.89 446.63 479.47 609.60 665.71 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.02 425.74 438.35 477.92 578.30 694.18 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.52 426.29 432.02 475.83 546.13 724.57 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.20 412.71 435.64 472.77 516.89 754.10 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.86 396.21 437.68 468.67 492.67 782.06 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.27 377.42 437.81 463.71 474.44 808.12 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.23 357.95 436.48 458.33 461.19 832.11 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.80 340.01 434.75 450.44 452.84 853.98 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.12 324.69 433.47 440.32 447.11 873.74 -------------------------------------------------------------------------------- K point *** = 0.265625 0.359375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.28 311.56 429.23 433.50 441.03 891.49 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.05 322.43 429.31 434.07 445.91 884.74 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.42 315.23 421.01 429.07 441.98 898.86 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.11 313.44 410.98 421.52 441.80 911.27 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.39 315.13 400.27 414.69 442.33 922.04 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.87 316.25 389.47 411.68 442.17 931.09 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.85 313.59 379.42 414.18 441.13 938.26 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.33 306.63 371.14 420.34 440.66 943.22 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.01 297.13 365.63 422.88 446.15 945.59 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.36 287.35 363.66 419.13 458.51 944.97 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.44 279.30 365.64 412.92 472.87 941.02 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.72 274.92 371.47 406.07 486.98 933.54 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.55 276.64 380.61 399.51 499.88 922.45 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.68 286.77 391.09 395.02 511.03 907.80 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.92 303.82 388.85 406.34 520.18 889.75 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.67 325.00 386.33 420.69 527.27 868.49 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.72 348.59 385.91 435.41 532.52 844.30 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.21 372.73 388.21 449.97 536.57 817.46 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.31 389.61 399.26 463.64 540.89 788.27 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.44 396.80 419.21 474.79 548.30 757.08 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.35 404.64 435.64 480.83 562.33 724.29 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.96 413.15 447.25 481.00 583.72 690.45 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.25 421.66 453.75 477.64 609.27 656.92 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.11 429.45 453.85 474.66 614.89 645.75 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.32 435.53 447.63 474.19 583.39 673.16 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.56 434.03 443.32 474.47 551.11 702.77 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.44 422.18 445.01 474.32 521.71 731.71 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.58 407.71 445.05 473.46 497.18 759.31 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.62 391.71 442.80 471.67 478.94 785.20 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.54 375.43 439.13 465.82 469.35 809.16 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.27 360.16 435.64 456.69 465.08 831.09 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.86 346.20 433.36 448.61 459.55 850.96 -------------------------------------------------------------------------------- K point *** = 0.265625 0.390625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.29 333.41 432.18 440.69 452.83 868.82 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.73 343.83 427.38 441.12 465.86 859.97 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.92 335.87 420.78 438.39 458.94 874.07 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.90 333.47 410.62 437.30 452.99 886.36 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.81 336.31 399.20 433.88 450.40 896.90 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.07 340.86 387.76 429.58 450.34 905.69 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.31 342.72 377.28 428.43 450.70 912.65 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.70 339.22 368.77 431.34 451.80 917.60 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.02 331.04 363.10 433.50 457.19 920.27 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.67 320.68 361.00 431.03 468.45 920.33 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.68 310.52 362.81 425.68 482.22 917.50 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.50 302.77 368.47 419.12 496.11 911.53 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.84 299.76 377.44 412.37 508.97 902.30 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.92 303.82 388.85 406.34 520.18 889.75 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.64 314.99 398.60 404.94 529.40 873.94 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.66 330.92 396.95 417.65 536.54 855.01 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.68 349.62 396.06 432.09 541.74 833.15 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.13 369.74 397.64 446.25 545.46 808.57 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.03 389.87 402.12 459.35 548.73 781.56 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.47 405.59 412.35 470.21 553.50 752.42 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.94 414.92 428.26 476.99 562.55 721.50 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.20 424.14 441.78 478.32 577.97 689.21 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.12 433.18 451.63 474.85 599.25 656.10 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 364.44 441.06 457.20 469.39 619.67 627.52 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.76 445.32 456.10 468.19 589.13 652.46 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 370.48 440.07 455.70 470.76 557.85 680.40 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.94 429.70 455.63 473.58 529.65 708.13 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.58 418.19 452.85 475.46 506.71 734.93 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.34 406.10 447.44 474.74 491.50 760.38 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.09 393.47 440.94 469.71 484.65 784.15 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.60 380.54 435.43 462.68 481.15 806.06 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.02 367.60 431.85 455.27 477.26 826.01 -------------------------------------------------------------------------------- K point *** = 0.265625 0.421875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.94 355.06 429.84 447.66 472.16 843.97 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.03 363.31 423.98 447.62 490.43 833.12 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.91 354.59 419.16 443.33 484.23 847.24 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.27 351.04 410.07 443.21 477.06 859.44 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.28 353.72 398.69 444.76 469.74 869.77 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.78 360.36 386.96 445.42 464.01 878.28 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.56 366.77 376.20 444.44 461.64 884.97 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.03 367.44 368.61 444.28 462.43 889.77 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.11 361.69 363.93 444.94 467.19 892.54 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.25 354.50 359.61 443.20 477.08 893.07 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.48 343.39 361.37 438.84 489.95 891.12 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.31 333.11 366.89 432.92 503.41 886.48 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.61 326.14 375.56 426.49 516.10 878.98 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.67 325.00 386.33 420.69 527.27 868.49 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.66 330.92 396.95 417.65 536.54 855.01 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.05 342.37 402.25 422.41 543.77 838.58 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.55 356.98 403.03 433.97 549.03 819.30 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.55 373.16 404.59 446.73 552.69 797.36 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.39 389.96 408.52 458.52 555.53 772.96 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.96 406.61 414.98 468.07 558.89 746.39 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.28 422.13 423.70 474.05 564.73 717.97 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.67 432.79 436.54 475.51 574.97 688.13 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.70 442.43 447.73 472.64 590.36 657.36 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.88 450.92 455.23 467.42 610.18 626.41 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 380.47 452.08 460.50 465.40 595.89 633.39 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 382.44 444.55 465.33 467.24 567.46 658.25 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 379.76 436.10 464.00 471.48 542.77 683.83 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 372.14 428.07 458.63 474.18 524.05 709.24 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.59 419.77 450.04 474.66 512.36 733.85 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.86 410.18 440.86 472.71 506.07 757.21 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.92 399.06 433.56 468.45 502.37 778.98 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.60 386.97 428.83 462.29 499.19 798.96 -------------------------------------------------------------------------------- K point *** = 0.265625 0.453125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.20 374.69 426.15 454.87 495.38 817.03 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.91 379.84 419.29 454.63 518.27 804.40 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.31 370.44 416.19 448.64 512.97 818.59 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.90 365.50 409.19 446.97 506.29 830.75 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.26 366.94 398.79 449.07 498.41 840.91 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.33 373.79 387.40 452.59 489.91 849.14 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.89 376.06 383.45 455.86 482.07 855.51 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.62 367.56 390.27 457.91 477.20 860.06 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.59 361.83 391.39 458.15 478.14 862.77 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.39 359.71 385.68 456.24 485.50 863.55 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.11 361.40 375.64 452.38 496.79 862.27 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.34 363.24 367.88 447.05 509.36 858.74 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.10 354.05 375.68 441.02 521.57 852.80 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.72 348.59 385.91 435.41 532.52 844.30 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.68 349.62 396.06 432.09 541.74 833.15 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.55 356.98 403.03 433.97 549.03 819.30 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.59 368.38 405.83 441.90 554.45 802.81 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.36 381.72 407.72 452.36 558.29 783.76 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.10 395.72 411.24 462.32 561.19 762.34 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.13 409.71 417.23 470.00 564.12 738.79 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.34 423.22 425.62 474.21 568.39 713.44 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.62 433.62 437.85 474.36 575.22 686.72 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.99 442.18 450.80 470.77 585.41 659.23 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 380.50 449.45 460.66 465.75 599.18 631.85 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 387.79 453.91 457.48 470.59 604.53 617.51 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 390.04 448.27 461.14 473.36 581.33 637.29 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 385.97 442.73 465.21 470.87 562.09 659.48 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.36 437.81 461.31 470.61 548.27 682.67 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.40 432.08 450.08 473.57 539.20 705.94 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.15 424.55 438.74 474.80 533.24 728.59 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.38 414.74 429.97 473.34 529.07 750.08 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.65 403.30 424.34 468.97 525.73 770.03 -------------------------------------------------------------------------------- K point *** = 0.265625 0.484375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.05 391.31 421.19 462.27 522.37 788.19 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.37 393.34 413.43 461.67 548.64 774.30 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.10 383.30 411.84 454.53 543.94 788.58 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.66 376.88 407.49 450.79 537.95 800.72 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.34 376.40 399.25 451.83 530.50 810.72 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.19 381.41 389.65 455.96 521.77 818.67 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.70 377.32 393.08 461.12 512.28 824.67 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.79 369.08 402.75 465.99 503.26 828.87 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.78 363.52 409.33 469.45 497.17 831.35 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.40 361.53 409.67 469.62 497.67 832.18 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.85 363.35 403.54 466.35 504.91 831.31 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.83 368.66 393.53 461.34 515.31 828.67 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.46 375.76 383.81 455.55 526.30 824.11 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.21 372.73 388.21 449.97 536.57 817.46 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.13 369.74 397.64 446.25 545.46 808.57 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.55 373.16 404.59 446.73 552.69 797.36 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.36 381.72 407.72 452.36 558.29 783.76 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.05 393.01 409.15 460.76 562.53 767.83 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.95 405.21 411.54 468.88 565.94 749.69 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.20 415.85 417.75 474.68 569.25 729.55 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.11 423.47 429.06 477.05 573.22 707.75 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.54 432.91 439.89 475.65 578.39 684.80 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.20 442.20 450.82 471.03 585.06 661.39 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 378.62 449.23 461.46 464.78 593.57 638.51 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 387.79 453.91 457.48 470.59 604.53 617.51 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 390.95 452.86 457.22 473.63 599.87 618.64 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 386.55 450.21 460.98 469.97 586.51 635.97 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.35 446.60 460.92 466.44 576.97 655.86 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.19 440.58 449.71 472.06 569.95 677.15 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.24 432.55 438.68 476.03 564.39 698.76 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.12 424.54 427.91 477.09 559.82 719.82 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.21 416.64 418.54 474.70 555.98 739.69 -------------------------------------------------------------------------------- K point *** = 0.265625 0.515625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.51 404.89 415.05 469.15 552.45 757.95 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.42 404.16 406.60 468.11 579.82 743.92 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.28 393.45 406.32 460.47 575.53 758.22 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.47 385.56 404.71 454.92 570.23 770.26 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.27 382.80 399.64 454.08 563.56 780.02 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.93 384.76 393.29 457.68 555.45 787.59 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.45 379.72 398.08 463.55 546.10 793.11 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.95 372.21 408.48 469.78 536.14 796.78 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.05 367.04 418.05 475.11 526.84 798.82 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.66 365.27 423.70 478.33 520.53 799.42 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.09 367.23 423.40 478.08 519.85 798.70 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.12 372.70 417.32 474.53 524.73 796.67 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.98 380.85 407.91 469.24 532.49 793.24 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.31 389.61 399.26 463.64 540.89 788.27 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.03 389.87 402.12 459.35 548.73 781.56 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.39 389.96 408.52 458.52 555.53 772.96 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.10 395.72 411.24 462.32 561.19 762.34 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.95 405.21 411.54 468.88 565.94 749.69 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.31 411.99 416.29 475.18 570.21 735.07 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.26 414.40 427.49 479.11 574.45 718.72 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.81 419.54 437.98 479.67 578.90 701.01 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.21 427.43 447.21 476.80 583.43 682.57 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.18 437.28 454.84 471.26 587.71 664.30 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 370.05 447.05 460.69 464.71 591.63 647.45 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 380.47 452.08 460.50 465.40 595.89 633.39 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 385.23 451.63 460.53 467.73 602.35 622.86 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 382.14 454.03 457.81 466.71 611.63 616.76 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 372.84 449.11 458.68 465.63 608.11 629.71 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.50 438.41 454.72 471.11 602.53 648.53 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.43 427.42 447.33 476.80 597.12 668.94 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.28 418.13 438.09 479.79 592.07 689.49 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.35 411.54 427.44 479.18 587.60 709.22 -------------------------------------------------------------------------------- K point *** = 0.265625 0.546875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.60 407.85 415.90 474.98 583.65 727.51 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.04 398.74 412.98 473.47 607.72 716.73 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.84 398.34 402.94 465.85 604.32 730.34 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.31 391.56 401.32 459.08 600.17 741.70 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.88 386.78 399.64 456.15 594.80 750.75 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.24 386.51 396.36 458.35 587.99 757.51 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.76 383.09 400.10 464.11 579.75 762.13 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.69 376.91 410.08 471.05 570.40 764.89 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.97 372.38 420.87 477.38 560.65 766.07 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.73 370.92 429.71 481.90 551.71 766.02 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.40 373.02 434.42 483.84 545.26 765.01 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.79 378.58 433.62 482.93 542.76 763.20 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.23 386.93 427.73 479.57 544.23 760.60 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.44 396.80 419.21 474.79 548.30 757.08 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.47 405.59 412.35 470.21 553.50 752.42 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.96 406.61 414.98 468.07 558.89 746.39 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.13 409.71 417.23 470.00 564.12 738.79 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.20 415.85 417.75 474.68 569.25 729.55 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.26 414.40 427.49 479.11 574.45 718.72 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.33 414.13 437.95 481.14 579.75 706.57 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.26 416.37 447.79 479.94 584.75 693.61 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.91 421.47 456.25 475.66 588.66 680.67 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.39 429.12 462.68 469.12 590.61 668.89 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.12 438.17 461.23 467.03 590.35 659.37 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.76 445.32 456.10 468.19 589.13 652.46 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 375.04 445.75 457.28 467.60 589.86 647.51 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.14 447.04 454.00 469.05 595.21 643.57 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.71 442.84 453.37 471.01 605.37 640.41 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.79 431.51 455.63 473.68 616.56 640.22 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.97 420.14 452.48 478.20 620.37 649.61 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.98 410.53 445.29 481.81 617.96 666.13 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.13 403.66 435.67 482.44 614.36 683.97 -------------------------------------------------------------------------------- K point *** = 0.265625 0.578125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.35 399.85 424.59 479.49 610.93 701.12 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.17 390.51 419.65 477.43 619.84 704.74 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.70 391.79 408.50 470.19 620.64 714.17 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.10 392.24 400.59 462.82 620.12 722.26 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.05 388.62 399.24 458.08 618.03 728.57 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.95 387.54 398.23 458.31 614.21 732.89 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.48 386.91 400.20 463.22 608.65 735.28 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.88 382.84 408.94 470.36 601.53 735.92 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.44 379.23 419.99 477.39 593.28 735.18 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.54 378.14 430.53 482.67 584.56 733.50 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.68 380.36 438.64 485.38 576.25 731.33 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.73 385.94 442.60 485.56 569.31 729.02 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.01 394.39 441.36 483.88 564.54 726.71 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.35 404.64 435.64 480.83 562.33 724.29 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.94 414.92 428.26 476.99 562.55 721.50 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.28 422.13 423.70 474.05 564.73 717.97 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.34 423.22 425.62 474.21 568.39 713.44 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.11 423.47 429.06 477.05 573.22 707.75 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.81 419.54 437.98 479.67 578.90 701.01 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.26 416.37 447.79 479.94 584.75 693.61 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.11 415.39 457.09 477.21 589.61 686.28 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.97 417.23 464.90 471.72 592.13 680.05 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.53 421.86 464.02 470.71 591.42 675.83 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.66 428.56 455.41 473.78 587.90 673.77 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.32 435.53 447.63 474.19 583.39 673.16 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.45 438.18 444.73 473.13 580.27 673.07 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.76 438.40 443.20 473.49 580.44 672.94 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.61 433.85 444.48 475.80 584.61 672.72 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.46 423.14 449.61 478.27 592.00 672.91 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.05 411.95 451.52 480.93 600.69 674.49 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.30 402.28 448.27 483.62 608.51 678.58 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.54 395.25 440.90 484.61 614.19 685.62 -------------------------------------------------------------------------------- K point *** = 0.265625 0.609375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.69 391.36 430.94 482.57 617.78 694.81 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.62 382.25 424.15 479.79 603.45 720.47 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.70 384.39 412.92 473.14 610.44 723.54 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.72 387.71 403.02 465.69 616.15 725.63 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.68 388.43 398.66 459.70 620.17 726.31 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.97 387.79 398.92 457.85 622.25 725.31 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.64 390.00 399.51 461.23 622.33 722.57 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.69 389.34 405.84 468.04 620.50 718.24 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.70 386.98 416.50 475.53 616.97 712.72 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.30 386.34 427.80 481.54 612.00 706.63 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.11 388.63 437.95 484.82 605.85 700.77 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.02 394.16 445.50 485.13 598.73 695.92 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.35 402.63 448.93 483.40 591.07 692.52 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.96 413.15 447.25 481.00 583.72 690.45 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.20 424.14 441.78 478.32 577.97 689.21 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.67 432.79 436.54 475.51 574.97 688.13 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.62 433.62 437.85 474.36 575.22 686.72 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.54 432.91 439.89 475.65 578.39 684.80 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.21 427.43 447.21 476.80 583.43 682.57 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.91 421.47 456.25 475.66 588.66 680.67 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.97 417.23 464.90 471.72 592.13 680.05 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.66 415.65 465.21 472.07 592.40 681.47 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.40 416.94 456.87 476.82 589.35 684.87 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.67 420.70 447.48 478.75 584.11 689.43 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.02 425.74 438.35 477.92 578.30 694.18 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.87 429.38 431.92 475.63 573.31 698.41 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.84 428.67 430.35 474.67 570.04 701.81 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.98 424.17 432.29 476.70 569.01 704.41 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.73 414.28 438.88 480.02 570.52 706.49 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.78 403.50 444.51 482.90 574.53 708.46 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.23 393.90 445.97 484.96 580.56 710.75 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.50 386.80 442.30 485.73 587.87 713.62 -------------------------------------------------------------------------------- K point *** = 0.265625 0.640625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.49 382.87 434.50 484.17 595.72 716.98 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.10 374.60 426.01 480.38 572.78 749.94 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.54 377.42 415.31 474.43 582.14 750.11 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.98 382.42 404.63 467.31 591.12 748.97 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.71 386.75 397.73 460.74 599.02 746.14 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.32 387.10 398.48 457.12 605.46 741.33 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.39 390.03 399.97 458.50 610.34 734.35 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.38 395.07 401.76 464.39 613.80 725.15 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.07 394.95 410.90 472.02 616.17 713.86 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.33 394.83 422.36 478.76 617.84 700.84 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.94 397.18 433.57 482.87 619.02 686.79 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.83 402.60 443.36 483.58 619.16 673.12 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.31 411.00 450.61 481.27 616.50 662.34 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.25 421.66 453.75 477.64 609.27 656.92 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.12 433.18 451.63 474.85 599.25 656.10 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.70 442.43 447.73 472.64 590.36 657.36 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.99 442.18 450.80 470.77 585.41 659.23 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.20 442.20 450.82 471.03 585.06 661.39 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.18 437.28 454.84 471.26 587.71 664.30 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.39 429.12 462.68 469.12 590.61 668.89 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.53 421.86 464.02 470.71 591.42 675.83 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.40 416.94 456.87 476.82 589.35 684.87 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.00 414.88 447.92 480.35 585.00 695.01 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.54 415.52 437.94 480.77 579.51 705.17 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.32 418.00 427.95 478.29 573.83 714.57 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.48 419.38 420.73 474.30 568.50 722.75 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.01 414.97 420.59 471.60 563.63 729.52 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.10 413.91 418.17 472.54 559.24 734.92 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.72 405.71 423.96 476.35 555.64 739.12 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.16 395.45 431.95 480.69 553.52 742.40 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.68 386.02 437.75 483.89 553.90 745.01 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.81 378.92 438.77 485.18 557.49 747.15 -------------------------------------------------------------------------------- K point *** = 0.265625 0.671875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.47 375.01 434.46 484.09 564.13 748.85 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.31 368.23 424.28 478.87 539.21 782.72 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.96 371.58 415.05 473.79 548.38 781.73 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.69 377.72 404.31 467.37 558.33 779.27 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.09 384.47 395.74 460.86 567.78 775.08 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.06 385.19 397.06 456.11 576.06 768.90 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.83 386.30 401.78 455.42 582.90 760.53 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.16 392.77 403.44 459.76 588.35 749.84 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.77 401.84 404.14 467.11 592.72 736.84 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.84 403.07 414.67 474.46 596.52 721.62 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.34 405.45 426.30 479.62 600.34 704.39 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.26 410.69 437.19 481.37 604.66 685.56 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.90 418.89 446.63 479.47 609.60 665.71 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.11 429.45 453.85 474.66 614.89 645.75 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 364.44 441.06 457.20 469.39 619.67 627.52 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.88 450.92 455.23 467.42 610.18 626.41 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 380.50 449.45 460.66 465.75 599.18 631.85 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 378.62 449.23 461.46 464.78 593.57 638.51 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 370.05 447.05 460.69 464.71 591.63 647.45 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.12 438.17 461.23 467.03 590.35 659.37 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.66 428.56 455.41 473.78 587.90 673.77 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.67 420.70 447.48 478.75 584.11 689.43 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.54 415.52 437.94 480.77 579.51 705.17 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.10 413.16 427.36 479.40 574.69 720.11 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.39 413.00 416.61 475.04 569.94 733.68 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.46 406.66 413.94 469.19 565.12 745.56 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.09 399.88 413.18 464.57 559.89 755.60 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.27 398.25 408.79 463.90 553.98 763.80 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.51 397.42 406.07 467.19 547.40 770.27 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.18 388.45 413.90 472.38 540.57 775.18 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.55 379.28 422.89 477.50 534.58 778.74 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.28 372.26 428.87 480.98 531.34 781.14 -------------------------------------------------------------------------------- K point *** = 0.265625 0.703125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.38 368.43 429.43 481.54 532.86 782.48 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.14 363.63 417.05 474.27 508.54 815.75 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.89 367.34 410.91 470.76 514.81 814.23 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.86 374.20 401.14 465.50 524.07 811.12 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.94 382.34 391.85 459.70 533.87 806.27 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.31 381.41 395.17 454.65 542.97 799.51 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.05 379.93 403.30 452.30 550.78 790.67 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.13 384.56 408.14 454.64 557.14 779.67 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.94 393.63 409.72 461.13 562.17 766.45 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.96 404.82 410.64 468.80 566.24 751.07 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.39 413.00 416.61 475.04 569.94 733.68 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.32 418.00 427.95 478.29 573.83 714.57 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.02 425.74 438.35 477.92 578.30 694.18 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.32 435.53 447.63 474.19 583.39 673.16 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.76 445.32 456.10 468.19 589.13 652.46 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 380.47 452.08 460.50 465.40 595.89 633.39 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 387.79 453.91 457.48 470.59 604.53 617.51 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 387.79 453.91 457.48 470.59 604.53 617.51 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 380.47 452.08 460.50 465.40 595.89 633.39 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.76 445.32 456.10 468.19 589.13 652.46 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.32 435.53 447.63 474.19 583.39 673.16 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.02 425.74 438.35 477.92 578.30 694.18 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.32 418.00 427.95 478.29 573.83 714.57 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.39 413.00 416.61 475.04 569.94 733.68 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.96 404.82 410.64 468.80 566.24 751.07 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.94 393.63 409.72 461.13 562.17 766.45 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.13 384.56 408.14 454.64 557.14 779.67 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.05 379.93 403.30 452.30 550.78 790.67 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.31 381.41 395.17 454.65 542.97 799.51 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.94 382.34 391.85 459.70 533.87 806.27 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.86 374.20 401.14 465.50 524.07 811.12 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.89 367.34 410.91 470.76 514.81 814.23 -------------------------------------------------------------------------------- K point *** = 0.265625 0.734375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.14 363.63 417.05 474.27 508.54 815.75 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.87 360.95 401.14 464.21 487.48 847.88 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.59 364.88 400.41 463.96 486.67 846.15 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.77 372.08 393.55 460.98 492.32 842.65 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.50 380.40 385.32 456.78 500.87 837.37 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.27 374.69 393.58 452.39 509.91 830.23 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.15 370.99 404.08 449.26 518.22 821.15 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.32 373.72 411.87 449.57 525.27 810.05 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.62 381.74 415.60 454.54 530.90 796.86 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.71 392.59 417.29 462.06 535.27 781.59 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.09 404.41 419.65 469.18 538.83 764.32 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.94 416.08 424.19 474.07 542.22 745.22 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.52 426.29 432.02 475.83 546.13 724.57 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.56 434.03 443.32 474.47 551.11 702.77 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 370.48 440.07 455.70 470.76 557.85 680.40 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 382.44 444.55 465.33 467.24 567.46 658.25 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 390.04 448.27 461.14 473.36 581.33 637.29 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 390.95 452.86 457.22 473.63 599.87 618.64 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 385.23 451.63 460.53 467.73 602.35 622.86 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 375.04 445.75 457.28 467.60 589.86 647.51 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.45 438.18 444.73 473.13 580.27 673.07 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.87 429.38 431.92 475.63 573.31 698.41 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.48 419.38 420.73 474.30 568.50 722.75 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.46 406.66 413.94 469.19 565.12 745.56 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.94 393.63 409.72 461.13 562.17 766.45 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.59 380.86 407.54 451.62 558.70 785.14 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.23 369.51 405.50 443.14 553.99 801.43 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.40 361.53 400.55 439.08 547.61 815.23 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.67 359.32 391.75 440.59 539.40 826.50 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.78 363.66 381.59 445.40 529.46 835.27 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.91 369.82 375.34 451.29 518.14 841.65 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.89 364.36 385.02 456.92 506.21 845.76 -------------------------------------------------------------------------------- K point *** = 0.265625 0.765625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.01 360.80 395.14 461.47 495.12 847.79 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.06 360.05 375.21 450.75 476.13 878.50 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.62 364.06 380.48 451.49 469.77 876.76 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.92 371.38 379.00 451.39 468.85 873.02 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.21 371.97 381.44 450.69 472.59 867.40 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.24 363.95 392.81 448.58 479.50 859.95 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.23 358.98 404.39 446.00 487.42 850.65 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.76 360.02 414.29 444.99 494.90 839.45 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.82 366.99 420.28 447.99 501.28 826.30 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.08 377.51 422.84 454.75 506.35 811.15 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.38 389.45 425.07 462.32 510.25 794.01 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.03 401.50 429.03 468.66 513.48 774.95 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.20 412.71 435.64 472.77 516.89 754.10 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.44 422.18 445.01 474.32 521.71 731.71 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.94 429.70 455.63 473.58 529.65 708.13 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 379.76 436.10 464.00 471.48 542.77 683.83 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 385.97 442.73 465.21 470.87 562.09 659.48 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 386.55 450.21 460.98 469.97 586.51 635.97 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 382.14 454.03 457.81 466.71 611.63 616.76 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.14 447.04 454.00 469.05 595.21 643.57 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.76 438.40 443.20 473.49 580.44 672.94 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.84 428.67 430.35 474.67 570.04 701.81 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.01 414.97 420.59 471.60 563.63 729.52 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.09 399.88 413.18 464.57 559.89 755.60 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.13 384.56 408.14 454.64 557.14 779.67 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.23 369.51 405.50 443.14 553.99 801.43 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.07 355.56 404.06 432.04 549.53 820.67 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.36 344.11 400.22 425.33 543.25 837.21 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.42 337.43 391.24 425.94 534.98 850.95 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.34 337.52 380.43 430.73 524.76 861.84 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.25 343.85 370.73 436.86 512.88 869.92 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.84 353.96 363.64 442.89 499.95 875.28 -------------------------------------------------------------------------------- K point *** = 0.265625 0.796875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.53 359.81 365.44 447.80 487.05 878.07 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.37 342.98 360.73 438.52 467.03 907.16 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.63 351.76 364.73 438.57 458.95 905.60 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.91 355.87 371.98 436.56 456.10 901.76 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.59 353.96 381.72 437.13 455.51 895.87 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.63 348.35 392.99 439.86 456.55 888.12 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.49 343.47 404.71 441.06 460.81 878.58 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.46 343.29 415.60 440.69 467.50 867.25 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.52 349.19 423.59 442.02 474.48 854.08 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.06 359.33 427.19 447.51 480.65 839.02 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.23 371.36 429.18 455.03 485.62 821.99 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.48 383.91 432.34 462.32 489.43 803.00 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.86 396.21 437.68 468.67 492.67 782.06 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.58 407.71 445.05 473.46 497.18 759.31 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.58 418.19 452.85 475.46 506.71 734.93 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 372.14 428.07 458.63 474.18 524.05 709.24 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.36 437.81 461.31 470.61 548.27 682.67 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.35 446.60 460.92 466.44 576.97 655.86 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 372.84 449.11 458.68 465.63 608.11 629.71 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.71 442.84 453.37 471.01 605.37 640.41 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.61 433.85 444.48 475.80 584.61 672.72 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.98 424.17 432.29 476.70 569.01 704.41 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.10 413.91 418.17 472.54 559.24 734.92 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.27 398.25 408.79 463.90 553.98 763.80 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.05 379.93 403.30 452.30 550.78 790.67 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.40 361.53 400.55 439.08 547.61 815.23 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.36 344.11 400.22 425.33 543.25 837.21 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.56 328.83 400.43 413.30 537.08 856.38 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.51 317.46 393.12 411.30 528.86 872.57 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.46 312.41 381.63 416.21 518.60 885.65 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.62 314.53 371.52 422.64 506.54 895.58 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.41 321.96 364.23 429.20 493.17 902.38 -------------------------------------------------------------------------------- K point *** = 0.265625 0.828125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.38 332.22 360.52 434.90 479.42 906.18 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.50 308.93 362.73 427.12 457.23 933.50 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.30 318.86 366.62 427.67 448.14 932.31 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.42 326.41 373.74 423.13 445.90 928.50 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.29 329.42 383.20 420.06 446.10 922.44 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.00 327.80 394.06 422.00 445.99 914.41 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.30 324.57 405.35 427.59 445.57 904.61 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.54 323.98 416.20 433.27 446.63 893.12 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.75 328.89 425.42 436.24 451.62 879.90 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.65 338.54 430.30 440.69 458.56 864.88 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.62 350.59 431.89 448.03 465.10 847.96 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.23 363.68 434.04 455.75 470.42 829.05 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.27 377.42 437.81 463.71 474.44 808.12 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.62 391.71 442.80 471.67 478.94 785.20 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.34 406.10 447.44 474.74 491.50 760.38 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.59 419.77 450.04 474.66 512.36 733.85 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.40 432.08 450.08 473.57 539.20 705.94 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.19 440.58 449.71 472.06 569.95 677.15 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.50 438.41 454.72 471.11 602.53 648.53 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.79 431.51 455.63 473.68 616.56 640.22 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.46 423.14 449.61 478.27 592.00 672.91 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.73 414.28 438.88 480.02 570.52 706.49 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.72 405.71 423.96 476.35 555.64 739.12 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.51 397.42 406.07 467.19 547.40 770.27 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.31 381.41 395.17 454.65 542.97 799.51 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.67 359.32 391.75 440.59 539.40 826.50 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.42 337.43 391.24 425.94 534.98 850.95 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.51 317.46 393.12 411.30 528.86 872.57 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.33 300.92 396.79 397.49 520.72 891.13 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.92 290.15 384.53 402.53 510.51 906.42 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.89 287.22 374.00 409.03 498.42 918.30 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.37 290.99 366.48 415.90 484.87 926.72 -------------------------------------------------------------------------------- K point *** = 0.265625 0.859375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.27 298.94 362.63 422.34 470.62 931.73 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.14 275.88 365.87 415.93 446.07 957.14 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.35 285.45 369.59 417.56 436.07 956.55 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.19 294.53 376.47 411.36 435.06 952.97 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.03 301.00 385.51 404.93 437.23 946.85 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.04 303.52 395.42 403.90 438.82 938.62 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.22 303.14 404.36 409.68 439.25 928.58 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.21 303.22 412.93 419.02 438.86 916.90 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.58 307.44 422.27 427.65 438.83 903.60 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.89 316.60 431.66 432.15 442.31 888.60 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.55 328.66 433.11 440.75 448.95 871.77 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.19 342.38 434.30 449.41 455.49 852.97 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.23 357.95 436.48 458.33 461.19 832.11 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.54 375.43 439.13 465.82 469.35 809.16 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.09 393.47 440.94 469.71 484.65 784.15 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.86 410.18 440.86 472.71 506.07 757.21 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.15 424.55 438.74 474.80 533.24 728.59 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.24 432.55 438.68 476.03 564.39 698.76 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.43 427.42 447.33 476.80 597.12 668.94 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.97 420.14 452.48 478.20 620.37 649.61 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.05 411.95 451.52 480.93 600.69 674.49 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.78 403.50 444.51 482.90 574.53 708.46 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.16 395.45 431.95 480.69 553.52 742.40 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.18 388.45 413.90 472.38 540.57 775.18 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.94 382.34 391.85 459.70 533.87 806.27 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.78 363.66 381.59 445.40 529.46 835.27 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.34 337.52 380.43 430.73 524.76 861.84 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.46 312.41 381.63 416.21 518.60 885.65 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.92 290.15 384.53 402.53 510.51 906.42 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.74 272.71 385.82 393.29 500.38 923.85 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.84 263.54 377.45 396.98 488.34 937.74 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.51 263.00 369.97 403.44 474.73 947.92 -------------------------------------------------------------------------------- K point *** = 0.265625 0.890625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.90 267.81 365.95 410.17 460.20 954.35 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 214.98 245.84 369.96 405.12 433.43 977.72 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.54 253.86 373.39 407.66 422.67 978.00 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 220.02 263.09 379.83 399.95 423.39 974.89 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.66 271.58 386.39 393.09 427.66 968.90 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.63 277.53 385.03 399.83 431.28 960.58 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.06 280.52 386.93 409.46 433.58 950.37 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.99 282.42 393.84 418.71 434.60 938.53 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.15 286.60 403.92 426.96 434.79 925.15 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.88 295.39 415.45 432.77 435.95 910.16 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.09 307.58 427.23 433.73 441.25 893.41 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.33 322.27 433.58 439.75 446.63 874.72 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.80 340.01 434.75 450.44 452.84 853.98 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.27 360.16 435.64 456.69 465.08 831.09 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.60 380.54 435.43 462.68 481.15 806.06 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.92 399.06 433.56 468.45 502.37 778.98 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.39 414.74 429.97 473.34 529.07 750.08 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.12 424.54 427.91 477.09 559.82 719.82 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.28 418.13 438.09 479.79 592.07 689.49 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.98 410.53 445.29 481.81 617.96 666.13 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.30 402.28 448.27 483.62 608.51 678.58 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.23 393.90 445.97 484.96 580.56 710.75 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.68 386.02 437.75 483.89 553.90 745.01 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.55 379.28 422.89 477.50 534.58 778.74 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.86 374.20 401.14 465.50 524.07 811.12 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.91 369.82 375.34 451.29 518.14 841.65 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.25 343.85 370.73 436.86 512.88 869.92 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.62 314.53 371.52 422.64 506.54 895.58 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.89 287.22 374.00 409.03 498.42 918.30 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.84 263.54 377.45 396.98 488.34 937.74 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.27 245.67 378.89 390.03 476.36 953.59 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.65 239.51 374.17 392.89 462.77 965.62 -------------------------------------------------------------------------------- K point *** = 0.265625 0.921875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 218.96 240.64 370.28 398.97 448.10 973.66 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 204.73 220.55 374.80 395.46 419.44 994.84 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 204.66 225.83 377.64 398.16 408.39 996.29 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 208.80 233.97 381.68 389.88 411.63 993.95 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.13 243.27 375.00 394.07 417.57 988.37 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.74 251.73 368.86 402.92 422.94 980.17 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.86 258.02 368.58 411.79 427.17 969.93 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.77 262.64 374.39 419.85 430.06 958.02 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.76 267.88 384.75 426.78 431.73 944.60 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.78 276.59 397.71 432.20 432.92 929.62 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.37 289.19 411.84 432.99 437.40 912.94 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.86 305.20 426.14 433.64 441.65 894.36 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.12 324.69 433.47 440.32 447.11 873.74 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.86 346.20 433.36 448.61 459.55 850.96 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.02 367.60 431.85 455.27 477.26 826.01 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.60 386.97 428.83 462.29 499.19 798.96 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.65 403.30 424.34 468.97 525.73 770.03 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.21 416.64 418.54 474.70 555.98 739.69 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.35 411.54 427.44 479.18 587.60 709.22 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.13 403.66 435.67 482.44 614.36 683.97 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.54 395.25 440.90 484.61 614.19 685.62 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.50 386.80 442.30 485.73 587.87 713.62 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.81 378.92 438.77 485.18 557.49 747.15 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.28 372.26 428.87 480.98 531.34 781.14 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.89 367.34 410.91 470.76 514.81 814.23 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.89 364.36 385.02 456.92 506.21 845.76 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.84 353.96 363.64 442.89 499.95 875.28 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.41 321.96 364.23 429.20 493.17 902.38 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.37 290.99 366.48 415.90 484.87 926.72 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.51 263.00 369.97 403.44 474.73 947.92 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.65 239.51 374.17 392.89 462.77 965.62 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 221.47 221.81 377.01 387.07 449.20 979.49 -------------------------------------------------------------------------------- K point *** = 0.265625 0.953125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.13 219.09 375.35 389.76 434.47 989.27 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.00 201.69 379.99 388.24 404.41 1008.10 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.46 202.98 380.58 389.46 395.53 1011.02 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 200.47 208.62 372.12 389.60 401.66 1009.83 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 207.23 217.70 360.58 397.27 408.14 1005.03 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.00 227.86 352.91 406.03 414.33 997.28 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.27 236.99 351.19 414.19 419.95 987.25 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.51 244.52 356.08 421.00 424.63 975.43 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.18 251.90 366.51 426.38 428.13 962.05 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.81 261.31 380.52 430.50 430.54 947.12 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.76 274.49 396.41 432.13 433.72 930.51 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.05 291.43 413.07 433.18 436.63 912.02 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.28 311.56 429.23 433.50 441.03 891.49 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.29 333.41 432.18 440.69 452.83 868.82 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.94 355.06 429.84 447.66 472.16 843.97 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.20 374.69 426.15 454.87 495.38 817.03 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.05 391.31 421.19 462.27 522.37 788.19 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.51 404.89 415.05 469.15 552.45 757.95 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.60 407.85 415.90 474.98 583.65 727.51 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.35 399.85 424.59 479.49 610.93 701.12 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.69 391.36 430.94 482.57 617.78 694.81 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.49 382.87 434.50 484.17 595.72 716.98 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.47 375.01 434.46 484.09 564.13 748.85 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.38 368.43 429.43 481.54 532.86 782.48 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.14 363.63 417.05 474.27 508.54 815.75 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.01 360.80 395.14 461.47 495.12 847.79 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.53 359.81 365.44 447.80 487.05 878.07 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.38 332.22 360.52 434.90 479.42 906.18 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.27 298.94 362.63 422.34 470.62 931.73 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.90 267.81 365.95 410.17 460.20 954.35 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 218.96 240.64 370.28 398.97 448.10 973.66 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.13 219.09 375.35 389.76 434.47 989.27 -------------------------------------------------------------------------------- K point *** = 0.265625 0.984375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 203.51 205.03 380.11 384.48 419.67 1000.83 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.15 211.85 378.25 383.54 434.93 992.30 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 205.73 210.98 378.46 389.57 419.41 997.77 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 207.45 214.54 381.86 395.89 404.91 999.04 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.32 222.38 383.30 394.90 404.13 996.45 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 219.45 232.57 374.49 401.04 410.69 990.59 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.39 242.65 367.60 409.65 417.10 982.14 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.62 250.84 366.50 417.54 422.84 971.71 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.60 257.17 371.73 424.06 427.51 959.71 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.79 263.51 381.95 429.25 430.92 946.29 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.70 272.26 395.20 433.25 433.32 931.40 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.04 284.80 409.86 434.99 436.50 914.86 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.50 301.47 424.87 436.08 439.80 896.47 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.81 321.58 435.90 438.74 445.75 876.03 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.82 343.57 434.74 446.92 459.43 853.42 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.47 365.46 432.12 454.17 477.60 828.62 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.71 385.34 428.16 461.75 499.69 801.69 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.56 402.20 422.93 468.91 526.24 772.82 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.05 416.02 416.52 474.99 556.45 742.49 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.25 409.04 427.18 479.72 588.11 711.94 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.19 400.76 435.70 483.12 615.22 686.32 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.83 392.03 441.15 485.35 616.02 686.94 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.06 383.30 442.70 486.46 589.90 714.67 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.66 375.21 439.28 485.86 559.31 748.30 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.38 368.43 429.43 481.54 532.86 782.48 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.17 363.45 411.42 471.09 516.08 815.79 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.27 360.50 385.23 456.98 507.35 847.57 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.22 353.92 359.55 442.75 501.02 877.34 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.70 321.20 360.26 428.92 494.19 904.71 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 244.42 289.55 362.51 415.53 485.83 929.28 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.10 260.99 366.05 403.00 475.63 950.69 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.43 237.23 370.64 392.18 463.57 968.55 -------------------------------------------------------------------------------- K point *** = 0.296875 0.015625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.01 219.78 375.85 384.29 449.87 982.51 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 205.73 210.98 378.46 389.57 419.41 997.77 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.95 210.44 376.72 393.44 405.13 1005.11 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.33 213.87 377.51 387.34 402.68 1008.20 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.84 220.63 372.28 383.80 408.56 1007.27 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 203.28 229.29 361.27 390.83 414.60 1002.76 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.57 237.92 354.37 399.52 419.97 995.31 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.79 244.96 353.54 408.38 424.24 985.51 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.15 250.45 359.12 416.58 427.21 973.82 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.96 256.27 369.75 423.70 428.90 960.46 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.99 265.32 383.48 429.48 429.82 945.46 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.91 278.87 398.78 429.89 434.57 928.71 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.87 295.58 414.70 430.11 438.77 910.04 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.02 315.23 428.67 432.20 443.35 889.32 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.80 336.62 429.64 442.91 453.44 866.47 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.06 357.78 428.53 449.46 471.95 841.46 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.75 376.85 425.98 456.02 494.87 814.38 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.87 392.87 421.97 462.85 521.80 785.46 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.46 405.88 416.61 469.27 551.90 755.18 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.56 409.90 416.57 474.77 583.09 724.77 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.19 402.46 424.84 479.05 610.16 698.63 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.34 394.40 430.90 482.00 616.25 693.13 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.88 386.26 434.24 483.55 593.79 715.78 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.60 378.67 434.04 483.48 562.31 747.66 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.28 372.26 428.87 480.98 531.34 781.14 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.89 367.55 416.40 473.86 507.36 814.22 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.70 364.71 394.60 461.29 494.16 846.03 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.24 363.21 365.76 447.83 486.19 876.07 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.19 332.55 364.45 435.08 478.61 903.92 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.30 299.92 366.53 422.63 469.86 929.23 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.33 269.42 369.82 410.54 459.50 951.63 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.08 242.69 373.96 399.48 447.48 970.76 -------------------------------------------------------------------------------- K point *** = 0.296875 0.046875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.36 221.13 378.02 391.07 433.97 986.25 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 207.45 214.54 381.86 395.89 404.91 999.04 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 194.33 213.87 377.51 387.34 402.68 1008.20 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 187.12 217.18 372.74 375.59 407.91 1013.30 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.79 223.38 359.29 377.19 413.42 1014.39 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.69 230.87 348.68 382.27 418.33 1011.73 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.85 237.67 342.95 389.89 422.18 1005.80 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.19 242.48 343.57 398.86 424.69 997.13 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.67 245.90 350.37 408.11 425.81 986.14 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.12 250.38 361.66 416.90 425.72 973.12 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.21 259.68 375.55 424.79 424.82 958.17 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.12 275.11 390.75 423.57 431.68 941.25 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.60 293.42 406.53 422.56 437.61 922.30 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.43 313.47 420.03 424.71 443.02 901.25 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.54 334.33 421.02 439.04 450.05 878.06 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.23 354.42 421.06 447.85 465.99 852.77 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.17 372.10 420.56 453.26 489.12 825.47 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.26 386.56 418.95 458.56 516.53 796.43 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.48 398.01 415.91 463.93 546.89 766.13 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.86 406.63 411.93 468.99 578.10 735.74 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.42 404.96 415.14 473.32 605.65 708.99 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.17 398.53 420.54 476.59 616.07 698.84 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.04 391.63 424.12 478.56 598.10 716.38 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.88 385.00 425.25 478.99 567.41 746.20 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.55 379.28 422.89 477.50 534.58 778.74 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.08 374.97 415.10 473.10 505.08 811.30 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.74 372.29 398.95 463.52 485.11 842.82 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.06 370.92 374.01 450.66 474.27 872.76 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.70 342.80 371.90 438.84 465.38 900.70 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.41 310.63 373.79 427.77 455.73 926.32 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.00 279.57 376.82 416.85 444.71 949.28 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.37 251.31 380.54 406.39 432.29 969.28 -------------------------------------------------------------------------------- K point *** = 0.296875 0.078125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 218.30 227.24 383.58 398.06 418.67 985.98 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.32 222.38 383.30 394.90 404.13 996.45 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.84 220.63 372.28 383.80 408.56 1007.27 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 185.79 223.38 359.29 377.19 413.42 1014.39 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 180.41 228.62 347.17 374.87 417.80 1017.71 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 180.80 234.32 338.43 376.59 421.18 1017.30 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 186.53 238.37 335.26 381.85 423.24 1013.41 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.74 240.02 338.59 389.72 423.84 1006.37 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.34 240.76 347.36 399.08 423.07 996.54 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.86 243.56 359.48 408.92 421.24 984.19 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 239.82 252.89 373.26 417.98 419.30 969.51 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.43 270.60 387.67 416.09 427.48 952.56 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.71 291.75 402.13 414.07 435.45 933.37 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.14 314.13 410.75 418.96 442.60 911.96 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.77 336.31 410.51 434.14 449.66 888.38 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.65 356.53 410.57 447.33 461.23 862.70 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.10 373.17 411.14 453.90 482.83 835.08 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.70 385.72 411.75 458.21 510.35 805.79 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.22 394.82 411.78 461.91 541.13 775.31 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.53 401.25 410.93 465.34 572.79 744.75 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.60 404.27 410.49 468.45 601.29 717.22 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.42 402.09 412.71 471.02 615.57 703.27 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.97 397.75 414.90 472.76 602.40 715.92 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.23 392.94 415.60 473.33 573.45 743.63 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.18 388.45 413.90 472.38 540.57 775.18 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.94 384.83 408.41 469.39 508.80 807.10 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.78 382.42 396.76 463.01 482.91 838.15 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.18 376.73 381.40 451.39 467.57 867.74 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.76 349.76 381.72 439.12 457.47 895.47 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.27 319.71 383.33 428.52 447.16 921.04 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.55 289.64 385.97 418.67 435.54 944.18 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.51 261.48 389.04 409.35 422.60 964.64 -------------------------------------------------------------------------------- K point *** = 0.296875 0.109375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.71 236.87 389.85 402.84 408.79 982.15 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 219.45 232.57 374.49 401.04 410.69 990.59 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 203.28 229.29 361.27 390.83 414.60 1002.76 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.69 230.87 348.68 382.27 418.33 1011.73 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 180.80 234.32 338.43 376.59 421.18 1017.30 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 177.41 237.13 332.74 374.56 422.76 1019.34 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 179.78 237.43 333.35 376.47 422.88 1017.83 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 187.59 235.55 340.05 381.99 421.55 1012.87 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 200.05 233.74 350.87 390.25 419.00 1004.63 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.75 234.84 363.73 400.18 415.67 993.36 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 230.38 243.69 377.17 409.66 413.16 979.24 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.41 263.46 390.23 407.98 422.08 962.46 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.20 287.57 400.31 407.69 432.15 943.16 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.61 313.25 400.41 418.03 441.43 921.44 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.82 338.66 399.15 431.42 449.97 897.46 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.89 361.43 398.79 445.79 459.52 871.34 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.03 379.07 399.52 455.90 477.05 843.30 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.66 390.66 401.42 461.00 503.58 813.63 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.33 397.05 404.40 464.07 534.58 782.81 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.77 400.27 407.43 466.04 566.89 751.83 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.79 401.92 409.45 467.30 596.66 723.33 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.27 402.36 410.34 468.11 614.63 705.96 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.20 401.59 410.21 468.48 606.35 713.94 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.58 399.81 408.95 468.28 579.54 739.62 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.51 397.42 406.07 467.19 547.40 770.27 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.14 394.81 400.75 464.81 515.24 801.59 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.74 389.29 394.56 460.38 486.58 832.14 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.72 373.89 392.96 451.68 466.04 861.28 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.63 351.55 392.97 438.17 454.82 888.61 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.20 325.14 394.13 425.37 445.59 913.88 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.28 297.64 396.07 413.95 435.64 936.89 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.82 271.17 396.23 405.21 424.79 957.46 -------------------------------------------------------------------------------- K point *** = 0.296875 0.140625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.19 247.62 387.09 405.58 413.68 975.42 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.39 242.65 367.60 409.65 417.10 982.14 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.57 237.92 354.37 399.52 419.97 995.31 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.85 237.67 342.95 389.89 422.18 1005.80 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 186.53 238.37 335.26 381.85 423.24 1013.41 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 179.78 237.43 333.35 376.47 422.88 1017.83 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 178.42 233.91 337.92 374.66 421.06 1018.82 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.82 229.18 347.52 376.82 417.93 1016.19 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 192.79 225.56 359.89 382.76 413.86 1009.91 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 207.46 225.24 372.96 391.83 409.40 1000.07 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.47 232.80 385.05 401.97 406.54 986.89 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.61 253.83 392.94 403.84 416.56 970.58 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.81 279.99 392.28 411.66 428.90 951.38 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.96 308.43 389.72 421.73 440.46 929.52 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.25 337.41 387.79 432.54 450.86 905.22 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.76 364.37 386.97 444.88 460.64 878.70 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.70 385.65 387.56 457.44 473.80 850.20 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.39 388.94 399.76 464.92 497.18 820.06 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.33 391.62 407.30 468.64 527.63 788.75 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.14 395.00 410.80 470.32 560.44 757.16 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.63 398.55 411.83 470.55 591.58 727.47 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.71 401.56 411.40 469.74 613.12 706.79 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.33 403.05 410.38 468.23 609.81 710.08 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.51 401.96 409.59 466.25 585.21 733.84 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.27 398.25 408.79 463.90 553.98 763.80 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.70 391.97 407.53 461.05 522.17 794.68 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.96 382.26 406.09 457.34 492.75 824.80 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.32 367.95 405.02 451.55 468.59 853.49 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.23 348.77 404.71 439.90 454.11 880.38 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.32 326.08 405.26 424.85 445.94 905.24 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.46 302.03 405.39 411.92 438.11 927.93 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.63 278.48 395.10 410.74 429.51 948.36 -------------------------------------------------------------------------------- K point *** = 0.296875 0.171875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.26 257.20 381.42 413.46 420.16 966.45 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.62 250.84 366.50 417.54 422.84 971.71 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.79 244.96 353.54 408.38 424.24 985.51 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.19 242.48 343.57 398.86 424.69 997.13 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 196.74 240.02 338.59 389.72 423.84 1006.37 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 187.59 235.55 340.05 381.99 421.55 1012.87 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 182.82 229.18 347.52 376.82 417.93 1016.19 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 183.33 222.67 359.14 375.18 413.27 1015.91 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.65 218.03 372.31 378.03 408.07 1011.77 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 201.75 216.81 380.72 389.49 403.16 1003.68 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.67 222.27 386.23 399.63 405.17 991.78 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.62 243.44 386.21 404.58 419.24 976.30 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.27 270.15 382.91 413.71 432.69 957.55 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.08 299.92 379.65 423.77 444.88 935.82 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.19 331.24 377.30 434.06 455.68 911.42 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.71 361.88 376.20 445.09 465.36 884.64 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.86 376.38 388.40 457.63 475.71 855.77 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.93 378.20 406.54 468.27 493.36 825.17 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.33 381.51 416.12 473.64 521.33 793.30 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.69 386.17 419.89 475.88 553.91 760.96 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.81 391.77 420.06 476.12 586.15 729.92 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.74 397.72 417.84 474.81 611.05 705.90 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.56 403.23 414.00 472.24 612.89 704.19 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.34 405.68 410.86 468.72 590.38 726.09 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.09 399.88 413.18 464.57 559.89 755.60 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.80 390.87 415.29 460.13 528.57 786.22 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.47 379.04 416.18 455.60 499.29 816.07 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.16 363.80 416.19 450.73 473.90 844.41 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.04 345.20 415.96 443.17 455.03 870.89 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.50 324.43 415.93 428.77 446.00 895.33 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.25 303.14 411.18 418.20 439.84 917.64 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.30 282.69 396.11 419.08 433.33 937.79 -------------------------------------------------------------------------------- K point *** = 0.296875 0.203125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.40 264.22 380.97 420.92 425.93 955.80 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.60 257.17 371.73 424.06 427.51 959.71 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.15 250.45 359.12 416.58 427.21 973.82 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.67 245.90 350.37 408.11 425.81 986.14 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 210.34 240.76 347.36 399.08 423.07 996.54 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 200.05 233.74 350.87 390.25 419.00 1004.63 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 192.79 225.56 359.89 382.76 413.86 1009.91 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 189.65 218.03 372.31 378.03 408.07 1011.77 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 191.69 212.93 376.11 386.86 402.53 1009.74 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.72 211.42 378.15 393.99 405.05 1003.57 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.45 214.51 380.89 392.62 419.01 993.25 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 220.03 234.50 378.89 398.33 433.02 978.98 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.27 260.04 374.89 408.37 445.89 961.06 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.71 289.55 371.27 419.72 457.27 939.84 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.47 321.57 368.65 431.43 467.12 915.67 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.74 354.13 367.38 443.35 475.66 888.90 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.74 367.38 384.63 456.04 483.92 859.87 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.77 369.28 408.29 468.97 495.70 828.95 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.20 372.94 422.49 477.37 517.84 796.60 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.61 378.31 428.82 480.82 548.33 763.50 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.88 385.03 430.02 481.58 580.81 731.06 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.13 392.52 427.74 480.55 608.57 703.69 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.56 400.13 422.89 478.03 615.87 696.32 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.32 407.20 416.03 474.18 595.29 716.26 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.46 406.66 413.94 469.19 565.12 745.56 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.98 395.70 418.89 463.37 534.10 776.12 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.83 381.91 422.54 457.19 505.23 805.84 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.97 364.98 424.72 451.21 479.98 833.95 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.40 345.28 425.58 445.25 459.15 860.13 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.18 324.24 425.52 435.09 446.22 884.21 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.56 303.75 418.19 426.58 440.63 906.15 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.17 285.25 402.22 426.64 435.86 925.98 -------------------------------------------------------------------------------- K point *** = 0.296875 0.234375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.07 269.24 386.46 427.14 430.47 943.79 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.79 263.51 381.95 429.25 430.92 946.29 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.96 256.27 369.75 423.70 428.90 960.46 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.12 250.38 361.66 416.90 425.72 973.12 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.86 243.56 359.48 408.92 421.24 984.19 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.75 234.84 363.73 400.18 415.67 993.36 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 207.46 225.24 372.96 391.83 409.40 1000.07 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 201.75 216.81 380.72 389.49 403.16 1003.68 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.72 211.42 378.15 393.99 405.05 1003.57 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 202.80 210.04 377.44 388.66 419.57 999.31 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.81 213.16 377.96 385.73 434.67 990.76 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 218.59 228.87 374.21 391.21 448.91 978.02 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.49 251.55 369.57 401.08 461.74 961.32 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.44 279.30 365.64 412.92 472.87 941.02 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.68 310.52 362.81 425.68 482.22 917.50 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.48 343.39 361.37 438.84 489.95 891.12 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.11 361.40 375.64 452.38 496.79 862.27 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.85 363.35 403.54 466.35 504.91 831.31 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.09 367.23 423.40 478.08 519.85 798.70 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.40 373.02 434.42 483.84 545.26 765.01 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.68 380.36 438.64 485.38 576.25 731.33 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.11 388.63 437.95 484.82 605.85 700.77 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.94 397.18 433.57 482.87 619.02 686.79 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.34 405.45 426.30 479.62 600.34 704.39 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.39 413.00 416.61 475.04 569.94 733.68 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.09 404.41 419.65 469.18 538.83 764.32 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.38 389.45 425.07 462.32 510.25 794.01 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.23 371.36 429.18 455.03 485.62 821.99 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.62 350.59 431.89 448.03 465.10 847.96 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.55 328.66 433.11 440.75 448.95 871.77 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.09 307.58 427.23 433.73 441.25 893.41 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.37 289.19 411.84 432.99 437.40 912.94 -------------------------------------------------------------------------------- K point *** = 0.296875 0.265625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.76 274.49 396.41 432.13 433.72 930.51 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.70 272.26 395.20 433.25 433.32 931.40 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.99 265.32 383.48 429.48 429.82 945.46 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.21 259.68 375.55 424.79 424.82 958.17 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 239.82 252.89 373.26 417.98 419.30 969.51 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 230.38 243.69 377.17 409.66 413.16 979.24 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.47 232.80 385.05 401.97 406.54 986.89 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.67 222.27 386.23 399.63 405.17 991.78 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.45 214.51 380.89 392.62 419.01 993.25 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.81 213.16 377.96 385.73 434.67 990.76 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.88 215.88 379.15 379.15 450.21 984.03 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 221.48 227.46 373.13 384.59 464.76 973.01 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.59 246.19 367.88 393.61 477.80 957.87 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 239.67 270.92 363.63 405.19 489.01 938.90 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.11 300.05 360.58 418.36 498.27 916.46 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.22 331.79 358.99 432.36 505.67 890.92 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.31 359.06 364.03 446.82 511.72 862.66 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.65 361.04 394.00 461.57 517.83 832.07 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.64 365.08 418.29 475.32 527.56 799.56 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.86 371.11 434.68 484.15 546.11 765.64 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.24 378.76 443.59 487.00 573.22 731.09 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.96 387.39 446.30 486.68 602.92 697.89 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.25 396.34 443.83 485.13 622.21 676.34 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.28 405.07 437.21 482.79 605.88 690.68 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.10 413.16 427.36 479.40 574.69 720.11 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.70 414.71 420.33 474.65 543.06 750.85 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.01 399.16 426.39 468.47 514.40 780.52 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.99 380.50 431.22 461.14 490.31 808.41 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.59 359.22 434.77 453.44 470.87 834.22 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.80 336.88 436.99 446.17 454.91 857.83 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.68 315.55 436.90 437.91 443.83 879.23 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.33 297.04 423.16 437.55 439.09 898.50 -------------------------------------------------------------------------------- K point *** = 0.296875 0.296875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.92 282.53 408.85 435.97 436.09 915.82 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.04 284.80 409.86 434.99 436.50 914.86 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.91 278.87 398.78 429.89 434.57 928.71 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.12 275.11 390.75 423.57 431.68 941.25 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.43 270.60 387.67 416.09 427.48 952.56 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.41 263.46 390.23 407.98 422.08 962.46 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.61 253.83 392.94 403.84 416.56 970.58 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.62 243.44 386.21 404.58 419.24 976.30 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 220.03 234.50 378.89 398.33 433.02 978.98 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 218.59 228.87 374.21 391.21 448.91 978.02 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 221.48 227.46 373.13 384.59 464.76 973.01 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.98 230.14 373.67 381.24 479.65 963.81 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.01 244.99 370.00 386.90 492.99 950.45 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 244.46 265.99 365.68 397.43 504.44 933.14 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.65 291.92 362.41 410.41 513.82 912.18 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.84 321.24 360.64 424.77 521.17 887.92 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.26 351.95 360.76 439.88 526.85 860.72 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.18 362.48 382.32 455.29 531.82 830.96 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.98 366.64 408.88 470.15 538.39 799.03 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.25 372.80 429.49 481.62 550.85 765.37 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.92 380.59 443.34 486.63 572.24 730.55 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.13 389.35 450.85 486.48 599.74 695.68 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.08 398.45 452.11 484.52 624.37 666.52 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.87 407.31 447.36 482.69 611.91 675.55 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.54 415.52 437.94 480.77 579.51 705.17 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.04 422.72 425.15 477.84 547.10 735.87 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.26 409.23 428.90 473.37 517.98 765.40 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.13 390.36 433.70 467.21 493.98 793.13 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.57 368.99 437.12 459.80 475.57 818.76 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.55 346.70 439.08 452.40 461.20 842.18 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.07 325.61 439.58 445.86 449.05 863.38 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.12 307.70 434.84 439.16 442.94 882.43 -------------------------------------------------------------------------------- K point *** = 0.296875 0.328125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.62 294.40 422.28 437.80 439.24 899.52 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.50 301.47 424.87 436.08 439.80 896.47 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.87 295.58 414.70 430.11 438.77 910.04 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.60 293.42 406.53 422.56 437.61 922.30 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.71 291.75 402.13 414.07 435.45 933.37 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.20 287.57 400.31 407.69 432.15 943.16 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.81 279.99 392.28 411.66 428.90 951.38 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.27 270.15 382.91 413.71 432.69 957.55 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.27 260.04 374.89 408.37 445.89 961.06 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.49 251.55 369.57 401.08 461.74 961.32 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.59 246.19 367.88 393.61 477.80 957.87 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.01 244.99 370.00 386.90 492.99 950.45 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 244.86 250.44 373.50 383.67 506.66 938.98 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.90 266.39 371.61 390.39 518.41 923.56 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.50 288.13 368.28 402.56 528.02 904.42 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.58 313.77 366.21 416.88 535.47 881.83 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.32 341.67 366.11 432.29 541.00 856.15 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.91 365.95 372.26 448.12 545.32 827.71 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.69 371.44 397.71 463.61 549.99 796.89 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.24 377.76 420.48 476.79 558.08 764.07 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.45 385.64 438.02 484.38 573.37 729.70 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.40 394.49 450.13 485.28 596.45 694.39 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.23 403.65 456.59 482.18 623.13 660.02 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.00 412.54 455.74 479.42 617.95 659.76 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.67 420.70 447.48 478.75 584.11 689.43 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.14 427.58 434.88 478.05 551.03 719.68 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.25 418.38 433.99 475.97 521.32 748.76 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.87 399.76 438.29 471.99 496.86 776.12 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.84 378.87 441.03 465.91 478.90 801.46 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.99 357.38 442.05 458.48 466.61 824.65 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.02 337.71 441.46 452.08 456.57 845.64 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.57 322.23 440.01 446.30 447.49 864.49 -------------------------------------------------------------------------------- K point *** = 0.296875 0.359375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.22 310.76 435.56 438.89 443.04 881.36 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.81 321.58 435.90 438.74 445.75 876.03 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.02 315.23 428.67 432.20 443.35 889.32 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.43 313.47 420.03 424.71 443.02 901.25 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.14 314.13 410.75 418.96 442.60 911.96 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.61 313.25 400.41 418.03 441.43 921.44 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.96 308.43 389.72 421.73 440.46 929.52 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.08 299.92 379.65 423.77 444.88 935.82 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.71 289.55 371.27 419.72 457.27 939.84 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.44 279.30 365.64 412.92 472.87 941.02 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 239.67 270.92 363.63 405.19 489.01 938.90 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 244.46 265.99 365.68 397.43 504.44 933.14 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.90 266.39 371.61 390.39 518.41 923.56 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.42 274.90 379.08 386.41 530.46 910.16 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.96 290.96 377.72 395.48 540.34 893.07 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.96 311.72 375.10 409.58 547.97 872.50 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.12 335.44 374.47 425.05 553.52 848.72 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.63 360.19 376.64 441.02 557.48 822.06 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.71 377.57 388.39 456.70 560.98 792.86 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.87 384.96 410.24 470.66 566.15 761.47 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.91 393.11 429.46 480.31 576.25 728.29 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.89 402.17 444.55 483.31 593.60 693.77 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.86 411.51 455.40 480.18 617.29 658.45 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.82 420.49 460.83 474.49 622.73 644.92 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.66 428.56 455.41 473.78 587.90 673.77 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.18 434.45 443.72 475.60 554.73 702.72 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.12 425.53 442.39 476.17 524.73 730.81 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.18 408.04 445.66 474.99 499.63 757.45 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.98 388.77 447.10 471.72 481.13 782.29 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.93 369.82 446.18 465.01 470.95 805.11 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.50 353.75 443.43 457.99 464.69 825.84 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.99 341.28 440.60 452.15 458.21 844.48 -------------------------------------------------------------------------------- K point *** = 0.296875 0.390625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.60 330.77 438.61 445.80 451.49 861.15 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.82 343.57 434.74 446.92 459.43 853.42 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.80 336.62 429.64 442.91 453.44 866.47 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.54 334.33 421.02 439.04 450.05 878.06 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.77 336.31 410.51 434.14 449.66 888.38 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.82 338.66 399.15 431.42 449.97 897.46 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.25 337.41 387.79 432.54 450.86 905.22 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.19 331.24 377.30 434.06 455.68 911.42 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.47 321.57 368.65 431.43 467.12 915.67 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.68 310.52 362.81 425.68 482.22 917.50 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.11 300.05 360.58 418.36 498.27 916.46 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.65 291.92 362.41 410.41 513.82 912.18 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.50 288.13 368.28 402.56 528.02 904.42 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.96 290.96 377.72 395.48 540.34 893.07 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.26 301.19 389.40 390.34 550.48 878.17 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.76 316.72 385.85 404.28 558.33 859.84 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.04 335.53 384.30 419.69 563.98 838.31 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.50 356.23 385.50 435.50 567.81 813.83 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.21 376.96 390.19 450.90 570.62 786.70 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.41 391.95 402.58 464.77 573.95 757.28 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.73 401.47 420.48 475.26 580.20 725.95 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.10 411.11 436.51 480.16 591.92 693.18 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.53 420.93 449.44 478.66 609.64 659.69 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.94 430.24 459.20 472.00 621.56 636.42 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.12 438.17 461.23 467.03 590.35 659.37 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.71 441.15 452.46 471.54 558.22 685.65 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.25 430.45 453.38 474.50 528.77 711.93 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.06 415.16 455.21 476.04 503.80 737.31 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.29 399.45 454.15 476.38 485.10 761.29 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.24 385.27 449.77 472.79 475.97 783.54 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.02 373.41 444.18 465.38 473.80 803.89 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.63 362.89 439.80 459.12 470.32 822.28 -------------------------------------------------------------------------------- K point *** = 0.296875 0.421875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.64 352.86 437.10 452.85 465.42 838.75 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.47 365.46 432.12 454.17 477.60 828.62 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.06 357.78 428.53 449.46 471.95 841.46 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.23 354.42 421.06 447.85 465.99 852.77 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.65 356.53 410.57 447.33 461.23 862.70 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.89 361.43 398.79 445.79 459.52 871.34 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.76 364.37 386.97 444.88 460.64 878.70 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.71 361.88 376.20 445.09 465.36 884.64 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.74 354.13 367.38 443.35 475.66 888.90 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.48 343.39 361.37 438.84 489.95 891.12 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.22 331.79 358.99 432.36 505.67 890.92 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.84 321.24 360.64 424.77 521.17 887.92 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.58 313.77 366.21 416.88 535.47 881.83 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.96 311.72 375.10 409.58 547.97 872.50 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.76 316.72 385.85 404.28 558.33 859.84 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.94 327.66 392.58 406.66 566.40 843.92 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.05 342.24 392.46 419.25 572.22 824.87 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.38 358.83 393.22 433.97 576.07 802.88 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.22 376.32 396.74 448.40 578.58 778.23 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.53 393.51 403.57 461.30 580.87 751.22 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.50 407.86 414.95 471.23 584.66 722.27 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.74 419.16 429.33 476.58 591.94 691.91 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.06 429.88 442.48 476.45 603.58 661.17 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.29 439.77 453.15 471.50 613.13 636.88 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 370.05 447.05 460.69 464.71 591.63 647.45 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.74 444.74 461.75 467.51 562.28 669.24 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.41 433.89 464.42 471.75 534.94 692.61 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.77 422.16 464.03 475.14 512.46 716.01 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.88 411.81 459.04 476.67 497.72 738.64 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.72 402.86 450.82 475.31 491.04 760.00 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.07 394.09 442.95 471.61 488.23 779.80 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.66 384.78 437.43 466.53 485.71 797.86 -------------------------------------------------------------------------------- K point *** = 0.296875 0.453125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.29 374.99 434.22 460.48 482.25 814.12 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.71 385.34 428.16 461.75 499.69 801.69 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.75 376.85 425.98 456.02 494.87 814.38 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.17 372.10 420.56 453.26 489.12 825.47 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.10 373.17 411.14 453.90 482.83 835.08 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.03 379.07 399.52 455.90 477.05 843.30 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.70 385.65 387.56 457.44 473.80 850.20 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.86 376.38 388.40 457.63 475.71 855.77 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.74 367.38 384.63 456.04 483.92 859.87 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.11 361.40 375.64 452.38 496.79 862.27 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.31 359.06 364.03 446.82 511.72 862.66 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.26 351.95 360.76 439.88 526.85 860.72 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.32 341.67 366.11 432.29 541.00 856.15 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.12 335.44 374.47 425.05 553.52 848.72 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.04 335.53 384.30 419.69 563.98 838.31 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.05 342.24 392.46 419.25 572.22 824.87 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.08 353.47 395.82 426.63 578.24 808.45 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.60 367.06 397.31 438.58 582.27 789.20 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.76 381.60 400.41 451.16 584.82 767.32 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.88 396.23 406.34 462.35 586.74 743.10 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.92 410.35 415.21 470.66 589.30 716.93 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.01 423.37 426.47 474.90 593.85 689.38 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.51 434.63 439.08 474.51 601.04 661.56 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.94 443.85 451.28 470.13 607.21 638.18 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 378.62 449.23 461.46 464.78 593.57 638.51 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 384.44 445.71 464.59 469.05 568.82 654.27 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 385.65 437.54 468.23 472.02 545.90 673.56 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 380.56 430.63 468.36 472.37 528.75 694.03 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.75 425.48 459.94 474.66 518.67 714.64 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.99 420.26 449.17 475.84 513.31 734.69 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.08 413.50 439.86 475.29 509.84 753.68 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.14 404.94 433.54 472.63 506.82 771.29 -------------------------------------------------------------------------------- K point *** = 0.296875 0.484375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.54 395.21 429.99 467.88 503.59 787.32 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.56 402.20 422.93 468.91 526.24 772.82 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.87 392.87 421.97 462.85 521.80 785.46 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.26 386.56 418.95 458.56 516.53 796.43 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.70 385.72 411.75 458.21 510.35 805.79 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.66 390.66 401.42 461.00 503.58 813.63 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.39 388.94 399.76 464.92 497.18 820.06 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.93 378.20 406.54 468.27 493.36 825.17 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.77 369.28 408.29 468.97 495.70 828.95 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.85 363.35 403.54 466.35 504.91 831.31 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.65 361.04 394.00 461.57 517.83 832.07 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.18 362.48 382.32 455.29 531.82 830.96 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.91 365.95 372.26 448.12 545.32 827.71 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.63 360.19 376.64 441.02 557.48 822.06 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.50 356.23 385.50 435.50 567.81 813.83 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.38 358.83 393.22 433.97 576.07 802.88 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.60 367.06 397.31 438.58 582.27 789.20 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.44 378.50 398.96 447.85 586.60 772.84 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.22 391.18 401.27 458.35 589.51 753.95 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.02 402.94 407.02 467.63 591.72 732.78 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.18 411.86 418.10 474.04 594.16 709.68 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.73 422.16 429.61 476.58 597.72 685.21 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.63 433.77 440.40 474.99 602.73 660.35 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.94 443.85 451.28 470.13 607.21 638.18 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 380.50 449.45 460.66 465.75 599.18 631.85 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 387.48 447.78 462.06 470.99 580.11 641.44 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 388.25 443.20 464.81 472.82 563.22 655.66 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 381.55 440.63 467.70 468.13 551.90 672.11 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.64 438.57 457.87 471.49 545.33 689.80 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.76 435.02 446.44 474.80 541.07 707.92 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.33 429.71 435.94 476.94 537.42 725.77 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.16 422.24 428.30 476.86 533.82 742.78 -------------------------------------------------------------------------------- K point *** = 0.296875 0.515625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.42 412.48 424.47 474.08 530.14 758.55 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.05 416.02 416.52 474.99 556.45 742.49 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.46 405.88 416.61 469.27 551.90 755.18 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.48 398.01 415.91 463.93 546.89 766.13 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.22 394.82 411.78 461.91 541.13 775.31 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.33 397.05 404.40 464.07 534.58 782.81 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.33 391.62 407.30 468.64 527.63 788.75 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.33 381.51 416.12 473.64 521.33 793.30 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.20 372.94 422.49 477.37 517.84 796.60 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.09 367.23 423.40 478.08 519.85 798.70 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.64 365.08 418.29 475.32 527.56 799.56 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.98 366.64 408.88 470.15 538.39 799.03 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.69 371.44 397.71 463.61 549.99 796.89 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.71 377.57 388.39 456.70 560.98 792.86 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.21 376.96 390.19 450.90 570.62 786.70 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.22 376.32 396.74 448.40 578.58 778.23 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.76 381.60 400.41 451.16 584.82 767.32 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.22 391.18 401.27 458.35 589.51 753.95 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.87 401.82 402.83 466.97 593.09 738.21 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.81 404.14 414.99 474.38 596.18 720.27 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.07 409.20 426.73 478.90 599.49 700.47 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.97 417.26 437.40 479.68 603.51 679.29 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.46 427.85 446.45 476.81 608.33 657.53 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.29 439.77 453.15 471.50 613.13 636.88 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.88 450.92 455.23 467.42 610.18 626.41 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 382.90 451.33 459.07 467.82 596.00 631.64 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 384.29 448.71 462.80 467.47 584.95 640.41 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 377.97 448.71 463.29 464.49 578.77 651.52 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.63 444.90 458.78 466.94 575.44 664.97 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.54 436.43 453.17 472.17 572.62 680.25 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.04 427.91 445.83 476.94 569.23 696.48 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.82 421.47 436.87 479.39 565.19 712.72 -------------------------------------------------------------------------------- K point *** = 0.296875 0.546875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.01 417.76 426.71 478.73 560.85 728.23 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.25 409.04 427.18 479.72 588.11 711.94 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.56 409.90 416.57 474.77 583.09 724.77 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.86 406.63 411.93 468.99 578.10 735.74 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.53 401.25 410.93 465.34 572.79 744.75 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.77 400.27 407.43 466.04 566.89 751.83 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.14 395.00 410.80 470.32 560.44 757.16 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.69 386.17 419.89 475.88 553.91 760.96 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.61 378.31 428.82 480.82 548.33 763.50 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.40 373.02 434.42 483.84 545.26 765.01 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.86 371.11 434.68 484.15 546.11 765.64 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.25 372.80 429.49 481.62 550.85 765.37 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.24 377.76 420.48 476.79 558.08 764.07 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.87 384.96 410.24 470.66 566.15 761.47 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.41 391.95 402.58 464.77 573.95 757.28 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.53 393.51 403.57 461.30 580.87 751.22 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.88 396.23 406.34 462.35 586.74 743.10 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.02 402.94 407.02 467.63 591.72 732.78 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.81 404.14 414.99 474.38 596.18 720.27 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.31 404.16 426.19 479.87 600.66 705.71 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.36 406.50 437.19 482.43 605.55 689.39 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.91 411.80 447.03 481.46 610.94 671.81 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.18 419.96 454.86 477.37 616.49 653.72 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.94 430.24 459.20 472.00 621.56 636.42 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 364.44 441.06 457.20 469.39 619.67 627.52 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.20 447.76 454.74 468.20 609.13 630.52 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.01 447.00 457.65 466.77 603.94 633.29 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 371.37 446.87 455.90 467.77 604.16 636.43 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.53 439.48 460.36 467.57 606.33 642.19 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.73 429.43 462.06 470.00 606.35 652.54 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.41 420.40 456.27 476.39 603.44 666.57 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.25 413.76 447.95 480.78 598.74 682.09 -------------------------------------------------------------------------------- K point *** = 0.296875 0.578125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.37 410.01 438.01 481.96 593.40 697.53 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.19 400.76 435.70 483.12 615.22 686.32 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.19 402.46 424.84 479.05 610.16 698.63 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.42 404.96 415.14 473.32 605.65 708.99 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.60 404.27 410.49 468.45 601.29 717.22 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.79 401.92 409.45 467.30 596.66 723.33 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.63 398.55 411.83 470.55 591.58 727.47 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.81 391.77 420.06 476.12 586.15 729.92 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.88 385.03 430.02 481.58 580.81 731.06 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.68 380.36 438.64 485.38 576.25 731.33 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.24 378.76 443.59 487.00 573.22 731.09 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.92 380.59 443.34 486.63 572.24 730.55 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.45 385.64 438.02 484.38 573.37 729.70 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.91 393.11 429.46 480.31 576.25 728.29 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.73 401.47 420.48 475.26 580.20 725.95 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.50 407.86 414.95 471.23 584.66 722.27 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.92 410.35 415.21 470.66 589.30 716.93 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.18 411.86 418.10 474.04 594.16 709.68 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.07 409.20 426.73 478.90 599.49 700.47 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.36 406.50 437.19 482.43 605.55 689.39 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.75 405.77 447.49 483.11 612.26 676.82 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.88 407.85 456.32 480.70 618.98 663.50 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.54 412.91 462.03 476.47 623.94 651.26 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.82 420.49 460.83 474.49 622.73 644.92 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.11 429.45 453.85 474.66 614.89 645.75 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.00 437.28 447.23 473.62 607.59 647.84 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.29 439.62 445.55 472.46 604.51 648.74 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.80 438.25 445.89 473.52 606.88 647.88 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.89 430.57 451.36 475.28 614.44 645.29 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.64 420.77 457.50 476.39 625.47 641.67 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.61 411.83 458.92 478.70 631.78 643.99 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.54 405.17 454.26 482.25 627.05 657.65 -------------------------------------------------------------------------------- K point *** = 0.296875 0.609375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.56 401.47 445.93 484.21 620.96 672.42 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.83 392.03 441.15 485.35 616.02 686.94 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.34 394.40 430.90 482.00 616.25 693.13 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.17 398.53 420.54 476.59 616.07 698.84 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.42 402.09 412.71 471.02 615.57 703.27 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.27 402.36 410.34 468.11 614.63 705.96 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.71 401.56 411.40 469.74 613.12 706.79 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.74 397.72 417.84 474.81 611.05 705.90 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.13 392.52 427.74 480.55 608.57 703.69 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.11 388.63 437.95 484.82 605.85 700.77 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.96 387.39 446.30 486.68 602.92 697.89 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.13 389.35 450.85 486.48 599.74 695.68 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.40 394.49 450.13 485.28 596.45 694.39 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.89 402.17 444.55 483.31 593.60 693.77 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.10 411.11 436.51 480.16 591.92 693.18 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.74 419.16 429.33 476.58 591.94 691.91 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.01 423.37 426.47 474.90 593.85 689.38 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.73 422.16 429.61 476.58 597.72 685.21 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.97 417.26 437.40 479.68 603.51 679.29 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.91 411.80 447.03 481.46 610.94 671.81 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.88 407.85 456.32 480.70 618.98 663.50 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.22 406.50 462.99 478.17 625.16 656.46 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.38 408.13 462.75 477.74 624.84 655.15 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.00 412.54 455.74 479.42 617.95 659.76 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.90 418.89 446.63 479.47 609.60 665.71 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.99 425.45 438.18 477.49 602.62 670.77 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.26 429.28 433.20 475.43 598.23 674.27 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.90 427.61 433.75 475.94 596.84 676.10 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.07 420.56 439.55 478.71 598.40 676.56 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.48 411.37 447.18 481.40 602.32 676.28 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.75 402.69 452.95 483.18 607.39 676.28 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.74 396.11 453.89 484.80 611.95 677.76 -------------------------------------------------------------------------------- K point *** = 0.296875 0.640625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.58 392.48 449.43 486.02 614.83 681.43 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.06 383.30 442.70 486.46 589.90 714.67 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.88 386.26 434.24 483.55 593.79 715.78 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.04 391.63 424.12 478.56 598.10 716.38 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.97 397.75 414.90 472.76 602.40 715.92 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.20 401.59 410.21 468.48 606.35 713.94 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.33 403.05 410.38 468.23 609.81 710.08 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.56 403.23 414.00 472.24 612.89 704.19 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.56 400.13 422.89 478.03 615.87 696.32 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.94 397.18 433.57 482.87 619.02 686.79 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.25 396.34 443.83 485.13 622.21 676.34 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.08 398.45 452.11 484.52 624.37 666.52 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.23 403.65 456.59 482.18 623.13 660.02 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.86 411.51 455.40 480.18 617.29 658.45 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.53 420.93 449.44 478.66 609.64 659.69 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.06 429.88 442.48 476.45 603.58 661.17 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.51 434.63 439.08 474.51 601.04 661.56 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.63 433.77 440.40 474.99 602.73 660.35 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.46 427.85 446.45 476.81 608.33 657.53 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.18 419.96 454.86 477.37 616.49 653.72 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.54 412.91 462.03 476.47 623.94 651.26 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.38 408.13 462.75 477.74 624.84 655.15 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.73 406.25 456.52 481.13 619.34 664.76 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.87 407.31 447.36 482.69 611.91 675.55 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.26 410.69 437.19 481.37 604.66 685.56 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.40 415.02 427.69 477.82 598.42 694.02 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.69 417.53 421.49 474.21 593.37 700.65 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.03 415.87 420.67 473.47 589.38 705.46 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.28 410.29 425.00 476.36 586.38 708.63 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.34 401.88 433.18 480.70 584.47 710.54 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.87 393.53 441.51 484.32 583.87 711.67 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.80 387.07 446.94 486.44 584.68 712.54 -------------------------------------------------------------------------------- K point *** = 0.296875 0.671875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.34 383.52 447.42 487.21 586.77 713.51 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.66 375.21 439.28 485.86 559.31 748.30 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.60 378.67 434.04 483.48 562.31 747.66 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.88 385.00 425.25 478.99 567.41 746.20 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.23 392.94 415.60 473.33 573.45 743.63 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.58 399.81 408.95 468.28 579.54 739.62 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.51 401.96 409.59 466.25 585.21 733.84 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.34 405.68 410.86 468.72 590.38 726.09 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.32 407.20 416.03 474.18 595.29 716.26 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.34 405.45 426.30 479.62 600.34 704.39 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.28 405.07 437.21 482.79 605.88 690.68 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.87 407.31 447.36 482.69 611.91 675.55 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.00 412.54 455.74 479.42 617.95 659.76 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.82 420.49 460.83 474.49 622.73 644.92 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.94 430.24 459.20 472.00 621.56 636.42 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.29 439.77 453.15 471.50 613.13 636.88 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.94 443.85 451.28 470.13 607.21 638.18 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.94 443.85 451.28 470.13 607.21 638.18 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.29 439.77 453.15 471.50 613.13 636.88 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.94 430.24 459.20 472.00 621.56 636.42 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.82 420.49 460.83 474.49 622.73 644.92 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.00 412.54 455.74 479.42 617.95 659.76 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.87 407.31 447.36 482.69 611.91 675.55 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.28 405.07 437.21 482.79 605.88 690.68 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.34 405.45 426.30 479.62 600.34 704.39 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.32 407.20 416.03 474.18 595.29 716.26 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.34 405.68 410.86 468.72 590.38 726.09 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.51 401.96 409.59 466.25 585.21 733.84 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.58 399.81 408.95 468.28 579.54 739.62 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.23 392.94 415.60 473.33 573.45 743.63 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.88 385.00 425.25 478.99 567.41 746.20 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.60 378.67 434.04 483.48 562.31 747.66 -------------------------------------------------------------------------------- K point *** = 0.296875 0.703125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.66 375.21 439.28 485.86 559.31 748.30 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.38 368.43 429.43 481.54 532.86 782.48 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.28 372.26 428.87 480.98 531.34 781.14 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.55 379.28 422.89 477.50 534.58 778.74 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.18 388.45 413.90 472.38 540.57 775.18 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.51 397.42 406.07 467.19 547.40 770.27 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.27 398.25 408.79 463.90 553.98 763.80 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.09 399.88 413.18 464.57 559.89 755.60 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.46 406.66 413.94 469.19 565.12 745.56 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.39 413.00 416.61 475.04 569.94 733.68 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.10 413.16 427.36 479.40 574.69 720.11 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.54 415.52 437.94 480.77 579.51 705.17 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.67 420.70 447.48 478.75 584.11 689.43 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.66 428.56 455.41 473.78 587.90 673.77 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.12 438.17 461.23 467.03 590.35 659.37 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 370.05 447.05 460.69 464.71 591.63 647.45 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 378.62 449.23 461.46 464.78 593.57 638.51 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 380.50 449.45 460.66 465.75 599.18 631.85 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.88 450.92 455.23 467.42 610.18 626.41 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 364.44 441.06 457.20 469.39 619.67 627.52 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.11 429.45 453.85 474.66 614.89 645.75 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.90 418.89 446.63 479.47 609.60 665.71 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.26 410.69 437.19 481.37 604.66 685.56 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.34 405.45 426.30 479.62 600.34 704.39 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.84 403.07 414.67 474.46 596.52 721.62 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.77 401.84 404.14 467.11 592.72 736.84 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.16 392.77 403.44 459.76 588.35 749.84 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.83 386.30 401.78 455.42 582.90 760.53 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.06 385.19 397.06 456.11 576.06 768.90 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.09 384.47 395.74 460.86 567.78 775.08 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.69 377.72 404.31 467.37 558.33 779.27 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.96 371.58 415.05 473.79 548.38 781.73 -------------------------------------------------------------------------------- K point *** = 0.296875 0.734375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.31 368.23 424.28 478.87 539.21 782.72 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.17 363.45 411.42 471.09 516.08 815.79 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.89 367.55 416.40 473.86 507.36 814.22 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.08 374.97 415.10 473.10 505.08 811.30 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.94 384.83 408.41 469.39 508.80 807.10 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.14 394.81 400.75 464.81 515.24 801.59 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.70 391.97 407.53 461.05 522.17 794.68 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.80 390.87 415.29 460.13 528.57 786.22 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.98 395.70 418.89 463.37 534.10 776.12 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.09 404.41 419.65 469.18 538.83 764.32 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.70 414.71 420.33 474.65 543.06 750.85 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.04 422.72 425.15 477.84 547.10 735.87 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.14 427.58 434.88 478.05 551.03 719.68 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.18 434.45 443.72 475.60 554.73 702.72 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.71 441.15 452.46 471.54 558.22 685.65 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.74 444.74 461.75 467.51 562.28 669.24 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 384.44 445.71 464.59 469.05 568.82 654.27 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 387.48 447.78 462.06 470.99 580.11 641.44 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 382.90 451.33 459.07 467.82 596.00 631.64 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.20 447.76 454.74 468.20 609.13 630.52 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.00 437.28 447.23 473.62 607.59 647.84 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.99 425.45 438.18 477.49 602.62 670.77 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.40 415.02 427.69 477.82 598.42 694.02 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.32 407.20 416.03 474.18 595.29 716.26 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.77 401.84 404.14 467.11 592.72 736.84 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.41 390.75 400.44 457.91 589.92 755.33 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.15 379.21 399.36 448.66 586.13 771.45 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.83 370.27 397.04 442.39 580.80 785.04 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.09 366.32 391.25 441.68 573.60 796.04 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.04 368.70 383.25 445.84 564.45 804.47 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.31 371.38 380.51 452.41 553.50 810.45 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.86 366.31 390.39 459.53 541.15 814.16 -------------------------------------------------------------------------------- K point *** = 0.296875 0.765625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.22 363.10 401.88 466.02 528.19 815.85 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.27 360.50 385.23 456.98 507.35 847.57 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.70 364.71 394.60 461.29 494.16 846.03 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.74 372.29 398.95 463.52 485.11 842.82 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.78 382.42 396.76 463.01 482.91 838.15 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.74 389.29 394.56 460.38 486.58 832.14 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.96 382.26 406.09 457.34 492.75 824.80 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.47 379.04 416.18 455.60 499.29 816.07 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.83 381.91 422.54 457.19 505.23 805.84 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.38 389.45 425.07 462.32 510.25 794.01 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.01 399.16 426.39 468.47 514.40 780.52 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.26 409.23 428.90 473.37 517.98 765.40 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.25 418.38 433.99 475.97 521.32 748.76 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.12 425.53 442.39 476.17 524.73 730.81 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.25 430.45 453.38 474.50 528.77 711.93 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.41 433.89 464.42 471.75 534.94 692.61 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 385.65 437.54 468.23 472.02 545.90 673.56 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 388.25 443.20 464.81 472.82 563.22 655.66 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 384.29 448.71 462.80 467.47 584.95 640.41 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.01 447.00 457.65 466.77 603.94 633.29 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.29 439.62 445.55 472.46 604.51 648.74 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.26 429.28 433.20 475.43 598.23 674.27 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.69 417.53 421.49 474.21 593.37 700.65 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.34 405.68 410.86 468.72 590.38 726.09 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.16 392.77 403.44 459.76 588.35 749.84 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.15 379.21 399.36 448.66 586.13 771.45 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.00 366.07 397.41 437.27 582.78 790.60 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.55 354.74 395.04 428.61 577.68 807.05 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.44 347.26 388.94 426.32 570.50 820.68 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.49 345.95 379.79 429.95 561.13 831.43 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.04 351.21 370.82 436.50 549.67 839.33 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.55 360.33 364.76 443.93 536.44 844.51 -------------------------------------------------------------------------------- K point *** = 0.296875 0.796875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.65 360.05 373.51 451.02 522.00 847.16 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.22 353.92 359.55 442.75 501.02 877.34 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.24 363.21 365.76 447.83 486.19 876.07 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.06 370.92 374.01 450.66 474.27 872.76 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.18 376.73 381.40 451.39 467.57 867.74 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.72 373.89 392.96 451.68 466.04 861.28 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.32 367.95 405.02 451.55 468.59 853.49 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.16 363.80 416.19 450.73 473.90 844.41 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.97 364.98 424.72 451.21 479.98 833.95 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.23 371.36 429.18 455.03 485.62 821.99 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.99 380.50 431.22 461.14 490.31 808.41 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.13 390.36 433.70 467.21 493.98 793.13 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.87 399.76 438.29 471.99 496.86 776.12 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.18 408.04 445.66 474.99 499.63 757.45 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.06 415.16 455.21 476.04 503.80 737.31 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.77 422.16 464.03 475.14 512.46 716.01 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 380.56 430.63 468.36 472.37 528.75 694.03 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 381.55 440.63 467.70 468.13 551.90 672.11 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 377.97 448.71 463.29 464.49 578.77 651.52 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 371.37 446.87 455.90 467.77 604.16 636.43 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.80 438.25 445.89 473.52 606.88 647.88 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.90 427.61 433.75 475.94 596.84 676.10 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.03 415.87 420.67 473.47 589.38 705.46 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.51 401.96 409.59 466.25 585.21 733.84 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.83 386.30 401.78 455.42 582.90 760.53 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.83 370.27 397.04 442.39 580.80 785.04 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.55 354.74 395.04 428.61 577.68 807.05 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.72 340.67 394.20 416.32 572.81 826.28 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.11 329.56 389.44 411.01 565.79 842.51 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.20 323.67 379.57 414.15 556.48 855.62 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.46 324.69 369.86 420.72 544.96 865.57 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.55 331.63 362.70 428.38 531.49 872.38 -------------------------------------------------------------------------------- K point *** = 0.296875 0.828125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.12 342.12 359.10 436.02 516.58 876.22 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.70 321.20 360.26 428.92 494.19 904.71 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.19 332.55 364.45 435.08 478.61 903.92 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.70 342.80 371.90 438.84 465.38 900.70 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.76 349.76 381.72 439.12 457.47 895.47 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.63 351.55 392.97 438.17 454.82 888.61 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.23 348.77 404.71 439.90 454.11 880.38 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.04 345.20 415.96 443.17 455.03 870.89 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.40 345.28 425.58 445.25 459.15 860.13 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.62 350.59 431.89 448.03 465.10 847.96 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.59 359.22 434.77 453.44 470.87 834.22 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.57 368.99 437.12 459.80 475.57 818.76 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.84 378.87 441.03 465.91 478.90 801.46 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.98 388.77 447.10 471.72 481.13 782.29 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.29 399.45 454.15 476.38 485.10 761.29 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.88 411.81 459.04 476.67 497.72 738.64 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.75 425.48 459.94 474.66 518.67 714.64 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.64 438.57 457.87 471.49 545.33 689.80 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.63 444.90 458.78 466.94 575.44 664.97 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.53 439.48 460.36 467.57 606.33 642.19 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.89 430.57 451.36 475.28 614.44 645.29 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.07 420.56 439.55 478.71 598.40 676.56 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.28 410.29 425.00 476.36 586.38 708.63 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.58 399.81 408.95 468.28 579.54 739.62 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.06 385.19 397.06 456.11 576.06 768.90 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.09 366.32 391.25 441.68 573.60 796.04 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.44 347.26 388.94 426.32 570.50 820.68 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.11 329.56 389.44 411.01 565.79 842.51 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.77 314.47 390.97 397.94 558.96 861.26 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.03 303.80 381.79 399.21 549.85 876.74 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.37 299.82 371.24 405.77 538.47 888.80 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.59 302.80 363.70 413.47 525.07 897.41 -------------------------------------------------------------------------------- K point *** = 0.296875 0.859375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.31 310.66 359.94 421.44 510.07 902.64 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 244.42 289.55 362.51 415.53 485.83 929.28 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.30 299.92 366.53 422.63 469.86 929.23 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.41 310.63 373.79 427.77 455.73 926.32 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.27 319.71 383.33 428.52 447.16 921.04 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.20 325.14 394.13 425.37 445.59 913.88 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.32 326.08 405.26 424.85 445.94 905.24 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.50 324.43 415.93 428.77 446.00 895.33 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.18 324.24 425.52 435.09 446.22 884.21 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.55 328.66 433.11 440.75 448.95 871.77 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.80 336.88 436.99 446.17 454.91 857.83 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.55 346.70 439.08 452.40 461.20 842.18 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.99 357.38 442.05 458.48 466.61 824.65 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.93 369.82 446.18 465.01 470.95 805.11 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.24 385.27 449.77 472.79 475.97 783.54 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.72 402.86 450.82 475.31 491.04 760.00 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.99 420.26 449.17 475.84 513.31 734.69 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.76 435.02 446.44 474.80 541.07 707.92 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.54 436.43 453.17 472.17 572.62 680.25 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.73 429.43 462.06 470.00 606.35 652.54 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.64 420.77 457.50 476.39 625.47 641.67 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.48 411.37 447.18 481.40 602.32 676.28 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.34 401.88 433.18 480.70 584.47 710.54 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.23 392.94 415.60 473.33 573.45 743.63 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.09 384.47 395.74 460.86 567.78 775.08 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.04 368.70 383.25 445.84 564.45 804.47 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.49 345.95 379.79 429.95 561.13 831.43 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.20 323.67 379.57 414.15 556.48 855.62 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.03 303.80 381.79 399.21 549.85 876.74 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.46 287.94 384.02 387.88 540.97 894.51 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.57 278.41 374.19 392.66 529.84 908.71 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.47 276.80 366.39 399.81 516.65 919.23 -------------------------------------------------------------------------------- K point *** = 0.296875 0.890625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.94 281.26 362.39 407.66 501.77 926.04 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.10 260.99 366.05 403.00 475.63 950.69 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.33 269.42 369.82 410.54 459.50 951.63 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.00 279.57 376.82 416.85 444.71 949.28 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.55 289.64 385.97 418.67 435.54 944.18 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.28 297.64 396.07 413.95 435.64 936.89 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.46 302.03 405.39 411.92 438.11 927.93 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.25 303.14 411.18 418.20 439.84 917.64 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.56 303.75 418.19 426.58 440.63 906.15 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.09 307.58 427.23 433.73 441.25 893.41 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.68 315.55 436.90 437.91 443.83 879.23 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.07 325.61 439.58 445.86 449.05 863.38 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.02 337.71 441.46 452.08 456.57 845.64 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.50 353.75 443.43 457.99 464.69 825.84 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.02 373.41 444.18 465.38 473.80 803.89 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.07 394.09 442.95 471.61 488.23 779.80 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.08 413.50 439.86 475.29 509.84 753.68 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.33 429.71 435.94 476.94 537.42 725.77 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.04 427.91 445.83 476.94 569.23 696.48 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.41 420.40 456.27 476.39 603.44 666.57 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.61 411.83 458.92 478.70 631.78 643.99 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.75 402.69 452.95 483.18 607.39 676.28 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.87 393.53 441.51 484.32 583.87 711.67 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.88 385.00 425.25 478.99 567.41 746.20 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.69 377.72 404.31 467.37 558.33 779.27 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.31 371.38 380.51 452.41 553.50 810.45 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.04 351.21 370.82 436.50 549.67 839.33 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.46 324.69 369.86 420.72 544.96 865.57 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.37 299.82 371.24 405.77 538.47 888.80 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.57 278.41 374.19 392.66 529.84 908.71 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.20 262.32 375.56 385.00 519.00 925.02 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.99 255.18 370.19 388.50 506.10 937.51 -------------------------------------------------------------------------------- K point *** = 0.296875 0.921875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.72 255.78 366.19 395.37 491.46 946.05 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.43 237.23 370.64 392.18 463.57 968.55 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.08 242.69 373.96 399.48 447.48 970.76 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.37 251.31 380.54 406.39 432.29 969.28 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.51 261.48 389.04 409.35 422.60 964.64 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.82 271.17 396.23 405.21 424.79 957.46 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.63 278.48 395.10 410.74 429.51 948.36 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.30 282.69 396.11 419.08 433.33 937.79 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.17 285.25 402.22 426.64 435.86 925.98 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.37 289.19 411.84 432.99 437.40 912.94 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.33 297.04 423.16 437.55 439.09 898.50 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.12 307.70 434.84 439.16 442.94 882.43 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.57 322.23 440.01 446.30 447.49 864.49 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.99 341.28 440.60 452.15 458.21 844.48 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.63 362.89 439.80 459.12 470.32 822.28 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.66 384.78 437.43 466.53 485.71 797.86 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.14 404.94 433.54 472.63 506.82 771.29 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.16 422.24 428.30 476.86 533.82 742.78 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.82 421.47 436.87 479.39 565.19 712.72 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.25 413.76 447.95 480.78 598.74 682.09 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.54 405.17 454.26 482.25 627.05 657.65 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.74 396.11 453.89 484.80 611.95 677.76 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.80 387.07 446.94 486.44 584.68 712.54 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.60 378.67 434.04 483.48 562.31 747.66 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.96 371.58 415.05 473.79 548.38 781.73 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.86 366.31 390.39 459.53 541.15 814.16 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.55 360.33 364.76 443.93 536.44 844.51 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.55 331.63 362.70 428.38 531.49 872.38 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.59 302.80 363.70 413.47 525.07 897.41 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.47 276.80 366.39 399.81 516.65 919.23 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.99 255.18 370.19 388.50 506.10 937.51 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.49 239.56 372.88 382.41 493.51 951.94 -------------------------------------------------------------------------------- K point *** = 0.296875 0.953125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.32 235.81 371.03 385.57 479.17 962.31 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.01 219.78 375.85 384.29 449.87 982.51 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.36 221.13 378.02 391.07 433.97 986.25 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 218.30 227.24 383.58 398.06 418.67 985.98 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.71 236.87 389.85 402.84 408.79 982.15 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.19 247.62 387.09 405.58 413.68 975.42 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.26 257.20 381.42 413.46 420.16 966.45 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.40 264.22 380.97 420.92 425.93 955.80 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.07 269.24 386.46 427.14 430.47 943.79 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.76 274.49 396.41 432.13 433.72 930.51 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.92 282.53 408.85 435.97 436.09 915.82 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.62 294.40 422.28 437.80 439.24 899.52 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.22 310.76 435.56 438.89 443.04 881.36 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.60 330.77 438.61 445.80 451.49 861.15 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.64 352.86 437.10 452.85 465.42 838.75 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.29 374.99 434.22 460.48 482.25 814.12 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.54 395.21 429.99 467.88 503.59 787.32 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.42 412.48 424.47 474.08 530.14 758.55 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.01 417.76 426.71 478.73 560.85 728.23 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.37 410.01 438.01 481.96 593.40 697.53 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.56 401.47 445.93 484.21 620.96 672.42 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.58 392.48 449.43 486.02 614.83 681.43 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.34 383.52 447.42 487.21 586.77 713.51 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.66 375.21 439.28 485.86 559.31 748.30 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.31 368.23 424.28 478.87 539.21 782.72 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.22 363.10 401.88 466.02 528.19 815.85 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.65 360.05 373.51 451.02 522.00 847.16 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.12 342.12 359.10 436.02 516.58 876.22 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.31 310.66 359.94 421.44 510.07 902.64 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.94 281.26 362.39 407.66 501.77 926.04 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.72 255.78 366.19 395.37 491.46 946.05 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.32 235.81 371.03 385.57 479.17 962.31 -------------------------------------------------------------------------------- K point *** = 0.296875 0.984375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 222.00 222.91 375.80 380.15 465.17 974.53 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.17 229.24 373.78 379.07 480.13 965.32 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.10 228.45 374.35 385.46 464.34 971.51 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.10 232.49 378.71 392.72 447.95 973.60 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.76 240.96 386.16 400.15 432.07 971.93 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.67 251.79 394.60 406.95 419.17 967.05 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.45 262.62 397.80 410.65 417.77 959.65 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.60 271.37 394.27 417.28 423.70 950.36 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.59 277.05 394.55 424.26 429.27 939.68 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.89 280.67 400.25 430.19 433.52 927.85 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.04 284.80 409.86 434.99 436.50 914.86 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.44 292.09 421.47 438.64 438.81 900.55 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.46 303.28 433.65 440.53 441.93 884.64 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.19 319.27 441.39 444.70 446.96 866.88 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.64 339.12 441.04 451.03 458.14 847.05 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.72 361.25 439.28 458.50 470.65 825.00 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.39 383.61 436.14 466.36 486.22 800.69 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.68 404.24 431.63 472.86 507.31 774.19 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.65 422.06 425.83 477.40 534.24 745.68 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.37 418.80 436.85 480.12 565.61 715.57 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.95 410.76 448.19 481.60 599.28 684.78 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.47 401.95 454.65 483.12 628.34 659.55 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.96 392.71 454.37 485.64 614.26 678.58 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.34 383.52 447.42 487.21 586.77 713.51 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.47 375.01 434.46 484.09 564.13 748.85 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.14 367.84 415.32 474.13 550.00 783.17 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.29 362.58 390.30 459.54 542.67 815.87 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.14 359.26 361.46 443.68 537.89 846.48 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.21 330.66 358.59 427.97 532.90 874.61 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.18 301.08 359.59 412.97 526.42 899.88 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.77 274.42 362.28 399.29 517.93 921.92 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.68 252.42 366.35 387.80 507.30 940.36 -------------------------------------------------------------------------------- K point *** = 0.328125 0.015625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.57 236.48 371.36 379.68 494.61 954.91 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.10 228.45 374.35 385.46 464.34 971.51 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.15 227.83 372.56 390.76 449.24 979.51 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.58 231.29 373.85 397.39 433.70 983.36 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.45 238.32 378.65 403.22 419.61 983.28 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 220.76 247.62 385.59 400.62 415.82 979.70 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.68 257.26 387.16 398.47 420.90 973.22 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.45 265.27 382.49 406.65 426.11 964.48 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.38 270.62 382.79 415.36 430.20 953.98 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.79 274.26 388.77 423.21 432.95 942.03 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.91 278.87 398.78 429.89 434.57 928.71 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.90 287.18 410.95 434.90 436.01 913.92 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.12 298.81 423.88 436.08 440.20 897.46 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.10 314.09 435.75 437.96 444.49 879.12 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.46 333.38 437.21 447.43 451.88 858.73 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.14 354.96 436.75 453.96 465.26 836.17 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.22 376.62 434.81 461.04 481.82 811.41 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.74 396.35 431.34 467.96 503.09 784.52 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.74 413.14 426.42 473.77 529.69 755.70 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.33 420.16 427.01 478.16 560.42 725.40 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.58 412.80 437.99 481.22 592.88 694.83 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.58 404.57 445.70 483.40 619.93 670.27 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.34 395.82 449.04 485.20 612.71 680.42 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.80 387.07 446.94 486.44 584.68 712.54 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.81 378.92 438.77 485.18 557.49 747.15 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.18 372.03 423.81 478.39 537.65 781.35 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.88 366.94 401.61 465.83 526.80 814.23 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.18 363.72 373.83 451.10 520.69 845.28 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.62 342.62 363.18 436.28 515.33 874.08 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.89 311.89 363.98 421.83 508.87 900.25 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.78 283.16 366.43 408.11 500.63 923.42 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.09 258.17 370.12 395.90 490.40 943.23 -------------------------------------------------------------------------------- K point *** = 0.328125 0.046875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.64 238.27 374.05 386.82 478.21 959.36 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.10 232.49 378.71 392.72 447.95 973.60 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.58 231.29 373.85 397.39 433.70 983.36 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 206.88 234.65 371.64 402.26 420.07 989.10 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 205.29 241.29 373.12 398.88 415.17 990.90 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 208.26 249.75 377.66 387.83 419.47 989.04 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.00 258.14 376.27 387.18 424.28 983.99 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.61 264.58 371.86 395.98 428.09 976.28 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.19 268.32 373.29 405.63 430.53 966.40 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.76 270.80 380.21 415.01 431.61 954.68 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.12 275.11 390.75 423.57 431.68 941.25 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.95 284.18 403.11 430.13 432.16 926.11 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.48 297.44 416.11 430.35 437.97 909.15 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.81 313.38 428.08 431.47 443.64 890.23 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.75 331.94 430.19 442.67 449.41 869.25 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.14 352.32 430.90 451.77 459.97 846.12 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.61 372.58 430.97 457.78 476.77 820.87 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.13 390.72 429.70 463.70 498.40 793.60 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.76 405.85 426.77 469.34 524.98 764.52 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.60 418.17 422.23 474.24 555.28 734.16 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.77 416.28 428.12 478.18 586.79 703.84 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.34 409.23 435.71 481.13 612.80 679.39 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.39 401.47 440.46 483.19 610.58 683.16 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.87 393.53 441.51 484.32 583.87 711.67 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.68 386.02 437.75 483.89 553.90 745.01 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.72 379.58 427.74 479.94 528.36 778.62 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.01 374.72 409.90 470.16 512.33 811.25 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.83 371.57 384.71 456.83 504.01 842.28 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.74 354.35 371.10 443.20 497.88 871.27 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.45 323.63 371.67 429.79 491.20 897.87 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.78 294.03 373.91 416.66 483.00 921.73 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.60 267.35 377.29 404.34 473.01 942.52 -------------------------------------------------------------------------------- K point *** = 0.328125 0.078125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.54 245.09 380.53 394.51 461.23 959.91 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.76 240.96 386.16 400.15 432.07 971.93 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.45 238.32 378.65 403.22 419.61 983.28 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 205.29 241.29 373.12 398.88 415.17 990.90 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.99 247.43 371.01 386.61 419.03 994.75 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.71 254.92 372.22 375.45 423.44 994.95 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 204.10 261.57 366.56 378.26 426.92 991.79 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.42 265.51 364.20 386.13 429.03 985.63 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.76 266.62 368.00 395.70 429.67 976.86 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.97 267.15 376.52 405.95 429.02 965.77 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.43 270.60 387.67 416.09 427.48 952.56 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.01 280.34 399.84 424.45 426.76 937.28 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.53 295.76 412.02 423.64 434.68 919.92 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.05 314.07 420.47 426.34 442.42 900.46 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.24 333.99 421.03 437.89 449.45 878.86 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.94 354.45 421.72 449.86 457.34 855.12 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.18 373.67 422.92 457.55 471.95 829.31 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.48 389.90 423.94 462.55 493.41 801.57 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.61 402.63 423.97 466.86 520.11 772.16 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.52 412.51 422.45 470.78 550.34 741.64 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.26 418.67 420.93 474.28 581.43 711.38 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.92 414.24 426.80 477.22 607.23 686.57 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.60 408.36 431.16 479.43 608.94 685.59 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.34 401.88 433.18 480.70 584.47 710.54 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.16 395.45 431.95 480.69 553.52 742.40 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.06 389.70 425.99 478.53 524.06 775.17 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.13 385.17 413.11 472.11 501.82 807.24 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.69 382.06 392.08 460.63 489.73 837.90 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.26 364.24 381.32 448.14 482.24 866.70 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.55 334.63 381.69 436.11 474.92 893.31 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.40 305.40 383.63 424.18 466.40 917.42 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.69 278.40 386.71 412.47 456.35 938.74 -------------------------------------------------------------------------------- K point *** = 0.328125 0.109375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.83 255.34 389.57 402.36 444.78 957.00 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.67 251.79 394.60 406.95 419.17 967.05 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 220.76 247.62 385.59 400.62 415.82 979.70 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 208.26 249.75 377.66 387.83 419.47 989.04 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 199.71 254.92 372.22 375.45 423.44 994.95 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 195.97 260.68 365.29 370.66 426.54 997.41 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.25 264.49 360.36 372.55 428.32 996.47 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 203.25 264.84 361.71 378.04 428.58 992.29 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.29 262.77 368.61 386.39 427.40 985.10 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.28 261.16 378.80 396.68 425.06 975.10 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.41 263.46 390.23 407.98 422.08 962.46 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.54 273.55 401.50 418.03 420.60 947.33 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.83 291.12 410.39 418.09 430.91 929.78 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.05 312.37 411.35 425.63 441.06 909.89 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.47 335.24 410.55 435.99 450.09 887.71 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.18 358.06 410.65 447.40 458.38 863.34 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.19 378.55 411.89 458.18 469.32 836.90 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.77 394.39 414.01 464.39 488.87 808.59 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.43 405.15 416.43 468.05 515.31 778.72 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.87 412.14 418.39 470.57 545.65 747.85 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.91 416.38 419.65 472.50 576.82 717.31 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.48 416.68 421.84 474.14 603.18 691.68 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.57 414.19 424.04 475.49 608.36 686.82 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.28 410.29 425.00 476.36 586.38 708.63 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.72 405.71 423.96 476.35 555.64 739.12 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.01 401.12 419.75 474.94 524.57 771.04 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.34 397.16 410.40 471.09 497.77 802.43 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.03 393.46 394.62 462.61 480.23 832.51 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.56 370.15 392.93 450.93 470.62 860.84 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.63 342.98 393.01 439.95 462.33 887.12 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.10 315.39 394.50 429.52 453.10 911.10 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.84 289.41 397.05 419.17 442.53 932.55 -------------------------------------------------------------------------------- K point *** = 0.328125 0.140625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.20 266.85 399.26 409.80 430.80 951.27 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.45 262.62 397.80 410.65 417.77 959.65 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.68 257.26 387.16 398.47 420.90 973.22 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.00 258.14 376.27 387.18 424.28 983.99 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 204.10 261.57 366.56 378.26 426.92 991.79 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.25 264.49 360.36 372.55 428.32 996.47 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 195.15 264.38 359.95 370.59 428.23 997.89 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 198.07 260.90 365.54 372.70 426.64 995.98 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 205.78 256.10 374.43 379.45 423.75 990.73 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 217.51 252.77 383.49 390.96 420.04 982.23 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.61 253.83 392.94 403.84 416.56 970.58 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 244.08 263.63 401.53 411.02 420.23 955.94 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.88 282.77 403.23 416.62 432.09 938.49 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.59 306.48 401.04 425.93 443.53 918.37 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.78 332.34 399.30 435.71 453.67 895.76 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.69 358.54 398.76 446.10 462.56 870.82 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.39 382.47 399.61 457.55 471.62 843.76 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.12 400.59 402.04 466.89 486.72 814.83 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.30 404.85 412.48 471.55 511.40 784.35 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.54 408.55 418.63 473.71 541.50 752.91 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.58 412.13 421.49 474.50 572.96 721.74 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.26 414.88 422.37 474.49 600.41 694.79 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.43 416.23 422.01 474.09 609.02 686.27 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.03 415.87 420.67 473.47 589.38 705.46 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.10 413.91 418.17 472.54 559.24 734.92 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.76 410.47 414.09 470.91 527.97 766.14 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.20 403.51 409.72 467.99 499.44 796.89 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.72 390.10 406.81 462.55 477.26 826.33 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.76 370.44 405.12 452.45 464.38 854.05 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.98 346.79 404.71 441.15 455.68 879.78 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.25 322.05 405.54 430.98 446.45 903.34 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.52 298.33 407.11 421.58 435.91 924.59 -------------------------------------------------------------------------------- K point *** = 0.328125 0.171875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.22 277.39 406.20 415.23 424.30 943.40 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.60 271.37 394.27 417.28 423.70 950.36 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.45 265.27 382.49 406.65 426.11 964.48 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.61 264.58 371.86 395.98 428.09 976.28 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.42 265.51 364.20 386.13 429.03 985.63 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 203.25 264.84 361.71 378.04 428.58 992.29 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 198.07 260.90 365.54 372.70 426.64 995.98 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 197.60 254.53 370.80 374.72 423.34 996.39 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 202.13 248.00 372.79 386.85 419.14 993.30 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.50 243.57 378.25 399.38 415.39 986.60 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.62 243.44 386.21 404.58 419.24 976.30 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.16 252.14 393.74 403.63 431.14 962.55 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.24 271.94 393.39 410.80 443.24 945.55 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.31 297.02 390.32 421.64 454.20 925.53 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.08 324.84 387.95 432.81 463.73 902.74 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.80 353.72 386.92 444.02 471.97 877.43 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.58 381.09 387.62 455.77 479.71 849.86 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.63 389.39 404.07 467.51 490.30 820.32 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.34 393.05 418.76 475.01 510.30 789.20 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.30 397.89 426.23 478.03 538.72 757.03 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.30 403.41 428.82 478.72 570.08 724.93 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.24 408.99 428.25 478.03 598.80 696.18 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.07 413.96 425.55 476.42 611.02 683.70 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.69 417.53 421.49 474.21 593.37 700.65 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.01 414.97 420.59 471.60 563.63 729.52 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.99 407.73 421.04 468.66 532.52 760.31 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.64 397.88 420.16 465.24 503.74 790.55 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.08 384.30 418.51 460.87 479.73 819.42 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.58 366.51 416.91 453.92 462.74 846.51 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.66 345.78 416.02 442.50 453.45 871.61 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.15 324.23 416.02 430.80 445.75 894.60 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.15 303.53 415.20 421.35 437.30 915.40 -------------------------------------------------------------------------------- K point *** = 0.328125 0.203125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.38 285.07 405.99 420.92 427.95 933.99 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.59 277.05 394.55 424.26 429.27 939.68 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.38 270.62 382.79 415.36 430.20 953.98 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.19 268.32 373.29 405.63 430.53 966.40 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.76 266.62 368.00 395.70 429.67 976.86 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.29 262.77 368.61 386.39 427.40 985.10 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 205.78 256.10 374.43 379.45 423.75 990.73 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 202.13 248.00 372.79 386.85 419.14 993.30 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 203.11 240.54 371.29 398.74 415.11 992.36 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.13 235.54 373.47 402.49 419.94 987.63 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 220.03 234.50 378.89 398.33 433.02 978.98 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.29 241.26 384.57 396.05 446.49 966.48 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.40 260.67 383.54 402.98 458.86 950.34 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.84 285.84 380.08 414.44 469.69 930.81 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.12 314.33 377.33 426.89 478.81 908.19 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.45 344.55 375.98 439.55 486.36 882.81 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.95 373.31 377.46 452.41 492.95 854.97 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.85 377.94 401.46 465.48 500.63 825.01 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.51 381.83 420.96 476.30 514.60 793.32 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.50 387.30 432.26 481.52 538.71 760.42 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.64 393.97 437.01 482.82 568.68 727.23 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.97 401.23 437.06 482.22 598.28 696.33 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.55 408.44 433.67 480.48 614.43 679.19 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.40 415.02 427.69 477.82 598.42 694.02 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.48 419.38 420.73 474.30 568.50 722.75 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.68 409.48 424.56 470.04 537.35 753.37 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.91 396.96 426.89 465.21 508.67 783.29 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.08 381.40 427.58 460.05 484.42 811.69 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.17 362.88 427.08 454.49 465.41 838.22 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.31 342.79 426.19 446.08 452.94 862.71 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.95 323.08 425.47 433.79 446.21 885.06 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.15 305.05 419.70 426.95 439.88 905.31 -------------------------------------------------------------------------------- K point *** = 0.328125 0.234375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.15 289.25 407.17 427.47 432.89 923.48 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.89 280.67 400.25 430.19 433.52 927.85 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.79 274.26 388.77 423.21 432.95 942.03 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.76 270.80 380.21 415.01 431.61 954.68 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.97 267.15 376.52 405.95 429.02 965.77 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.28 261.16 378.80 396.68 425.06 975.10 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 217.51 252.77 383.49 390.96 420.04 982.23 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.50 243.57 378.25 399.38 415.39 986.60 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 209.13 235.54 373.47 402.49 419.94 987.63 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 211.26 230.30 372.06 397.09 433.94 984.85 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 218.59 228.87 374.21 391.21 448.91 978.02 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.87 233.20 377.31 388.50 463.13 967.07 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.83 251.09 375.27 394.81 475.94 952.16 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.72 274.92 371.47 406.07 486.98 933.54 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.50 302.77 368.47 419.12 496.11 911.53 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.31 333.11 366.89 432.92 503.41 886.48 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.34 363.24 367.88 447.05 509.36 858.74 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.83 368.66 393.53 461.34 515.31 828.67 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.12 372.70 417.32 474.53 524.73 796.67 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.79 378.58 433.62 482.93 542.76 763.20 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.73 385.94 442.60 485.56 569.31 729.02 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.02 394.16 445.50 485.13 598.73 695.92 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.83 402.60 443.36 483.58 619.16 673.12 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.26 410.69 437.19 481.37 604.66 685.56 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.32 418.00 427.95 478.29 573.83 714.57 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.94 416.08 424.19 474.07 542.22 745.22 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.03 401.50 429.03 468.66 513.48 774.95 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.48 383.91 432.34 462.32 489.43 803.00 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.23 363.68 434.04 455.75 470.42 829.05 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.19 342.38 434.30 449.41 455.49 852.97 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.33 322.27 433.58 439.75 446.63 874.72 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.86 305.20 426.14 433.64 441.65 894.36 -------------------------------------------------------------------------------- K point *** = 0.328125 0.265625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.05 291.43 413.07 433.18 436.63 912.02 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.04 284.80 409.86 434.99 436.50 914.86 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.91 278.87 398.78 429.89 434.57 928.71 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.12 275.11 390.75 423.57 431.68 941.25 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.43 270.60 387.67 416.09 427.48 952.56 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.41 263.46 390.23 407.98 422.08 962.46 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.61 253.83 392.94 403.84 416.56 970.58 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 224.62 243.44 386.21 404.58 419.24 976.30 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 220.03 234.50 378.89 398.33 433.02 978.98 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 218.59 228.87 374.21 391.21 448.91 978.02 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 221.48 227.46 373.13 384.59 464.76 973.01 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.98 230.14 373.67 381.24 479.65 963.81 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.01 244.99 370.00 386.90 492.99 950.45 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 244.46 265.99 365.68 397.43 504.44 933.14 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.65 291.92 362.41 410.41 513.82 912.18 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.84 321.24 360.64 424.77 521.17 887.92 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.26 351.95 360.76 439.88 526.85 860.72 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.18 362.48 382.32 455.29 531.82 830.96 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.98 366.64 408.88 470.15 538.39 799.03 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.25 372.80 429.49 481.62 550.85 765.37 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.92 380.59 443.34 486.63 572.24 730.55 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.13 389.35 450.85 486.48 599.74 695.68 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.08 398.45 452.11 484.52 624.37 666.52 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.87 407.31 447.36 482.69 611.91 675.55 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.54 415.52 437.94 480.77 579.51 705.17 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.04 422.72 425.15 477.84 547.10 735.87 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.26 409.23 428.90 473.37 517.98 765.40 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.13 390.36 433.70 467.21 493.98 793.13 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.57 368.99 437.12 459.80 475.57 818.76 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.55 346.70 439.08 452.40 461.20 842.18 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.07 325.61 439.58 445.86 449.05 863.38 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.12 307.70 434.84 439.16 442.94 882.43 -------------------------------------------------------------------------------- K point *** = 0.328125 0.296875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.62 294.40 422.28 437.80 439.24 899.52 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.44 292.09 421.47 438.64 438.81 900.55 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.90 287.18 410.95 434.90 436.01 913.92 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.95 284.18 403.11 430.13 432.16 926.11 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.01 280.34 399.84 424.45 426.76 937.28 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.54 273.55 401.50 418.03 420.60 947.33 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 244.08 263.63 401.53 411.02 420.23 955.94 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.16 252.14 393.74 403.63 431.14 962.55 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.29 241.26 384.57 396.05 446.49 966.48 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.87 233.20 377.31 388.50 463.13 967.07 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.98 230.14 373.67 381.24 479.65 963.81 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.14 233.14 374.51 374.51 495.15 956.41 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.70 243.40 368.56 379.86 509.07 944.82 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.43 260.50 363.66 389.15 521.01 929.14 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.80 283.38 360.08 401.46 530.77 909.63 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.18 310.49 358.10 415.82 538.34 886.60 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.88 340.01 357.97 431.43 543.98 860.42 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.19 359.96 369.83 447.66 548.40 831.46 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.51 364.18 397.59 463.73 553.20 800.11 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.47 370.53 421.01 477.59 561.51 766.76 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.01 378.55 438.84 485.72 577.22 731.90 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.29 387.60 451.08 486.89 600.85 696.13 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.49 397.02 457.54 483.89 627.87 661.55 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.73 406.25 456.52 481.13 619.34 664.76 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.00 414.88 447.92 480.35 585.00 695.01 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.23 422.61 434.53 479.42 551.79 725.48 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.32 417.84 429.23 476.91 522.14 754.63 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.16 398.21 434.61 472.27 497.84 781.94 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.68 376.29 438.66 465.31 479.89 807.12 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.81 353.68 441.34 457.04 467.03 830.05 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.57 332.47 442.64 449.81 455.99 850.73 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.00 314.48 442.59 444.00 445.52 869.23 -------------------------------------------------------------------------------- K point *** = 0.328125 0.328125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.22 300.93 433.02 441.23 441.45 885.75 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.46 303.28 433.65 440.53 441.93 884.64 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.12 298.81 423.88 436.08 440.20 897.46 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.48 297.44 416.11 430.35 437.97 909.15 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.53 295.76 412.02 423.64 434.68 919.92 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.83 291.12 410.39 418.09 430.91 929.78 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.88 282.77 403.23 416.62 432.09 938.49 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.24 271.94 393.39 410.80 443.24 945.55 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.40 260.67 383.54 402.98 458.86 950.34 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.83 251.09 375.27 394.81 475.94 952.16 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.01 244.99 370.00 386.90 492.99 950.45 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.70 243.40 368.56 379.86 509.07 944.82 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.62 246.62 369.14 376.19 523.55 935.08 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.69 259.68 365.71 381.93 536.01 921.26 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.67 278.75 361.99 392.93 546.21 903.52 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.01 302.55 359.73 406.78 554.10 882.14 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.93 329.48 359.43 422.43 559.84 857.43 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.69 357.10 361.96 439.08 563.96 829.77 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.68 365.26 385.50 455.90 567.60 799.51 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.53 371.74 410.06 471.33 573.01 767.07 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.19 379.90 430.40 482.39 583.62 732.87 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.79 389.11 446.10 486.28 601.87 697.38 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.50 398.70 457.30 483.45 626.68 661.15 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.38 408.13 462.75 477.74 624.84 655.15 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.40 416.94 456.87 476.82 589.35 684.87 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.45 424.82 443.14 478.33 555.83 714.35 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.41 425.60 431.87 478.31 525.81 742.69 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.13 405.74 437.20 475.97 500.97 769.33 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.51 383.73 441.28 470.52 482.97 793.93 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.45 361.27 443.92 461.77 471.92 816.32 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.91 340.44 445.05 453.61 463.21 836.47 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.80 323.18 444.67 448.08 454.02 854.44 -------------------------------------------------------------------------------- K point *** = 0.328125 0.359375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.54 311.40 443.02 443.99 444.65 870.41 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.19 319.27 441.39 444.70 446.96 866.88 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.10 314.09 435.75 437.96 444.49 879.12 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.81 313.38 428.08 431.47 443.64 890.23 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.05 314.07 420.47 426.34 442.42 900.46 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.05 312.37 411.35 425.63 441.06 909.89 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.59 306.48 401.04 425.93 443.53 918.37 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.31 297.02 390.32 421.64 454.20 925.53 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.84 285.84 380.08 414.44 469.69 930.81 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.72 274.92 371.47 406.07 486.98 933.54 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 244.46 265.99 365.68 397.43 504.44 933.14 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.43 260.50 363.66 389.15 521.01 929.14 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.69 259.68 365.71 381.93 536.01 921.26 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.31 265.94 369.75 378.19 548.98 909.42 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.04 280.09 368.10 385.42 559.63 893.69 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.25 299.47 365.50 398.40 567.87 874.28 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.47 322.51 364.79 413.78 573.79 851.44 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.90 347.45 366.69 430.47 577.78 825.53 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.86 367.78 376.11 447.57 580.67 796.89 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.93 375.71 398.82 463.81 584.06 765.93 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.03 384.11 419.97 476.88 590.57 733.11 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.27 393.51 437.58 483.81 602.97 699.00 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.76 403.30 451.53 483.26 621.42 664.81 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.54 412.91 462.03 476.47 623.94 651.26 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.53 421.86 464.02 470.71 591.42 675.83 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.58 429.68 449.93 475.24 558.61 703.00 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.49 430.69 438.29 477.74 528.69 729.80 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.07 411.91 442.63 477.85 503.42 755.33 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.12 390.54 446.34 474.77 484.74 779.08 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.40 369.06 448.38 465.84 475.58 800.79 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.42 349.95 448.38 457.26 469.52 820.34 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.08 336.13 446.32 452.30 462.58 837.76 -------------------------------------------------------------------------------- K point *** = 0.328125 0.390625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.40 326.97 443.89 448.78 454.65 853.20 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.64 339.12 441.04 451.03 458.14 847.05 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.46 333.38 437.21 447.43 451.88 858.73 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.75 331.94 430.19 442.67 449.41 869.25 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.24 333.99 421.03 437.89 449.45 878.86 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.47 335.24 410.55 435.99 450.09 887.71 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.78 332.34 399.30 435.71 453.67 895.76 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.08 324.84 387.95 432.81 463.73 902.74 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.12 314.33 377.33 426.89 478.81 908.19 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.50 302.77 368.47 419.12 496.11 911.53 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.65 291.92 362.41 410.41 513.82 912.18 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.80 283.38 360.08 401.46 530.77 909.63 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.67 278.75 361.99 392.93 546.21 903.52 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.04 280.09 368.10 385.42 559.63 893.69 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.66 288.78 376.91 380.49 570.72 880.12 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.49 303.16 374.78 391.51 579.31 862.90 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.93 321.41 373.08 406.65 585.46 842.27 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.26 342.17 374.14 423.17 589.43 818.49 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.60 363.55 378.73 440.13 591.84 791.93 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.36 379.83 390.93 456.43 593.84 762.99 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.34 389.84 409.96 470.34 597.28 732.19 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.59 399.78 427.83 479.42 604.41 700.31 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.21 409.99 442.89 481.73 615.41 669.49 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.18 419.96 454.86 477.37 616.49 653.72 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.39 429.12 462.68 469.12 590.61 668.89 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.61 436.53 453.83 471.78 559.82 691.99 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.54 433.55 447.33 475.91 530.69 716.28 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.83 416.31 451.13 478.03 505.42 740.08 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.99 396.88 454.05 477.81 485.81 762.59 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.09 378.42 454.37 470.23 477.97 783.36 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.78 364.22 451.04 463.17 474.66 802.18 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.59 354.60 446.47 459.27 470.22 819.00 -------------------------------------------------------------------------------- K point *** = 0.328125 0.421875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.92 346.60 443.28 455.35 464.61 833.89 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.72 361.25 439.28 458.50 470.65 825.00 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.14 354.96 436.75 453.96 465.26 836.17 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.14 352.32 430.90 451.77 459.97 846.12 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.94 354.45 421.72 449.86 457.34 855.12 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.18 358.06 410.65 447.40 458.38 863.34 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.69 358.54 398.76 446.10 462.56 870.82 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.80 353.72 386.92 444.02 471.97 877.43 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.45 344.55 375.98 439.55 486.36 882.81 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.31 333.11 366.89 432.92 503.41 886.48 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.84 321.24 360.64 424.77 521.17 887.92 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.18 310.49 358.10 415.82 538.34 886.60 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.01 302.55 359.73 406.78 554.10 882.14 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.25 299.47 365.50 398.40 567.87 874.28 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.49 303.16 374.78 391.51 579.31 862.90 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.22 313.06 383.06 390.49 588.23 848.04 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.79 327.01 381.80 403.56 594.62 829.84 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.29 343.46 381.92 419.38 598.67 808.53 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.91 361.31 385.18 435.66 600.82 784.43 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.68 379.09 392.16 451.27 601.90 757.96 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.03 394.06 404.14 464.81 603.21 729.68 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.77 405.95 419.55 474.49 606.21 700.60 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.93 417.16 434.22 478.62 610.77 673.28 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.46 427.85 446.45 476.81 608.33 657.53 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.18 437.28 454.84 471.26 587.71 664.30 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.75 442.54 455.41 469.91 559.95 681.89 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.67 434.56 457.49 473.60 532.46 702.59 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.15 419.61 461.40 476.82 508.18 723.88 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.87 404.27 462.45 478.82 489.44 744.59 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.19 391.96 458.27 477.99 480.23 764.06 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.25 383.34 450.90 473.00 479.74 781.93 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.20 376.07 444.87 468.72 478.14 798.03 -------------------------------------------------------------------------------- K point *** = 0.328125 0.453125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.05 368.70 441.27 463.85 475.09 812.35 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.39 383.61 436.14 466.36 486.22 800.69 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.22 376.62 434.81 461.04 481.82 811.41 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.61 372.58 430.97 457.78 476.77 820.87 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.18 373.67 422.92 457.55 471.95 829.31 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.19 378.55 411.89 458.18 469.32 836.90 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.39 382.47 399.61 457.55 471.62 843.76 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.58 381.09 387.62 455.77 479.71 849.86 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.95 373.31 377.46 452.41 492.95 854.97 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.34 363.24 367.88 447.05 509.36 858.74 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.26 351.95 360.76 439.88 526.85 860.72 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.88 340.01 357.97 431.43 543.98 860.42 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.93 329.48 359.43 422.43 559.84 857.43 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.47 322.51 364.79 413.78 573.79 851.44 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.93 321.41 373.08 406.65 585.46 842.27 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.79 327.01 381.80 403.56 594.62 829.84 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.58 337.54 385.82 409.39 601.23 814.24 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.67 350.83 386.83 422.13 605.40 795.63 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.07 365.48 389.49 436.66 607.48 774.30 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.02 380.53 395.30 450.73 608.08 750.64 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.57 395.23 404.43 462.87 608.07 725.27 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.06 409.13 416.07 471.62 608.33 699.31 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.14 422.15 428.55 475.76 608.34 675.35 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.63 433.77 440.40 474.99 602.73 660.35 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.20 442.20 450.82 471.03 585.06 661.39 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.31 443.02 459.56 468.90 560.71 673.09 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 377.97 434.84 466.31 471.21 536.08 689.30 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 378.50 423.85 469.53 474.48 515.05 707.21 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 372.79 414.94 466.43 477.17 501.46 725.42 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.39 409.11 457.67 478.35 495.95 743.08 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.06 404.13 448.42 477.79 493.89 759.66 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.21 398.29 441.67 475.49 492.14 774.87 -------------------------------------------------------------------------------- K point *** = 0.328125 0.484375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.77 391.26 437.84 471.55 489.67 788.54 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.68 404.24 431.63 472.86 507.31 774.19 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.74 396.35 431.34 467.96 503.09 784.52 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.13 390.72 429.70 463.70 498.40 793.60 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.48 389.90 423.94 462.55 493.41 801.57 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.77 394.39 414.01 464.39 488.87 808.59 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.12 400.59 402.04 466.89 486.72 814.83 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.63 389.39 404.07 467.51 490.30 820.32 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.85 377.94 401.46 465.48 500.63 825.01 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.83 368.66 393.53 461.34 515.31 828.67 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.18 362.48 382.32 455.29 531.82 830.96 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.19 359.96 369.83 447.66 548.40 831.46 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.69 357.10 361.96 439.08 563.96 829.77 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.90 347.45 366.69 430.47 577.78 825.53 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.26 342.17 374.14 423.17 589.43 818.49 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.29 343.46 381.92 419.38 598.67 808.53 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.67 350.83 386.83 422.13 605.40 795.63 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.47 361.92 388.66 431.39 609.72 779.90 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.94 374.63 390.78 443.50 611.89 761.55 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.08 387.21 395.95 455.59 612.41 740.97 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.24 398.22 405.60 465.83 611.87 718.78 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.52 409.46 417.31 472.86 610.75 696.10 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.14 422.15 428.55 475.76 608.34 675.35 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.51 434.63 439.08 474.51 601.04 661.56 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.99 442.18 450.80 470.77 585.41 659.23 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 378.62 442.65 461.43 468.69 564.87 665.78 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 383.62 437.06 467.73 470.92 544.85 677.07 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 382.36 431.15 470.67 471.70 529.72 690.79 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.87 428.19 464.58 474.17 521.74 705.67 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.15 426.58 454.31 476.39 518.49 720.82 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.92 423.98 444.37 477.82 516.47 735.64 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.74 419.26 437.05 478.01 514.09 749.64 -------------------------------------------------------------------------------- K point *** = 0.328125 0.515625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.14 412.36 433.04 476.42 511.01 762.55 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.65 422.06 425.83 477.40 534.24 745.68 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.74 413.14 426.42 473.77 529.69 755.70 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.76 405.85 426.77 469.34 524.98 764.52 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.61 402.63 423.97 466.86 520.11 772.16 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.43 405.15 416.43 468.05 515.31 778.72 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.30 404.85 412.48 471.55 511.40 784.35 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.34 393.05 418.76 475.01 510.30 789.20 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.51 381.83 420.96 476.30 514.60 793.32 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.12 372.70 417.32 474.53 524.73 796.67 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.98 366.64 408.88 470.15 538.39 799.03 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.51 364.18 397.59 463.73 553.20 800.11 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.68 365.26 385.50 455.90 567.60 799.51 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.86 367.78 376.11 447.57 580.67 796.89 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.60 363.55 378.73 440.13 591.84 791.93 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.91 361.31 385.18 435.66 600.82 784.43 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.07 365.48 389.49 436.66 607.48 774.30 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.94 374.63 390.78 443.50 611.89 761.55 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.71 386.33 391.40 453.47 614.31 746.35 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.47 393.27 399.33 463.65 615.13 729.04 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.21 398.22 411.96 472.04 614.84 710.19 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.33 406.28 423.81 477.25 613.65 690.89 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.93 417.16 434.22 478.62 610.77 673.28 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.06 429.88 442.48 476.45 603.58 661.17 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.70 442.43 447.73 472.64 590.36 657.36 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.37 445.66 455.31 470.43 574.20 660.15 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 381.67 441.82 462.99 470.01 559.85 666.77 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 379.78 439.61 465.52 469.06 550.65 675.73 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 370.92 440.10 459.66 470.66 546.74 686.32 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.61 439.56 451.74 472.79 545.42 698.02 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.19 435.39 445.20 475.46 544.17 710.31 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.93 430.22 438.72 477.87 541.87 722.67 -------------------------------------------------------------------------------- K point *** = 0.328125 0.546875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.22 426.86 430.91 478.79 538.43 734.59 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.37 418.80 436.85 480.12 565.61 715.57 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.33 420.16 427.01 478.16 560.42 725.40 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.60 418.17 422.23 474.24 555.28 734.16 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.52 412.51 422.45 470.78 550.34 741.64 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.87 412.14 418.39 470.57 545.65 747.85 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.54 408.55 418.63 473.71 541.50 752.91 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.30 397.89 426.23 478.03 538.72 757.03 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.50 387.30 432.26 481.52 538.71 760.42 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.79 378.58 433.62 482.93 542.76 763.20 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.25 372.80 429.49 481.62 550.85 765.37 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.47 370.53 421.01 477.59 561.51 766.76 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.53 371.74 410.06 471.33 573.01 767.07 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.93 375.71 398.82 463.81 584.06 765.93 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.36 379.83 390.93 456.43 593.84 762.99 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.68 379.09 392.16 451.27 601.90 757.96 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.02 380.53 395.30 450.73 608.08 750.64 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.08 387.21 395.95 455.59 612.41 740.97 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.47 393.27 399.33 463.65 615.13 729.04 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.22 393.82 410.58 472.04 616.64 715.10 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.22 396.19 422.48 478.57 617.33 699.70 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.43 401.55 433.55 481.94 617.24 683.84 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.21 409.99 442.89 481.73 615.41 669.49 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.53 420.93 449.44 478.66 609.64 659.69 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.12 433.18 451.63 474.85 599.25 656.10 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.21 444.68 449.15 472.25 587.46 656.86 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.16 444.33 454.30 470.07 578.25 659.77 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.17 443.40 456.62 469.02 573.77 663.91 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.48 443.43 454.84 469.57 573.44 669.23 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.40 437.18 458.41 469.11 574.74 676.06 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.15 429.34 459.56 470.76 575.25 684.56 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.93 423.15 454.33 475.58 573.77 694.45 -------------------------------------------------------------------------------- K point *** = 0.328125 0.578125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.14 419.59 446.29 479.19 570.33 705.04 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.95 410.76 448.19 481.60 599.28 684.78 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.58 412.80 437.99 481.22 592.88 694.83 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.77 416.28 428.12 478.18 586.79 703.84 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.26 418.67 420.93 474.28 581.43 711.38 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.91 416.38 419.65 472.50 576.82 717.31 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.58 412.13 421.49 474.50 572.96 721.74 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.30 403.41 428.82 478.72 570.08 724.93 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.64 393.97 437.01 482.82 568.68 727.23 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.73 385.94 442.60 485.56 569.31 729.02 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.92 380.59 443.34 486.63 572.24 730.55 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.01 378.55 438.84 485.72 577.22 731.90 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.19 379.90 430.40 482.39 583.62 732.87 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.03 384.11 419.97 476.88 590.57 733.11 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.34 389.84 409.96 470.34 597.28 732.19 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.03 394.06 404.14 464.81 603.21 729.68 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.57 395.23 404.43 462.87 608.07 725.27 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.24 398.22 405.60 465.83 611.87 718.78 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.21 398.22 411.96 472.04 614.84 710.19 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.22 396.19 422.48 478.57 617.33 699.70 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.00 395.68 433.59 483.19 619.62 687.80 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.22 397.94 443.70 484.74 621.44 675.51 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.76 403.30 451.53 483.26 621.42 664.81 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.86 411.51 455.40 480.18 617.29 658.45 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.25 421.66 453.75 477.64 609.27 656.92 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.10 432.07 448.19 475.68 600.89 657.70 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.74 438.93 444.25 473.47 595.36 658.70 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 364.32 439.16 445.27 472.69 594.20 659.07 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.45 436.33 447.89 473.83 597.23 658.80 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.97 428.76 455.36 474.04 602.60 658.70 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.04 420.86 463.48 472.15 607.18 660.51 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.92 414.72 464.47 473.71 608.09 665.92 -------------------------------------------------------------------------------- K point *** = 0.328125 0.609375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.01 411.28 457.43 478.86 604.91 674.62 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.47 401.95 454.65 483.12 628.34 659.55 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.58 404.57 445.70 483.40 619.93 670.27 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.34 409.23 435.71 481.13 612.80 679.39 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.92 414.24 426.80 477.22 607.23 686.57 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.48 416.68 421.84 474.14 603.18 691.68 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.26 414.88 422.37 474.49 600.41 694.79 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.24 408.99 428.25 478.03 598.80 696.18 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.97 401.23 437.06 482.22 598.28 696.33 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.02 394.16 445.50 485.13 598.73 695.92 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.13 389.35 450.85 486.48 599.74 695.68 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.29 387.60 451.08 486.89 600.85 696.13 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.79 389.11 446.10 486.28 601.87 697.38 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.27 393.51 437.58 483.81 602.97 699.00 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.59 399.78 427.83 479.42 604.41 700.31 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.77 405.95 419.55 474.49 606.21 700.60 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.06 409.13 416.07 471.62 608.33 699.31 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.52 409.46 417.31 472.86 610.75 696.10 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.33 406.28 423.81 477.25 613.65 690.89 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.43 401.55 433.55 481.94 617.24 683.84 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.22 397.94 443.70 484.74 621.44 675.51 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.08 396.79 452.30 484.94 625.36 667.13 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.50 398.70 457.30 483.45 626.68 661.15 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.23 403.65 456.59 482.18 623.13 660.02 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.31 411.00 450.61 481.27 616.50 662.34 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.09 419.44 442.47 479.29 610.22 665.20 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.06 426.61 435.64 476.55 606.36 666.95 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.22 429.19 433.48 475.38 605.79 666.89 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.37 425.87 437.14 477.08 608.77 664.71 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.62 418.87 444.87 479.54 615.17 660.39 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.07 411.40 453.51 480.58 624.44 654.13 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.02 405.48 459.87 480.36 635.56 646.37 -------------------------------------------------------------------------------- K point *** = 0.328125 0.640625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.93 402.19 460.35 481.23 637.27 647.86 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.96 392.71 454.37 485.64 614.26 678.58 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.34 395.82 449.04 485.20 612.71 680.42 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.39 401.47 440.46 483.19 610.58 683.16 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.60 408.36 431.16 479.43 608.94 685.59 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.57 414.19 424.04 475.49 608.36 686.82 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.43 416.23 422.01 474.09 609.02 686.27 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.07 413.96 425.55 476.42 611.02 683.70 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.55 408.44 433.67 480.48 614.43 679.19 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.83 402.60 443.36 483.58 619.16 673.12 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.08 398.45 452.11 484.52 624.37 666.52 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.49 397.02 457.54 483.89 627.87 661.55 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.50 398.70 457.30 483.45 626.68 661.15 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.76 403.30 451.53 483.26 621.42 664.81 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.21 409.99 442.89 481.73 615.41 669.49 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.93 417.16 434.22 478.62 610.77 673.28 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.14 422.15 428.55 475.76 608.34 675.35 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.14 422.15 428.55 475.76 608.34 675.35 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.93 417.16 434.22 478.62 610.77 673.28 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.21 409.99 442.89 481.73 615.41 669.49 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.76 403.30 451.53 483.26 621.42 664.81 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.50 398.70 457.30 483.45 626.68 661.15 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.49 397.02 457.54 483.89 627.87 661.55 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.08 398.45 452.11 484.52 624.37 666.52 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.83 402.60 443.36 483.58 619.16 673.12 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.55 408.44 433.67 480.48 614.43 679.19 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.07 413.96 425.55 476.42 611.02 683.70 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.43 416.23 422.01 474.09 609.02 686.27 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.57 414.19 424.04 475.49 608.36 686.82 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.60 408.36 431.16 479.43 608.94 685.59 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.39 401.47 440.46 483.19 610.58 683.16 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.34 395.82 449.04 485.20 612.71 680.42 -------------------------------------------------------------------------------- K point *** = 0.328125 0.671875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.96 392.71 454.37 485.64 614.26 678.58 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.34 383.52 447.42 487.21 586.77 713.51 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.80 387.07 446.94 486.44 584.68 712.54 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.87 393.53 441.51 484.32 583.87 711.67 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.34 401.88 433.18 480.70 584.47 710.54 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.28 410.29 425.00 476.36 586.38 708.63 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.03 415.87 420.67 473.47 589.38 705.46 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.69 417.53 421.49 474.21 593.37 700.65 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.40 415.02 427.69 477.82 598.42 694.02 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.26 410.69 437.19 481.37 604.66 685.56 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.87 407.31 447.36 482.69 611.91 675.55 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.73 406.25 456.52 481.13 619.34 664.76 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.38 408.13 462.75 477.74 624.84 655.15 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.54 412.91 462.03 476.47 623.94 651.26 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.18 419.96 454.86 477.37 616.49 653.72 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.46 427.85 446.45 476.81 608.33 657.53 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.63 433.77 440.40 474.99 602.73 660.35 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.51 434.63 439.08 474.51 601.04 661.56 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.06 429.88 442.48 476.45 603.58 661.17 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.53 420.93 449.44 478.66 609.64 659.69 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.86 411.51 455.40 480.18 617.29 658.45 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.23 403.65 456.59 482.18 623.13 660.02 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.08 398.45 452.11 484.52 624.37 666.52 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.25 396.34 443.83 485.13 622.21 676.34 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.94 397.18 433.57 482.87 619.02 686.79 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.56 400.13 422.89 478.03 615.87 696.32 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.56 403.23 414.00 472.24 612.89 704.19 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.33 403.05 410.38 468.23 609.81 710.08 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.20 401.59 410.21 468.48 606.35 713.94 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.97 397.75 414.90 472.76 602.40 715.92 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.04 391.63 424.12 478.56 598.10 716.38 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.88 386.26 434.24 483.55 593.79 715.78 -------------------------------------------------------------------------------- K point *** = 0.328125 0.703125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.06 383.30 442.70 486.46 589.90 714.67 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.47 375.01 434.46 484.09 564.13 748.85 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.81 378.92 438.77 485.18 557.49 747.15 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.68 386.02 437.75 483.89 553.90 745.01 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.16 395.45 431.95 480.69 553.52 742.40 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.72 405.71 423.96 476.35 555.64 739.12 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.10 413.91 418.17 472.54 559.24 734.92 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.01 414.97 420.59 471.60 563.63 729.52 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.48 419.38 420.73 474.30 568.50 722.75 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.32 418.00 427.95 478.29 573.83 714.57 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.54 415.52 437.94 480.77 579.51 705.17 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.00 414.88 447.92 480.35 585.00 695.01 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.40 416.94 456.87 476.82 589.35 684.87 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.53 421.86 464.02 470.71 591.42 675.83 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.39 429.12 462.68 469.12 590.61 668.89 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.18 437.28 454.84 471.26 587.71 664.30 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.20 442.20 450.82 471.03 585.06 661.39 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.99 442.18 450.80 470.77 585.41 659.23 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.70 442.43 447.73 472.64 590.36 657.36 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.12 433.18 451.63 474.85 599.25 656.10 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.25 421.66 453.75 477.64 609.27 656.92 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.31 411.00 450.61 481.27 616.50 662.34 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.83 402.60 443.36 483.58 619.16 673.12 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.94 397.18 433.57 482.87 619.02 686.79 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.33 394.83 422.36 478.76 617.84 700.84 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.07 394.95 410.90 472.02 616.17 713.86 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.38 395.07 401.76 464.39 613.80 725.15 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.39 390.03 399.97 458.50 610.34 734.35 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.32 387.10 398.48 457.12 605.46 741.33 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.71 386.75 397.73 460.74 599.02 746.14 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.98 382.42 404.63 467.31 591.12 748.97 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.54 377.42 415.31 474.43 582.14 750.11 -------------------------------------------------------------------------------- K point *** = 0.328125 0.734375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.10 374.60 426.01 480.38 572.78 749.94 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.14 367.84 415.32 474.13 550.00 783.17 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.18 372.03 423.81 478.39 537.65 781.35 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.72 379.58 427.74 479.94 528.36 778.62 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.06 389.70 425.99 478.53 524.06 775.17 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.01 401.12 419.75 474.94 524.57 771.04 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.76 410.47 414.09 470.91 527.97 766.14 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.99 407.73 421.04 468.66 532.52 760.31 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.68 409.48 424.56 470.04 537.35 753.37 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.94 416.08 424.19 474.07 542.22 745.22 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.04 422.72 425.15 477.84 547.10 735.87 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.23 422.61 434.53 479.42 551.79 725.48 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.45 424.82 443.14 478.33 555.83 714.35 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.58 429.68 449.93 475.24 558.61 703.00 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.61 436.53 453.83 471.78 559.82 691.99 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.75 442.54 455.41 469.91 559.95 681.89 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.31 443.02 459.56 468.90 560.71 673.09 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 378.62 442.65 461.43 468.69 564.87 665.78 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.37 445.66 455.31 470.43 574.20 660.15 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.21 444.68 449.15 472.25 587.46 656.86 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.10 432.07 448.19 475.68 600.89 657.70 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.09 419.44 442.47 479.29 610.22 665.20 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.55 408.44 433.67 480.48 614.43 679.19 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.56 400.13 422.89 478.03 615.87 696.32 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.07 394.95 410.90 472.02 616.17 713.86 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.69 392.67 398.52 463.43 615.60 730.34 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.42 386.33 392.76 453.97 613.81 745.00 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.31 376.50 392.70 446.17 610.37 757.42 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.18 370.88 390.43 442.99 604.94 767.41 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.75 371.27 385.49 445.55 597.37 774.90 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.07 373.46 383.71 452.00 587.71 779.98 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.18 369.92 392.46 459.95 576.20 782.85 -------------------------------------------------------------------------------- K point *** = 0.328125 0.765625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.89 367.27 404.17 467.71 563.34 783.79 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.29 362.58 390.30 459.54 542.67 815.87 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.88 366.94 401.61 465.83 526.80 814.23 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.01 374.72 409.90 470.16 512.33 811.25 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.13 385.17 413.11 472.11 501.82 807.24 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.34 397.16 410.40 471.09 497.77 802.43 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.20 403.51 409.72 467.99 499.44 796.89 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.64 397.88 420.16 465.24 503.74 790.55 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.91 396.96 426.89 465.21 508.67 783.29 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.03 401.50 429.03 468.66 513.48 774.95 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.26 409.23 428.90 473.37 517.98 765.40 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.32 417.84 429.23 476.91 522.14 754.63 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.41 425.60 431.87 478.31 525.81 742.69 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.49 430.69 438.29 477.74 528.69 729.80 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.54 433.55 447.33 475.91 530.69 716.28 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.67 434.56 457.49 473.60 532.46 702.59 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 377.97 434.84 466.31 471.21 536.08 689.30 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 383.62 437.06 467.73 470.92 544.85 677.07 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 381.67 441.82 462.99 470.01 559.85 666.77 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.16 444.33 454.30 470.07 578.25 659.77 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.74 438.93 444.25 473.47 595.36 658.70 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.06 426.61 435.64 476.55 606.36 666.95 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.07 413.96 425.55 476.42 611.02 683.70 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.56 403.23 414.00 472.24 612.89 704.19 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.38 395.07 401.76 464.39 613.80 725.15 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.42 386.33 392.76 453.97 613.81 745.00 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.31 374.12 390.06 442.63 612.43 762.93 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.01 362.73 388.88 432.72 609.14 778.49 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.39 354.46 385.92 427.58 603.60 791.39 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.25 351.77 379.65 429.01 595.66 801.52 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.31 355.69 372.29 435.09 585.31 808.86 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.74 362.75 368.36 443.24 572.74 813.54 -------------------------------------------------------------------------------- K point *** = 0.328125 0.796875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.37 361.90 377.95 451.76 558.32 815.76 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.14 359.26 361.46 443.68 537.89 846.48 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.18 363.72 373.83 451.10 520.69 845.28 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.83 371.57 384.71 456.83 504.01 842.28 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.69 382.06 392.08 460.63 489.73 837.90 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.03 393.46 394.62 462.61 480.23 832.51 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.72 390.10 406.81 462.55 477.26 826.33 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.08 384.30 418.51 460.87 479.73 819.42 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.08 381.40 427.58 460.05 484.42 811.69 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.48 383.91 432.34 462.32 489.43 803.00 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.13 390.36 433.70 467.21 493.98 793.13 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.16 398.21 434.61 472.27 497.84 781.94 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.13 405.74 437.20 475.97 500.97 769.33 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.07 411.91 442.63 477.85 503.42 755.33 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.83 416.31 451.13 478.03 505.42 740.08 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.15 419.61 461.40 476.82 508.18 723.88 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 378.50 423.85 469.53 474.48 515.05 707.21 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 382.36 431.15 470.67 471.70 529.72 690.79 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 379.78 439.61 465.52 469.06 550.65 675.73 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.17 443.40 456.62 469.02 573.77 663.91 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 364.32 439.16 445.27 472.69 594.20 659.07 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.22 429.19 433.48 475.38 605.79 666.89 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.43 416.23 422.01 474.09 609.02 686.27 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.33 403.05 410.38 468.23 609.81 710.08 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.39 390.03 399.97 458.50 610.34 734.35 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.31 376.50 392.70 446.17 610.37 757.42 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.01 362.73 388.88 432.72 609.14 778.49 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.23 349.73 387.24 420.17 606.01 797.06 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.92 338.93 384.52 412.24 600.57 812.81 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.80 332.45 377.55 412.38 592.62 825.54 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.98 332.42 369.06 418.12 582.14 835.18 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.43 338.69 362.34 426.26 569.28 841.76 -------------------------------------------------------------------------------- K point *** = 0.328125 0.828125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.73 349.04 358.92 435.13 554.36 845.44 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.21 330.66 358.59 427.97 532.90 874.61 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.62 342.62 363.18 436.28 515.33 874.08 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.74 354.35 371.10 443.20 497.88 871.27 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.26 364.24 381.32 448.14 482.24 866.70 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.56 370.15 392.93 450.93 470.62 860.84 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.76 370.44 405.12 452.45 464.38 854.05 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.58 366.51 416.91 453.92 462.74 846.51 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.17 362.88 427.08 454.49 465.41 838.22 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.23 363.68 434.04 455.75 470.42 829.05 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.57 368.99 437.12 459.80 475.57 818.76 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.68 376.29 438.66 465.31 479.89 807.12 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.51 383.73 441.28 470.52 482.97 793.93 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.12 390.54 446.34 474.77 484.74 779.08 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.99 396.88 454.05 477.81 485.81 762.59 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.87 404.27 462.45 478.82 489.44 744.59 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 372.79 414.94 466.43 477.17 501.46 725.42 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.87 428.19 464.58 474.17 521.74 705.67 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 370.92 440.10 459.66 470.66 546.74 686.32 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.48 443.43 454.84 469.57 573.44 669.23 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.45 436.33 447.89 473.83 597.23 658.80 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.37 425.87 437.14 477.08 608.77 664.71 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.57 414.19 424.04 475.49 608.36 686.82 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.20 401.59 410.21 468.48 606.35 713.94 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.32 387.10 398.48 457.12 605.46 741.33 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.18 370.88 390.43 442.99 604.94 767.41 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.39 354.46 385.92 427.58 603.60 791.39 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.92 338.93 384.52 412.24 600.57 812.81 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.57 325.31 384.42 399.39 595.30 831.29 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.30 315.06 378.52 396.60 587.53 846.59 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.74 310.38 368.93 402.07 577.20 858.56 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.78 312.51 361.61 410.03 564.43 867.14 -------------------------------------------------------------------------------- K point *** = 0.328125 0.859375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.48 320.02 358.02 418.96 549.51 872.42 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.18 301.08 359.59 412.97 526.42 899.88 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.89 311.89 363.98 421.83 508.87 900.25 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.45 323.63 371.67 429.79 491.20 897.87 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.55 334.63 381.69 436.11 474.92 893.31 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.63 342.98 393.01 439.95 462.33 887.12 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.98 346.79 404.71 441.15 455.68 879.78 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.66 345.78 416.02 442.50 453.45 871.61 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.31 342.79 426.19 446.08 452.94 862.71 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.19 342.38 434.30 449.41 455.49 852.97 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.55 346.70 439.08 452.40 461.20 842.18 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.81 353.68 441.34 457.04 467.03 830.05 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.45 361.27 443.92 461.77 471.92 816.32 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.40 369.06 448.38 465.84 475.58 800.79 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.09 378.42 454.37 470.23 477.97 783.36 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.19 391.96 458.27 477.99 480.23 764.06 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.39 409.11 457.67 478.35 495.95 743.08 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.15 426.58 454.31 476.39 518.49 720.82 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.61 439.56 451.74 472.79 545.42 698.02 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.40 437.18 458.41 469.11 574.74 676.06 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.97 428.76 455.36 474.04 602.60 658.70 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.62 418.87 444.87 479.54 615.17 660.39 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.60 408.36 431.16 479.43 608.94 685.59 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.97 397.75 414.90 472.76 602.40 715.92 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.71 386.75 397.73 460.74 599.02 746.14 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.75 371.27 385.49 445.55 597.37 774.90 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.25 351.77 379.65 429.01 595.66 801.52 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.80 332.45 377.55 412.38 592.62 825.54 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.30 315.06 378.52 396.60 587.53 846.59 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.57 300.84 381.75 382.94 580.03 864.37 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.40 291.43 371.09 387.97 570.00 878.65 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.52 288.87 363.12 395.41 557.52 889.31 -------------------------------------------------------------------------------- K point *** = 0.328125 0.890625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.29 292.79 359.22 403.95 542.85 896.34 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.77 274.42 362.28 399.29 517.93 921.92 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.78 283.16 366.43 408.11 500.63 923.42 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.78 294.03 373.91 416.66 483.00 921.73 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.40 305.40 383.63 424.18 466.40 917.42 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.10 315.39 394.50 429.52 453.10 911.10 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.25 322.05 405.54 430.98 446.45 903.34 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.15 324.23 416.02 430.80 445.75 894.60 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.95 323.08 425.47 433.79 446.21 885.06 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.33 322.27 433.58 439.75 446.63 874.72 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.07 325.61 439.58 445.86 449.05 863.38 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.57 332.47 442.64 449.81 455.99 850.73 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.91 340.44 445.05 453.61 463.21 836.47 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.42 349.95 448.38 457.26 469.52 820.34 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.78 364.22 451.04 463.17 474.66 802.18 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.25 383.34 450.90 473.00 479.74 781.93 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.06 404.13 448.42 477.79 493.89 759.66 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.92 423.98 444.37 477.82 516.47 735.64 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.19 435.39 445.20 475.46 544.17 710.31 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.15 429.34 459.56 470.76 575.25 684.56 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.04 420.86 463.48 472.15 607.18 660.51 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.07 411.40 453.51 480.58 624.44 654.13 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.39 401.47 440.46 483.19 610.58 683.16 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.04 391.63 424.12 478.56 598.10 716.38 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.98 382.42 404.63 467.31 591.12 748.97 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.07 373.46 383.71 452.00 587.71 779.98 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.31 355.69 372.29 435.09 585.31 808.86 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.98 332.42 369.06 418.12 582.14 835.18 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.74 310.38 368.93 402.07 577.20 858.56 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.40 291.43 371.09 387.97 570.00 878.65 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.56 277.06 372.50 379.30 560.34 895.17 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.45 269.41 366.24 383.47 548.28 907.93 -------------------------------------------------------------------------------- K point *** = 0.328125 0.921875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.88 269.28 362.17 390.86 534.01 916.83 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.68 252.42 366.35 387.80 507.30 940.36 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.09 258.17 370.12 395.90 490.40 943.23 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.60 267.35 377.29 404.34 473.01 942.52 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.69 278.40 386.71 412.47 456.35 938.74 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.84 289.41 397.05 419.17 442.53 932.55 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.52 298.33 407.11 421.58 435.91 924.59 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.15 303.53 415.20 421.35 437.30 915.40 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.15 305.05 419.70 426.95 439.88 905.31 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.86 305.20 426.14 433.64 441.65 894.36 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.12 307.70 434.84 439.16 442.94 882.43 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.00 314.48 442.59 444.00 445.52 869.23 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.80 323.18 444.67 448.08 454.02 854.44 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.08 336.13 446.32 452.30 462.58 837.76 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.59 354.60 446.47 459.27 470.22 819.00 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.20 376.07 444.87 468.72 478.14 798.03 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.21 398.29 441.67 475.49 492.14 774.87 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.74 419.26 437.05 478.01 514.09 749.64 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.93 430.22 438.72 477.87 541.87 722.67 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.93 423.15 454.33 475.58 573.77 694.45 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.92 414.72 464.47 473.71 608.09 665.92 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.02 405.48 459.87 480.36 635.56 646.37 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.34 395.82 449.04 485.20 612.71 680.42 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.88 386.26 434.24 483.55 593.79 715.78 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.54 377.42 415.31 474.43 582.14 750.11 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.18 369.92 392.46 459.95 576.20 782.85 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.74 362.75 368.36 443.24 572.74 813.54 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.43 338.69 362.34 426.26 569.28 841.76 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.78 312.51 361.61 410.03 564.43 867.14 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.52 288.87 363.12 395.41 557.52 889.31 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.45 269.41 366.24 383.47 548.28 907.93 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.97 255.69 368.65 377.15 536.68 922.75 -------------------------------------------------------------------------------- K point *** = 0.328125 0.953125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 244.94 251.04 366.53 380.72 522.91 933.58 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.57 236.48 371.36 379.68 494.61 954.91 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.64 238.27 374.05 386.82 478.21 959.36 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.54 245.09 380.53 394.51 461.23 959.91 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.83 255.34 389.57 402.36 444.78 957.00 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.20 266.85 399.26 409.80 430.80 951.27 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.22 277.39 406.20 415.23 424.30 943.40 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.38 285.07 405.99 420.92 427.95 933.99 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.15 289.25 407.17 427.47 432.89 923.48 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.05 291.43 413.07 433.18 436.63 912.02 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.62 294.40 422.28 437.80 439.24 899.52 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.22 300.93 433.02 441.23 441.45 885.75 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.54 311.40 443.02 443.99 444.65 870.41 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.40 326.97 443.89 448.78 454.65 853.20 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.92 346.60 443.28 455.35 464.61 833.89 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.05 368.70 441.27 463.85 475.09 812.35 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.77 391.26 437.84 471.55 489.67 788.54 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.14 412.36 433.04 476.42 511.01 762.55 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.22 426.86 430.91 478.79 538.43 734.59 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.14 419.59 446.29 479.19 570.33 705.04 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.01 411.28 457.43 478.86 604.91 674.62 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.93 402.19 460.35 481.23 637.27 647.86 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.96 392.71 454.37 485.64 614.26 678.58 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.06 383.30 442.70 486.46 589.90 714.67 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.10 374.60 426.01 480.38 572.78 749.94 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.89 367.27 404.17 467.71 563.34 783.79 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.37 361.90 377.95 451.76 558.32 815.76 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.73 349.04 358.92 435.13 554.36 845.44 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.48 320.02 358.02 418.96 549.51 872.42 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.29 292.79 359.22 403.95 542.85 896.34 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.88 269.28 362.17 390.86 534.01 916.83 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 244.94 251.04 366.53 380.72 522.91 933.58 -------------------------------------------------------------------------------- K point *** = 0.328125 0.984375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 239.01 239.32 371.14 375.31 509.67 946.32 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.67 245.12 368.99 374.10 524.21 936.57 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.80 244.67 369.99 380.68 508.46 943.34 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.01 249.47 375.02 388.34 491.38 946.13 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.66 258.58 383.43 396.48 473.75 945.28 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.55 270.07 393.70 404.78 456.68 941.32 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.30 281.85 404.09 412.74 441.97 934.93 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.48 291.81 412.75 419.12 432.90 926.80 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.56 298.19 416.37 424.31 433.11 917.50 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.06 300.78 418.79 430.53 436.80 907.36 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.50 301.47 424.87 436.08 439.80 896.47 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.46 303.28 433.65 440.53 441.93 884.64 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.26 309.00 443.46 443.72 444.05 871.60 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.84 318.73 445.59 446.97 453.30 856.98 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.82 333.85 446.17 451.77 462.31 840.48 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.42 353.19 445.32 459.22 470.37 821.87 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.62 375.19 443.03 468.80 478.71 801.01 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.42 397.89 439.31 475.79 492.77 777.92 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.90 419.39 434.21 478.53 514.62 752.71 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.16 427.72 438.60 478.52 542.34 725.68 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.32 420.14 454.76 476.28 574.24 697.35 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.53 411.53 464.98 474.53 608.64 668.65 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.93 402.19 460.35 481.23 637.27 647.86 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.58 392.48 449.43 486.02 614.83 681.43 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.49 382.87 434.50 484.17 595.72 716.98 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.53 374.00 415.33 474.71 583.94 751.54 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.54 366.54 392.02 459.84 577.94 784.53 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.44 360.95 365.71 442.81 574.45 815.47 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.39 337.62 358.14 425.62 570.96 843.95 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.89 310.51 357.41 409.33 566.07 869.56 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.59 286.04 358.84 394.74 559.10 891.93 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.21 265.99 362.08 382.76 549.79 910.74 -------------------------------------------------------------------------------- K point *** = 0.359375 0.015625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.45 251.69 366.65 374.54 538.10 925.68 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.80 244.67 369.99 380.68 508.46 943.34 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 233.98 243.77 368.19 386.47 493.53 951.91 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.55 247.32 369.80 393.90 477.33 956.43 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.85 254.73 375.13 401.78 460.61 957.11 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.17 264.71 383.26 409.36 444.66 954.40 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.91 275.45 392.85 414.91 432.18 948.88 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.45 284.90 402.16 413.83 429.63 941.20 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.21 291.26 406.35 415.36 433.20 931.95 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.57 294.19 408.47 422.92 436.55 921.52 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.87 295.58 414.70 430.11 438.77 910.04 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.12 298.81 423.88 436.08 440.20 897.46 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.03 306.15 434.32 440.12 442.13 883.55 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.36 315.83 441.81 444.91 445.78 868.03 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.23 329.58 443.29 449.78 455.10 850.65 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.70 348.36 443.69 455.88 464.57 831.17 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.32 369.94 442.51 464.07 474.62 809.50 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.32 392.02 439.72 471.44 489.10 785.60 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.81 412.63 435.43 475.99 510.51 759.57 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.89 428.66 431.77 478.15 538.00 731.63 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.69 422.47 446.07 478.43 569.88 702.17 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.36 414.40 457.02 478.02 604.35 671.92 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.02 405.48 459.87 480.36 635.56 646.37 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.74 396.11 453.89 484.80 611.95 677.76 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.50 386.80 442.30 485.73 587.87 713.62 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.18 378.17 425.74 479.90 570.97 748.65 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.63 370.88 404.19 467.58 561.64 782.24 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.82 365.34 378.62 451.96 556.69 813.95 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.97 349.55 363.21 435.56 552.78 843.36 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.62 321.49 362.17 419.52 547.97 870.09 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.49 295.05 363.41 404.53 541.38 893.78 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.39 272.16 366.34 391.46 532.61 914.09 -------------------------------------------------------------------------------- K point *** = 0.359375 0.046875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.07 254.25 369.95 381.88 521.59 930.69 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.01 249.47 375.02 388.34 491.38 946.13 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.55 247.32 369.80 393.90 477.33 956.43 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 225.57 250.56 367.62 400.85 462.12 962.75 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.89 257.45 369.35 407.78 446.71 965.20 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.18 266.65 374.65 412.92 433.28 964.09 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.84 276.42 382.57 410.52 428.53 959.89 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.13 284.78 391.65 403.44 431.40 953.16 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.28 290.03 396.81 404.58 434.61 944.41 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.44 292.14 399.65 413.59 436.69 934.06 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.60 293.42 406.53 422.56 437.61 922.30 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.48 297.44 416.11 430.35 437.97 909.15 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.13 305.86 426.76 435.38 439.81 894.48 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.96 316.98 436.02 438.22 444.68 878.09 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.08 330.38 437.65 448.15 449.83 859.80 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.06 347.29 439.18 455.00 458.50 839.44 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.57 367.19 440.09 461.17 469.76 816.94 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.76 387.73 439.44 467.37 484.92 792.29 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.91 406.69 436.94 472.40 506.15 765.58 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.24 422.92 432.85 475.91 533.26 737.03 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.94 426.48 437.15 478.00 564.60 707.08 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.16 419.50 447.58 479.15 597.87 676.77 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.07 411.40 453.51 480.58 624.44 654.13 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.75 402.69 452.95 483.18 607.39 676.28 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.23 393.90 445.97 484.96 580.56 710.75 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.42 385.68 433.19 482.30 558.73 745.41 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.21 378.68 414.54 473.18 545.19 778.97 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.63 373.29 390.73 459.55 538.18 810.88 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.98 361.64 371.85 444.46 533.58 840.69 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.83 333.81 370.31 429.26 528.74 868.04 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.94 306.48 371.38 414.50 522.43 892.58 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.18 281.92 374.11 400.87 514.14 913.98 -------------------------------------------------------------------------------- K point *** = 0.359375 0.078125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.13 261.76 377.24 390.05 503.75 931.92 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.66 258.58 383.43 396.48 473.75 945.28 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.85 254.73 375.13 401.78 460.61 957.11 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.89 257.45 369.35 407.78 446.71 965.20 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 218.91 264.04 367.24 412.31 433.88 969.56 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 218.27 272.69 369.01 409.63 428.33 970.34 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 221.71 281.47 374.26 400.34 430.58 967.87 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.68 288.19 381.98 393.36 433.54 962.56 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.37 291.33 388.94 394.32 435.42 954.83 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.80 291.52 394.03 403.72 435.97 945.03 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.71 291.75 402.13 414.07 435.45 933.37 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.53 295.76 412.02 423.64 434.68 919.92 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.90 305.25 422.30 429.62 436.72 904.66 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.93 318.42 429.27 433.47 443.52 887.50 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.58 333.69 430.03 443.03 450.45 868.32 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.65 350.78 431.36 453.13 456.63 847.06 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.43 369.28 433.39 461.46 465.38 823.69 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.92 387.65 435.20 466.07 480.90 798.26 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.91 404.06 435.72 469.94 502.11 770.88 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.48 417.81 434.33 473.16 528.92 741.81 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.82 428.49 431.61 475.74 559.61 711.58 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.13 425.40 438.63 477.76 591.44 681.61 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.62 418.87 444.87 479.54 615.17 660.39 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.48 411.37 447.18 481.40 602.32 676.28 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.78 403.50 444.51 482.90 574.53 708.46 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.55 395.92 436.18 482.12 548.67 742.15 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.77 389.30 421.53 476.29 530.16 775.18 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.54 384.05 400.59 465.11 520.15 806.78 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.20 373.15 382.55 451.68 514.47 836.51 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.34 346.09 380.79 437.83 509.38 863.99 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.76 318.85 381.63 423.97 503.19 888.90 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.32 293.79 384.17 410.48 495.25 910.94 -------------------------------------------------------------------------------- K point *** = 0.359375 0.109375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.48 272.61 387.26 398.70 485.40 929.82 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.55 270.07 393.70 404.78 456.68 941.32 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.17 264.71 383.26 409.36 444.66 954.40 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 226.18 266.65 374.65 412.92 433.28 964.09 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 218.27 272.69 369.01 409.63 428.33 970.34 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 214.45 280.49 367.01 399.66 430.35 973.19 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.01 287.60 368.82 390.68 433.08 972.76 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 219.74 291.57 374.04 386.49 434.76 969.30 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.03 291.40 381.69 388.87 435.03 963.06 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.96 288.90 390.58 396.93 433.99 954.28 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.20 287.57 400.31 407.69 432.15 943.16 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.83 291.12 410.39 418.09 430.91 929.78 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.75 301.52 419.90 423.01 435.23 914.21 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.77 316.92 421.49 430.37 444.20 896.44 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.33 334.97 420.96 439.65 452.84 876.47 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.96 354.43 421.51 449.23 460.25 854.34 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.38 374.10 423.38 459.52 467.11 830.08 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.45 392.07 426.22 467.12 478.95 803.80 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.45 406.57 429.20 470.59 499.27 775.68 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.02 417.45 431.25 472.62 525.70 746.02 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.01 425.70 431.63 474.10 555.85 715.44 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.42 429.41 432.64 475.52 586.58 685.59 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.37 425.87 437.14 477.08 608.77 664.71 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.07 420.56 439.55 478.71 598.40 676.56 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.73 414.28 438.88 480.02 570.52 706.49 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.50 407.75 434.04 480.07 541.98 739.00 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.51 401.69 423.60 476.95 518.63 771.20 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.94 396.59 406.54 468.60 504.41 802.16 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.15 382.57 394.18 456.90 497.02 831.40 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.75 356.74 392.58 444.62 491.36 858.57 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.55 330.54 393.05 432.20 485.01 883.39 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.45 306.03 395.21 419.65 477.19 905.61 -------------------------------------------------------------------------------- K point *** = 0.359375 0.140625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.89 284.90 398.33 407.58 467.70 924.99 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.30 281.85 404.09 412.74 441.97 934.93 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.91 275.45 392.85 414.91 432.18 948.88 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.84 276.42 382.57 410.52 428.53 959.89 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 221.71 281.47 374.26 400.34 430.58 967.87 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 215.01 287.60 368.82 390.68 433.08 972.76 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 212.48 291.77 366.91 384.93 434.56 974.53 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 214.35 291.72 368.78 385.30 434.61 973.20 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 220.40 287.79 374.13 391.58 433.25 968.84 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.96 282.78 382.27 401.40 430.89 961.53 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.81 279.99 392.28 411.66 428.90 951.38 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.88 282.77 403.23 416.62 432.09 938.49 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.16 293.61 413.78 415.69 441.35 922.95 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.96 310.84 412.41 425.42 451.21 904.85 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.15 331.53 410.71 435.81 460.07 884.30 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.64 353.97 410.39 445.98 467.64 861.40 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.48 376.53 411.65 456.44 474.36 836.30 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.64 396.80 414.43 466.68 482.85 809.15 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.37 412.10 418.38 472.79 499.47 780.21 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.19 421.70 422.95 474.95 524.48 749.82 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.76 426.43 427.94 475.41 553.96 718.65 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.82 428.78 431.54 475.30 584.03 688.40 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.22 429.19 433.48 475.38 605.79 666.89 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.90 427.61 433.75 475.94 596.84 676.10 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.98 424.17 432.29 476.70 569.01 704.41 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.68 419.50 428.37 476.92 539.07 735.89 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.24 414.48 420.50 475.48 512.32 767.19 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.92 406.83 409.97 470.29 493.18 797.33 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.13 387.15 406.59 460.39 483.15 825.82 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.46 363.79 404.79 449.38 476.61 852.37 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.80 339.65 404.69 438.55 469.81 876.73 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.11 316.73 406.18 427.52 461.78 898.72 -------------------------------------------------------------------------------- K point *** = 0.359375 0.171875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.95 296.63 408.84 416.22 452.38 918.16 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.48 291.81 412.75 419.12 432.90 926.80 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.45 284.90 402.16 413.83 429.63 941.20 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.13 284.78 391.65 403.44 431.40 953.16 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.68 288.19 381.98 393.36 433.54 962.56 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 219.74 291.57 374.04 386.49 434.76 969.30 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 214.35 291.72 368.78 385.30 434.61 973.20 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 213.14 287.54 366.94 390.40 433.03 974.10 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.32 280.73 368.89 399.82 430.40 971.84 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.65 274.05 374.43 409.92 428.38 966.33 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.27 270.15 382.91 413.71 432.69 957.55 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.24 271.94 393.39 410.80 443.24 945.55 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.61 282.54 403.78 407.88 454.38 930.45 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.00 300.82 402.18 417.82 464.50 912.40 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.64 323.34 399.64 429.76 473.15 891.57 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.68 348.11 398.56 441.46 480.31 868.15 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.32 373.46 399.26 453.02 486.43 842.36 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.63 396.75 401.98 464.48 493.16 814.43 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.90 405.58 415.84 473.75 505.16 784.66 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.62 410.89 427.74 477.94 526.61 753.43 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.53 416.67 433.94 478.65 554.54 721.40 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.41 422.17 436.15 477.83 584.07 690.18 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.06 426.61 435.64 476.55 606.36 666.95 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.26 429.28 433.20 475.43 598.23 674.27 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.84 428.67 430.35 474.67 570.04 701.81 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.74 423.01 428.84 474.02 539.40 732.58 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.09 414.74 425.96 472.81 511.11 763.12 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.09 402.61 422.33 469.97 488.31 792.43 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.11 385.75 418.96 463.06 474.21 820.08 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.74 365.50 416.68 452.70 466.75 845.81 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.91 344.27 415.84 442.77 459.66 869.44 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.79 323.91 416.41 433.16 451.37 890.87 -------------------------------------------------------------------------------- K point *** = 0.359375 0.203125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.19 305.75 417.89 423.37 441.98 910.00 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.56 298.19 416.37 424.31 433.11 917.50 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.21 291.26 406.35 415.36 433.20 931.95 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.28 290.03 396.81 404.58 434.61 944.41 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.37 291.33 388.94 394.32 435.42 954.83 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 228.03 291.40 381.69 388.87 435.03 963.06 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 220.40 287.79 374.13 391.58 433.25 968.84 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.32 280.73 368.89 399.82 430.40 971.84 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 216.39 272.25 367.10 409.55 428.33 971.71 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 220.80 264.68 369.16 412.46 433.72 968.17 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.27 260.04 374.89 408.37 445.89 961.06 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.40 260.67 383.54 402.98 458.86 950.34 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.61 270.28 392.43 399.78 470.91 936.09 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.38 288.75 391.27 408.85 481.43 918.50 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.36 312.09 388.27 421.69 490.16 897.78 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.80 338.18 386.68 434.89 497.15 874.20 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.95 365.27 387.03 448.03 502.79 848.01 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.92 387.37 393.32 460.96 508.29 819.52 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.00 392.61 414.47 472.58 516.80 789.05 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.73 398.40 430.32 479.78 533.25 757.01 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.87 405.23 439.58 481.76 558.07 723.99 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.34 412.48 443.28 480.97 586.61 691.33 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.09 419.44 442.47 479.29 610.22 665.20 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.99 425.45 438.18 477.49 602.62 670.77 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.87 429.38 431.92 475.63 573.31 698.41 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.49 422.10 432.99 473.60 542.01 728.87 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.69 411.15 433.57 471.25 513.18 758.83 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.35 397.47 432.31 468.34 489.17 787.41 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.53 380.81 429.94 464.29 471.34 814.23 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.54 362.28 427.54 456.18 461.32 839.08 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.22 343.70 426.00 446.01 454.82 861.85 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.98 326.28 425.56 436.50 447.41 882.49 -------------------------------------------------------------------------------- K point *** = 0.359375 0.234375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.13 310.67 424.81 427.98 439.17 901.03 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.06 300.78 418.79 430.53 436.80 907.36 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.57 294.19 408.47 422.92 436.55 921.52 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.44 292.14 399.65 413.59 436.69 934.06 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.80 291.52 394.03 403.72 435.97 945.03 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.96 288.90 390.58 396.93 433.99 954.28 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.96 282.78 382.27 401.40 430.89 961.53 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 223.65 274.05 374.43 409.92 428.38 966.33 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 220.80 264.68 369.16 412.46 433.72 968.17 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 221.99 256.63 367.41 407.59 447.00 966.61 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.49 251.55 369.57 401.08 461.74 961.32 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.83 251.09 375.27 394.81 475.94 952.16 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.58 258.92 381.74 391.63 488.80 939.15 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.55 276.64 380.61 399.51 499.88 922.45 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.84 299.76 377.44 412.37 508.97 902.30 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.61 326.14 375.56 426.49 516.10 878.98 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.10 354.05 375.68 441.02 521.57 852.80 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.46 375.76 383.81 455.55 526.30 824.11 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.98 380.85 407.91 469.24 532.49 793.24 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.23 386.93 427.73 479.57 544.23 760.60 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.01 394.39 441.36 483.88 564.54 726.71 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.35 402.63 448.93 483.40 591.07 692.52 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.31 411.00 450.61 481.27 616.50 662.34 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.90 418.89 446.63 479.47 609.60 665.71 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.02 425.74 438.35 477.92 578.30 694.18 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.52 426.29 432.02 475.83 546.13 724.57 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.20 412.71 435.64 472.77 516.89 754.10 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.86 396.21 437.68 468.67 492.67 782.06 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.27 377.42 437.81 463.71 474.44 808.12 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.23 357.95 436.48 458.33 461.19 832.11 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.80 340.01 434.75 450.44 452.84 853.98 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.12 324.69 433.47 440.32 447.11 873.74 -------------------------------------------------------------------------------- K point *** = 0.359375 0.265625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.28 311.56 429.23 433.50 441.03 891.49 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.50 301.47 424.87 436.08 439.80 896.47 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.87 295.58 414.70 430.11 438.77 910.04 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.60 293.42 406.53 422.56 437.61 922.30 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.71 291.75 402.13 414.07 435.45 933.37 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.20 287.57 400.31 407.69 432.15 943.16 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.81 279.99 392.28 411.66 428.90 951.38 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.27 270.15 382.91 413.71 432.69 957.55 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.27 260.04 374.89 408.37 445.89 961.06 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 227.49 251.55 369.57 401.08 461.74 961.32 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.59 246.19 367.88 393.61 477.80 957.87 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.01 244.99 370.00 386.90 492.99 950.45 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 244.86 250.44 373.50 383.67 506.66 938.98 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.90 266.39 371.61 390.39 518.41 923.56 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.50 288.13 368.28 402.56 528.02 904.42 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.58 313.77 366.21 416.88 535.47 881.83 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.32 341.67 366.11 432.29 541.00 856.15 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.91 365.95 372.26 448.12 545.32 827.71 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.69 371.44 397.71 463.61 549.99 796.89 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.24 377.76 420.48 476.79 558.08 764.07 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.45 385.64 438.02 484.38 573.37 729.70 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.40 394.49 450.13 485.28 596.45 694.39 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.23 403.65 456.59 482.18 623.13 660.02 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.00 412.54 455.74 479.42 617.95 659.76 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.67 420.70 447.48 478.75 584.11 689.43 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.14 427.58 434.88 478.05 551.03 719.68 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.25 418.38 433.99 475.97 521.32 748.76 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.87 399.76 438.29 471.99 496.86 776.12 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.84 378.87 441.03 465.91 478.90 801.46 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.99 357.38 442.05 458.48 466.61 824.65 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.02 337.71 441.46 452.08 456.57 845.64 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.57 322.23 440.01 446.30 447.49 864.49 -------------------------------------------------------------------------------- K point *** = 0.359375 0.296875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.22 310.76 435.56 438.89 443.04 881.36 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.46 303.28 433.65 440.53 441.93 884.64 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.12 298.81 423.88 436.08 440.20 897.46 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.48 297.44 416.11 430.35 437.97 909.15 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.53 295.76 412.02 423.64 434.68 919.92 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.83 291.12 410.39 418.09 430.91 929.78 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.88 282.77 403.23 416.62 432.09 938.49 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.24 271.94 393.39 410.80 443.24 945.55 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.40 260.67 383.54 402.98 458.86 950.34 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.83 251.09 375.27 394.81 475.94 952.16 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.01 244.99 370.00 386.90 492.99 950.45 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.70 243.40 368.56 379.86 509.07 944.82 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.62 246.62 369.14 376.19 523.55 935.08 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.69 259.68 365.71 381.93 536.01 921.26 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.67 278.75 361.99 392.93 546.21 903.52 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.01 302.55 359.73 406.78 554.10 882.14 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.93 329.48 359.43 422.43 559.84 857.43 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.69 357.10 361.96 439.08 563.96 829.77 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.68 365.26 385.50 455.90 567.60 799.51 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.53 371.74 410.06 471.33 573.01 767.07 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.19 379.90 430.40 482.39 583.62 732.87 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.79 389.11 446.10 486.28 601.87 697.38 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.50 398.70 457.30 483.45 626.68 661.15 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.38 408.13 462.75 477.74 624.84 655.15 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.40 416.94 456.87 476.82 589.35 684.87 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.45 424.82 443.14 478.33 555.83 714.35 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.41 425.60 431.87 478.31 525.81 742.69 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.13 405.74 437.20 475.97 500.97 769.33 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.51 383.73 441.28 470.52 482.97 793.93 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.45 361.27 443.92 461.77 471.92 816.32 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.91 340.44 445.05 453.61 463.21 836.47 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.80 323.18 444.67 448.08 454.02 854.44 -------------------------------------------------------------------------------- K point *** = 0.359375 0.328125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.54 311.40 443.02 443.99 444.65 870.41 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.26 309.00 443.46 443.72 444.05 871.60 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.03 306.15 434.32 440.12 442.13 883.55 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.13 305.86 426.76 435.38 439.81 894.48 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.90 305.25 422.30 429.62 436.72 904.66 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.75 301.52 419.90 423.01 435.23 914.21 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.16 293.61 413.78 415.69 441.35 922.95 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.61 282.54 403.78 407.88 454.38 930.45 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.61 270.28 392.43 399.78 470.91 936.09 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.58 258.92 381.74 391.63 488.80 939.15 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 244.86 250.44 373.50 383.67 506.66 938.98 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.62 246.62 369.14 376.19 523.55 935.08 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.82 248.82 369.48 369.48 538.80 927.17 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.24 257.72 363.84 374.62 551.98 915.17 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.45 273.09 359.59 384.04 562.81 899.17 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.92 293.95 357.06 396.89 571.18 879.39 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.96 318.76 356.58 412.21 577.20 856.13 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.92 345.69 358.41 429.11 581.25 829.74 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.21 362.69 372.76 446.70 584.17 800.61 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.51 369.24 398.03 463.67 587.60 769.17 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.82 377.55 420.02 477.57 594.20 735.89 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.30 386.96 438.07 485.16 606.81 701.39 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.08 396.79 452.30 484.94 625.36 667.13 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.22 406.50 462.99 478.17 625.16 656.46 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.66 415.65 465.21 472.07 592.40 681.47 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.29 423.94 450.61 476.51 559.50 708.93 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.96 431.16 432.53 478.92 529.62 735.93 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.52 411.85 437.13 478.77 504.53 761.53 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.83 389.41 441.75 475.17 486.06 785.23 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.81 366.78 444.97 466.03 476.37 806.78 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.40 345.97 446.75 456.74 469.50 826.08 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.61 328.74 447.11 450.33 461.75 843.18 -------------------------------------------------------------------------------- K point *** = 0.359375 0.359375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.52 316.30 446.08 446.39 452.94 858.26 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.84 318.73 445.59 446.97 453.30 856.98 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.36 315.83 441.81 444.91 445.78 868.03 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.96 316.98 436.02 438.22 444.68 878.09 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.93 318.42 429.27 433.47 443.52 887.50 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.77 316.92 421.49 430.37 444.20 896.44 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.96 310.84 412.41 425.42 451.21 904.85 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.00 300.82 402.18 417.82 464.50 912.40 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.38 288.75 391.27 408.85 481.43 918.50 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.55 276.64 380.61 399.51 499.88 922.45 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.90 266.39 371.61 390.39 518.41 923.56 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.69 259.68 365.71 381.93 536.01 921.26 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.24 257.72 363.84 374.62 551.98 915.17 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.42 261.46 364.53 370.69 565.84 905.10 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.33 272.72 361.56 376.48 577.28 891.07 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.71 289.67 358.78 387.85 586.15 873.22 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.93 311.09 357.98 402.42 592.48 851.82 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.25 335.36 359.67 419.11 596.54 827.19 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.10 359.73 364.92 436.94 598.94 799.73 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.16 369.82 386.10 454.70 600.85 769.90 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.44 378.35 408.46 470.45 604.16 738.30 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.08 387.92 427.77 481.29 611.14 705.87 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.22 397.94 443.70 484.74 621.44 675.51 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.88 407.85 456.32 480.70 618.98 663.50 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.97 417.23 464.90 471.72 592.13 680.05 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.34 425.73 455.17 473.95 561.17 703.81 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.82 432.68 437.94 478.16 532.08 728.59 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.22 416.63 439.59 480.01 507.05 752.65 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.39 394.44 444.33 478.69 487.94 775.16 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.19 372.18 447.64 469.51 479.62 795.71 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.54 351.89 449.44 459.42 474.82 814.10 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.27 335.49 449.63 452.72 468.80 830.33 -------------------------------------------------------------------------------- K point *** = 0.359375 0.390625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.35 325.28 447.90 449.30 461.48 844.53 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.82 333.85 446.17 451.77 462.31 840.48 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.23 329.58 443.29 449.78 455.10 850.65 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.08 330.38 437.65 448.15 449.83 859.80 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.58 333.69 430.03 443.03 450.45 868.32 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.33 334.97 420.96 439.65 452.84 876.47 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.15 331.53 410.71 435.81 460.07 884.30 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.64 323.34 399.64 429.76 473.15 891.57 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.36 312.09 388.27 421.69 490.16 897.78 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.84 299.76 377.44 412.37 508.97 902.30 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.50 288.13 368.28 402.56 528.02 904.42 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.67 278.75 361.99 392.93 546.21 903.52 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.45 273.09 359.59 384.04 562.81 899.17 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.33 272.72 361.56 376.48 577.28 891.07 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.01 279.28 366.37 372.21 589.28 879.15 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.08 291.70 364.92 380.26 598.62 863.48 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.57 308.59 363.42 393.99 605.26 844.26 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.63 328.83 364.51 410.24 609.37 821.81 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.49 350.73 368.77 427.88 611.38 796.50 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.77 369.99 378.68 445.77 612.08 768.86 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.43 381.07 397.76 462.32 612.72 739.60 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.61 391.17 416.92 475.21 614.70 710.07 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.43 401.55 433.55 481.94 617.24 683.84 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.91 411.80 447.03 481.46 610.94 671.81 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.91 421.47 456.25 475.66 588.66 680.67 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.26 430.10 454.43 473.13 560.50 699.34 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.73 435.07 442.47 476.83 532.81 720.91 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.07 419.31 445.27 479.92 508.29 742.77 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.03 398.31 449.85 480.69 488.65 763.67 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.34 377.28 452.93 471.79 481.56 782.95 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.36 358.91 453.98 461.54 478.83 800.29 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.28 346.80 451.59 456.76 474.64 815.58 -------------------------------------------------------------------------------- K point *** = 0.359375 0.421875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.45 339.89 448.24 454.50 469.02 828.91 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.42 353.19 445.32 459.22 470.37 821.87 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.70 348.36 443.69 455.88 464.57 831.17 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.06 347.29 439.18 455.00 458.50 839.44 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.65 350.78 431.36 453.13 456.63 847.06 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.96 354.43 421.51 449.23 460.25 854.34 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.64 353.97 410.39 445.98 467.64 861.40 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.68 348.11 398.56 441.46 480.31 868.15 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.80 338.18 386.68 434.89 497.15 874.20 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.61 326.14 375.56 426.49 516.10 878.98 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.58 313.77 366.21 416.88 535.47 881.83 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.01 302.55 359.73 406.78 554.10 882.14 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.92 293.95 357.06 396.89 571.18 879.39 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.71 289.67 358.78 387.85 586.15 873.22 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.08 291.70 364.92 380.26 598.62 863.48 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.10 300.00 374.07 375.65 608.36 850.16 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.98 312.65 371.44 388.57 615.27 833.39 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.48 328.42 371.30 404.30 619.43 813.45 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.65 346.35 374.46 421.39 621.13 790.72 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.67 365.05 381.17 438.77 620.86 765.76 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.24 381.85 392.34 455.10 619.37 739.42 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.42 394.78 407.97 468.61 617.28 713.28 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.33 406.28 423.81 477.25 613.65 690.89 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.97 417.26 437.40 479.68 603.51 679.29 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.21 427.43 447.21 476.80 583.43 682.57 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.80 435.86 449.82 473.67 558.00 695.69 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.42 435.19 448.63 475.48 532.08 713.20 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.69 420.13 453.65 478.80 508.47 732.12 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.06 401.53 458.10 481.03 488.87 750.85 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.38 383.84 460.12 473.95 482.18 768.48 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.45 371.43 456.86 467.21 481.33 784.53 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.86 364.48 450.96 465.17 479.01 798.76 -------------------------------------------------------------------------------- K point *** = 0.359375 0.453125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.14 358.87 447.12 462.70 475.30 811.15 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.62 375.19 443.03 468.80 478.71 801.01 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.32 369.94 442.51 464.07 474.62 809.50 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.57 367.19 440.09 461.17 469.76 816.94 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.43 369.28 433.39 461.46 465.38 823.69 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.38 374.10 423.38 459.52 467.11 830.08 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.48 376.53 411.65 456.44 474.36 836.30 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.32 373.46 399.26 453.02 486.43 842.36 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.95 365.27 387.03 448.03 502.79 848.01 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.10 354.05 375.68 441.02 521.57 852.80 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.32 341.67 366.11 432.29 541.00 856.15 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.93 329.48 359.43 422.43 559.84 857.43 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.96 318.76 356.58 412.21 577.20 856.13 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.93 311.09 357.98 402.42 592.48 851.82 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.57 308.59 363.42 393.99 605.26 844.26 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.98 312.65 371.44 388.57 615.27 833.39 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.32 321.91 376.24 391.84 622.36 819.27 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.79 334.35 376.68 404.62 626.54 802.12 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.21 348.70 378.96 420.20 627.96 782.33 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.71 364.16 384.52 436.25 626.90 760.47 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.46 379.98 393.32 451.37 623.75 737.48 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.09 395.32 404.64 464.09 618.65 715.01 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.52 409.46 417.31 472.86 610.75 696.10 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.73 422.16 429.61 476.58 597.72 685.21 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.54 432.91 439.89 475.65 578.39 684.80 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.64 438.32 448.12 473.35 555.12 692.81 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.52 433.14 456.06 474.01 531.17 705.77 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.39 420.55 462.69 476.89 509.14 721.07 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.70 406.31 466.31 479.68 491.44 737.00 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.92 395.63 463.44 481.19 482.32 752.48 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.82 389.81 455.37 478.92 482.92 766.87 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.52 385.49 448.52 476.66 482.92 779.82 -------------------------------------------------------------------------------- K point *** = 0.359375 0.484375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.43 380.68 444.54 473.27 481.53 791.18 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.42 397.89 439.31 475.79 492.77 777.92 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.32 392.02 439.72 471.44 489.10 785.60 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.76 387.73 439.44 467.37 484.92 792.29 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.92 387.65 435.20 466.07 480.90 798.26 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.45 392.07 426.22 467.12 478.95 803.80 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.64 396.80 414.43 466.68 482.85 809.15 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.63 396.75 401.98 464.48 493.16 814.43 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.92 387.37 393.32 460.96 508.29 819.52 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.46 375.76 383.81 455.55 526.30 824.11 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.91 365.95 372.26 448.12 545.32 827.71 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.69 357.10 361.96 439.08 563.96 829.77 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.92 345.69 358.41 429.11 581.25 829.74 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.25 335.36 359.67 419.11 596.54 827.19 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.63 328.83 364.51 410.24 609.37 821.81 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.48 328.42 371.30 404.30 619.43 813.45 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.79 334.35 376.68 404.62 626.54 802.12 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.36 344.49 378.65 413.02 630.63 788.01 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.31 356.74 380.53 425.87 631.76 771.45 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.56 369.64 385.25 439.86 630.07 753.04 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.41 382.37 393.66 453.08 625.71 733.71 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.09 395.32 404.64 464.09 618.65 715.01 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.06 409.13 416.07 471.62 608.33 699.31 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.01 423.37 426.47 474.90 593.85 689.38 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.62 433.62 437.85 474.36 575.22 686.72 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.36 436.41 450.41 472.49 554.04 690.57 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.36 432.12 460.79 472.64 532.74 699.02 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.90 423.29 467.62 474.76 514.18 710.20 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.23 415.56 468.01 477.20 502.23 722.66 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 364.73 411.91 460.76 479.38 498.44 735.37 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.52 410.06 451.63 480.58 497.93 747.60 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.64 407.53 444.53 480.49 497.28 758.91 -------------------------------------------------------------------------------- K point *** = 0.359375 0.515625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.34 403.40 440.51 478.92 495.57 769.04 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.90 419.39 434.21 478.53 514.62 752.71 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.81 412.63 435.43 475.99 510.51 759.57 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.91 406.69 436.94 472.40 506.15 765.58 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.91 404.06 435.72 469.94 502.11 770.88 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.45 406.57 429.20 470.59 499.27 775.68 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.37 412.10 418.38 472.79 499.47 780.21 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.90 405.58 415.84 473.75 505.16 784.66 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.00 392.61 414.47 472.58 516.80 789.05 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.98 380.85 407.91 469.24 532.49 793.24 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.69 371.44 397.71 463.61 549.99 796.89 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.68 365.26 385.50 455.90 567.60 799.51 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.21 362.69 372.76 446.70 584.17 800.61 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.10 359.73 364.92 436.94 598.94 799.73 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.49 350.73 368.77 427.88 611.38 796.50 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.65 346.35 374.46 421.39 621.13 790.72 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.21 348.70 378.96 420.20 627.96 782.33 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.31 356.74 380.53 425.87 631.76 771.45 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.02 367.92 381.15 436.23 632.53 758.39 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.38 379.28 384.58 448.15 630.34 743.69 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.38 386.41 395.47 459.46 625.27 728.22 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.42 394.78 407.97 468.61 617.28 713.28 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.77 405.95 419.55 474.49 606.21 700.60 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.74 419.16 429.33 476.58 591.94 691.91 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.67 432.79 436.54 475.51 574.97 688.13 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.69 437.78 447.06 473.52 556.79 688.96 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.35 434.71 457.87 472.94 539.71 693.39 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 377.08 429.60 464.29 473.24 526.85 700.29 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 372.48 427.26 463.01 474.37 520.68 708.72 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.19 427.93 455.43 476.32 519.66 717.91 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.43 428.87 446.69 477.95 520.06 727.29 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.40 428.25 439.44 479.09 519.69 736.41 -------------------------------------------------------------------------------- K point *** = 0.359375 0.546875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.97 425.10 435.13 479.46 517.84 744.96 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.16 427.72 438.60 478.52 542.34 725.68 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.89 428.66 431.77 478.15 538.00 731.63 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.24 422.92 432.85 475.91 533.26 737.03 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.48 417.81 434.33 473.16 528.92 741.81 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.02 417.45 431.25 472.62 525.70 746.02 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.19 421.70 422.95 474.95 524.48 749.82 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.62 410.89 427.74 477.94 526.61 753.43 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.73 398.40 430.32 479.78 533.25 757.01 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.23 386.93 427.73 479.57 544.23 760.60 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.24 377.76 420.48 476.79 558.08 764.07 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.53 371.74 410.06 471.33 573.01 767.07 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.51 369.24 398.03 463.67 587.60 769.17 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.16 369.82 386.10 454.70 600.85 769.90 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.77 369.99 378.68 445.77 612.08 768.86 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.67 365.05 381.17 438.77 620.86 765.76 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.71 364.16 384.52 436.25 626.90 760.47 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.56 369.64 385.25 439.86 630.07 753.04 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.38 379.28 384.58 448.15 630.34 743.69 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.22 383.53 392.17 458.24 627.79 732.88 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.97 385.82 404.72 467.80 622.53 721.33 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.61 391.17 416.92 475.21 614.70 710.07 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.59 399.78 427.83 479.42 604.41 700.31 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.10 411.11 436.51 480.16 591.92 693.18 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.20 424.14 441.78 478.32 577.97 689.21 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.70 437.31 442.33 475.84 564.03 688.19 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.72 438.85 448.68 473.89 552.26 689.50 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 371.49 435.47 455.42 472.35 544.92 692.43 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 367.12 435.79 454.59 472.62 542.72 696.50 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.66 438.08 449.68 473.72 543.89 701.41 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.97 436.09 448.20 474.40 545.79 706.99 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.97 431.39 448.01 475.48 546.56 713.06 -------------------------------------------------------------------------------- K point *** = 0.359375 0.578125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.44 428.30 444.71 477.24 545.39 719.39 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.32 420.14 454.76 476.28 574.24 697.35 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.69 422.47 446.07 478.43 569.88 702.17 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.94 426.48 437.15 478.00 564.60 707.08 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.82 428.49 431.61 475.74 559.61 711.58 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.01 425.70 431.63 474.10 555.85 715.44 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.76 426.43 427.94 475.41 553.96 718.65 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.53 416.67 433.94 478.65 554.54 721.40 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.87 405.23 439.58 481.76 558.07 723.99 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.01 394.39 441.36 483.88 564.54 726.71 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.45 385.64 438.02 484.38 573.37 729.70 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.19 379.90 430.40 482.39 583.62 732.87 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.82 377.55 420.02 477.57 594.20 735.89 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.44 378.35 408.46 470.45 604.16 738.30 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.43 381.07 397.76 462.32 612.72 739.60 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.24 381.85 392.34 455.10 619.37 739.42 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.46 379.98 393.32 451.37 623.75 737.48 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.41 382.37 393.66 453.08 625.71 733.71 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.38 386.41 395.47 459.46 625.27 728.22 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.97 385.82 404.72 467.80 622.53 721.33 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.96 385.54 416.37 475.64 617.74 713.62 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.08 387.92 427.77 481.29 611.14 705.87 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.27 393.51 437.58 483.81 602.97 699.00 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.89 402.17 444.55 483.31 593.60 693.77 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.96 413.15 447.25 481.00 583.72 690.45 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.11 425.11 445.04 478.36 574.62 688.78 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.33 435.71 440.34 475.69 567.93 688.14 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.86 435.98 443.36 473.57 564.87 687.97 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.81 436.55 444.03 473.73 565.58 687.94 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.82 434.92 446.25 474.78 568.93 688.08 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.45 428.86 453.62 474.19 573.05 688.72 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.56 423.49 460.69 471.88 576.01 690.33 -------------------------------------------------------------------------------- K point *** = 0.359375 0.609375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.91 420.41 461.34 472.45 576.51 693.24 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.53 411.53 464.98 474.53 608.64 668.65 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.36 414.40 457.02 478.02 604.35 671.92 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.16 419.50 447.58 479.15 597.87 676.77 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.13 425.40 438.63 477.76 591.44 681.61 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.42 429.41 432.64 475.52 586.58 685.59 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.82 428.78 431.54 475.30 584.03 688.40 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.41 422.17 436.15 477.83 584.07 690.18 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.34 412.48 443.28 480.97 586.61 691.33 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.35 402.63 448.93 483.40 591.07 692.52 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.40 394.49 450.13 485.28 596.45 694.39 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.79 389.11 446.10 486.28 601.87 697.38 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.30 386.96 438.07 485.16 606.81 701.39 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.08 387.92 427.77 481.29 611.14 705.87 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.61 391.17 416.92 475.21 614.70 710.07 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.42 394.78 407.97 468.61 617.28 713.28 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.09 395.32 404.64 464.09 618.65 715.01 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.09 395.32 404.64 464.09 618.65 715.01 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.42 394.78 407.97 468.61 617.28 713.28 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.61 391.17 416.92 475.21 614.70 710.07 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.08 387.92 427.77 481.29 611.14 705.87 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.30 386.96 438.07 485.16 606.81 701.39 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.79 389.11 446.10 486.28 601.87 697.38 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.40 394.49 450.13 485.28 596.45 694.39 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.35 402.63 448.93 483.40 591.07 692.52 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.34 412.48 443.28 480.97 586.61 691.33 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.41 422.17 436.15 477.83 584.07 690.18 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.82 428.78 431.54 475.30 584.03 688.40 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.42 429.41 432.64 475.52 586.58 685.59 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.13 425.40 438.63 477.76 591.44 681.61 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.16 419.50 447.58 479.15 597.87 676.77 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.36 414.40 457.02 478.02 604.35 671.92 -------------------------------------------------------------------------------- K point *** = 0.359375 0.640625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.53 411.53 464.98 474.53 608.64 668.65 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.93 402.19 460.35 481.23 637.27 647.86 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.02 405.48 459.87 480.36 635.56 646.37 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.07 411.40 453.51 480.58 624.44 654.13 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.62 418.87 444.87 479.54 615.17 660.39 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.37 425.87 437.14 477.08 608.77 664.71 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.22 429.19 433.48 475.38 605.79 666.89 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.06 426.61 435.64 476.55 606.36 666.95 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.09 419.44 442.47 479.29 610.22 665.20 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.31 411.00 450.61 481.27 616.50 662.34 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.23 403.65 456.59 482.18 623.13 660.02 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.50 398.70 457.30 483.45 626.68 661.15 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.08 396.79 452.30 484.94 625.36 667.13 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.22 397.94 443.70 484.74 621.44 675.51 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.43 401.55 433.55 481.94 617.24 683.84 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.33 406.28 423.81 477.25 613.65 690.89 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.52 409.46 417.31 472.86 610.75 696.10 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.06 409.13 416.07 471.62 608.33 699.31 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.77 405.95 419.55 474.49 606.21 700.60 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.59 399.78 427.83 479.42 604.41 700.31 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.27 393.51 437.58 483.81 602.97 699.00 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.79 389.11 446.10 486.28 601.87 697.38 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.29 387.60 451.08 486.89 600.85 696.13 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.13 389.35 450.85 486.48 599.74 695.68 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.02 394.16 445.50 485.13 598.73 695.92 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.97 401.23 437.06 482.22 598.28 696.33 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.24 408.99 428.25 478.03 598.80 696.18 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.26 414.88 422.37 474.49 600.41 694.79 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.48 416.68 421.84 474.14 603.18 691.68 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.92 414.24 426.80 477.22 607.23 686.57 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.34 409.23 435.71 481.13 612.80 679.39 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.58 404.57 445.70 483.40 619.93 670.27 -------------------------------------------------------------------------------- K point *** = 0.359375 0.671875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.47 401.95 454.65 483.12 628.34 659.55 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.58 392.48 449.43 486.02 614.83 681.43 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.74 396.11 453.89 484.80 611.95 677.76 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.75 402.69 452.95 483.18 607.39 676.28 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.48 411.37 447.18 481.40 602.32 676.28 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.07 420.56 439.55 478.71 598.40 676.56 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.90 427.61 433.75 475.94 596.84 676.10 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.26 429.28 433.20 475.43 598.23 674.27 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.99 425.45 438.18 477.49 602.62 670.77 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.90 418.89 446.63 479.47 609.60 665.71 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.00 412.54 455.74 479.42 617.95 659.76 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.38 408.13 462.75 477.74 624.84 655.15 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.22 406.50 462.99 478.17 625.16 656.46 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.88 407.85 456.32 480.70 618.98 663.50 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.91 411.80 447.03 481.46 610.94 671.81 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.97 417.26 437.40 479.68 603.51 679.29 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.73 422.16 429.61 476.58 597.72 685.21 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.01 423.37 426.47 474.90 593.85 689.38 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.74 419.16 429.33 476.58 591.94 691.91 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.10 411.11 436.51 480.16 591.92 693.18 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.89 402.17 444.55 483.31 593.60 693.77 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.40 394.49 450.13 485.28 596.45 694.39 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.13 389.35 450.85 486.48 599.74 695.68 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.96 387.39 446.30 486.68 602.92 697.89 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.11 388.63 437.95 484.82 605.85 700.77 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.13 392.52 427.74 480.55 608.57 703.69 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.74 397.72 417.84 474.81 611.05 705.90 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.71 401.56 411.40 469.74 613.12 706.79 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.27 402.36 410.34 468.11 614.63 705.96 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.42 402.09 412.71 471.02 615.57 703.27 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.17 398.53 420.54 476.59 616.07 698.84 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.34 394.40 430.90 482.00 616.25 693.13 -------------------------------------------------------------------------------- K point *** = 0.359375 0.703125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.83 392.03 441.15 485.35 616.02 686.94 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.49 382.87 434.50 484.17 595.72 716.98 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.50 386.80 442.30 485.73 587.87 713.62 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.23 393.90 445.97 484.96 580.56 710.75 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.78 403.50 444.51 482.90 574.53 708.46 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.73 414.28 438.88 480.02 570.52 706.49 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.98 424.17 432.29 476.70 569.01 704.41 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.84 428.67 430.35 474.67 570.04 701.81 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.87 429.38 431.92 475.63 573.31 698.41 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.02 425.74 438.35 477.92 578.30 694.18 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.67 420.70 447.48 478.75 584.11 689.43 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.40 416.94 456.87 476.82 589.35 684.87 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.66 415.65 465.21 472.07 592.40 681.47 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.97 417.23 464.90 471.72 592.13 680.05 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.91 421.47 456.25 475.66 588.66 680.67 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.21 427.43 447.21 476.80 583.43 682.57 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.54 432.91 439.89 475.65 578.39 684.80 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.62 433.62 437.85 474.36 575.22 686.72 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.67 432.79 436.54 475.51 574.97 688.13 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.20 424.14 441.78 478.32 577.97 689.21 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.96 413.15 447.25 481.00 583.72 690.45 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.35 402.63 448.93 483.40 591.07 692.52 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.02 394.16 445.50 485.13 598.73 695.92 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.11 388.63 437.95 484.82 605.85 700.77 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.30 386.34 427.80 481.54 612.00 706.63 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.70 386.98 416.50 475.53 616.97 712.72 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.69 389.34 405.84 468.04 620.50 718.24 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.64 390.00 399.51 461.23 622.33 722.57 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.97 387.79 398.92 457.85 622.25 725.31 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.68 388.43 398.66 459.70 620.17 726.31 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.72 387.71 403.02 465.69 616.15 725.63 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.70 384.39 412.92 473.14 610.44 723.54 -------------------------------------------------------------------------------- K point *** = 0.359375 0.734375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.62 382.25 424.15 479.79 603.45 720.47 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.53 374.00 415.33 474.71 583.94 751.54 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.18 378.17 425.74 479.90 570.97 748.65 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.42 385.68 433.19 482.30 558.73 745.41 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.55 395.92 436.18 482.12 548.67 742.15 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.50 407.75 434.04 480.07 541.98 739.00 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.68 419.50 428.37 476.92 539.07 735.89 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.74 423.01 428.84 474.02 539.40 732.58 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.49 422.10 432.99 473.60 542.01 728.87 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.52 426.29 432.02 475.83 546.13 724.57 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.14 427.58 434.88 478.05 551.03 719.68 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.45 424.82 443.14 478.33 555.83 714.35 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.29 423.94 450.61 476.51 559.50 708.93 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.34 425.73 455.17 473.95 561.17 703.81 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.26 430.10 454.43 473.13 560.50 699.34 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.80 435.86 449.82 473.67 558.00 695.69 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.64 438.32 448.12 473.35 555.12 692.81 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.36 436.41 450.41 472.49 554.04 690.57 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.69 437.78 447.06 473.52 556.79 688.96 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.70 437.31 442.33 475.84 564.03 688.19 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.11 425.11 445.04 478.36 574.62 688.78 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.34 412.48 443.28 480.97 586.61 691.33 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.97 401.23 437.06 482.22 598.28 696.33 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.13 392.52 427.74 480.55 608.57 703.69 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.70 386.98 416.50 475.53 616.97 712.72 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.27 384.60 404.38 467.74 623.23 722.39 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.86 384.26 392.99 458.52 627.14 731.70 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.67 379.68 388.72 449.91 628.53 739.90 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.76 373.34 389.09 444.61 627.23 746.46 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.66 372.37 387.41 444.93 623.22 751.11 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.91 375.68 385.67 450.42 616.57 753.77 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.58 375.03 392.14 458.62 607.50 754.53 -------------------------------------------------------------------------------- K point *** = 0.359375 0.765625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.76 373.23 403.51 467.25 596.42 753.66 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.54 366.54 392.02 459.84 577.94 784.53 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.63 370.88 404.19 467.58 561.64 782.24 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.21 378.68 414.54 473.18 545.19 778.97 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.77 389.30 421.53 476.29 530.16 775.18 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.51 401.69 423.60 476.95 518.63 771.20 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.24 414.48 420.50 475.48 512.32 767.19 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.09 414.74 425.96 472.81 511.11 763.12 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.69 411.15 433.57 471.25 513.18 758.83 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.20 412.71 435.64 472.77 516.89 754.10 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.25 418.38 433.99 475.97 521.32 748.76 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.41 425.60 431.87 478.31 525.81 742.69 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.96 431.16 432.53 478.92 529.62 735.93 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.82 432.68 437.94 478.16 532.08 728.59 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.73 435.07 442.47 476.83 532.81 720.91 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.42 435.19 448.63 475.48 532.08 713.20 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.52 433.14 456.06 474.01 531.17 705.77 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.36 432.12 460.79 472.64 532.74 699.02 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.35 434.71 457.87 472.94 539.71 693.39 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.72 438.85 448.68 473.89 552.26 689.50 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.33 435.71 440.34 475.69 567.93 688.14 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.41 422.17 436.15 477.83 584.07 690.18 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.24 408.99 428.25 478.03 598.80 696.18 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.74 397.72 417.84 474.81 611.05 705.90 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.69 389.34 405.84 468.04 620.50 718.24 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.86 384.26 392.99 458.52 627.14 731.70 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.80 379.97 382.37 447.59 630.97 744.97 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.53 368.20 382.30 437.11 631.90 757.05 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.07 359.11 382.21 429.79 629.86 767.30 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.32 355.16 379.64 428.42 624.82 775.34 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.59 357.91 374.81 433.06 616.85 781.00 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.84 364.81 371.55 441.25 606.15 784.28 -------------------------------------------------------------------------------- K point *** = 0.359375 0.796875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.08 365.64 379.63 450.70 593.02 785.35 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.44 360.95 365.71 442.81 574.45 815.47 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.82 365.34 378.62 451.96 556.69 813.95 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.63 373.29 390.73 459.55 538.18 810.88 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.54 384.05 400.59 465.11 520.15 806.78 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.94 396.59 406.54 468.60 504.41 802.16 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.92 406.83 409.97 470.29 493.18 797.33 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.09 402.61 422.33 469.97 488.31 792.43 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.35 397.47 432.31 468.34 489.17 787.41 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.86 396.21 437.68 468.67 492.67 782.06 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.87 399.76 438.29 471.99 496.86 776.12 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.13 405.74 437.20 475.97 500.97 769.33 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.52 411.85 437.13 478.77 504.53 761.53 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.22 416.63 439.59 480.01 507.05 752.65 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.07 419.31 445.27 479.92 508.29 742.77 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.69 420.13 453.65 478.80 508.47 732.12 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.39 420.55 462.69 476.89 509.14 721.07 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.90 423.29 467.62 474.76 514.18 710.20 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 377.08 429.60 464.29 473.24 526.85 700.29 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 371.49 435.47 455.42 472.35 544.92 692.43 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.86 435.98 443.36 473.57 564.87 687.97 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.82 428.78 431.54 475.30 584.03 688.40 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.26 414.88 422.37 474.49 600.41 694.79 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.71 401.56 411.40 469.74 613.12 706.79 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.64 390.00 399.51 461.23 622.33 722.57 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.67 379.68 388.72 449.91 628.53 739.90 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.53 368.20 382.30 437.11 631.90 757.05 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.87 356.08 379.90 424.57 632.41 772.85 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.72 345.44 378.70 414.87 629.95 786.58 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.01 338.48 375.31 411.58 624.45 797.81 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.74 337.61 369.27 415.34 615.94 806.29 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.38 343.25 363.57 423.24 604.57 811.97 -------------------------------------------------------------------------------- K point *** = 0.359375 0.828125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.48 353.36 360.45 432.88 590.61 814.94 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.39 337.62 358.14 425.62 570.96 843.95 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.97 349.55 363.21 435.56 552.78 843.36 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.98 361.64 371.85 444.46 533.58 840.69 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.20 373.15 382.55 451.68 514.47 836.51 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.15 382.57 394.18 456.90 497.02 831.40 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.13 387.15 406.59 460.39 483.15 825.82 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.11 385.75 418.96 463.06 474.21 820.08 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.53 380.81 429.94 464.29 471.34 814.23 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.27 377.42 437.81 463.71 474.44 808.12 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.84 378.87 441.03 465.91 478.90 801.46 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.51 383.73 441.28 470.52 482.97 793.93 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.83 389.41 441.75 475.17 486.06 785.23 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.39 394.44 444.33 478.69 487.94 775.16 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.03 398.31 449.85 480.69 488.65 763.67 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.06 401.53 458.10 481.03 488.87 750.85 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.70 406.31 466.31 479.68 491.44 737.00 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.23 415.56 468.01 477.20 502.23 722.66 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 372.48 427.26 463.01 474.37 520.68 708.72 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 367.12 435.79 454.59 472.62 542.72 696.50 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.81 436.55 444.03 473.73 565.58 687.94 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.42 429.41 432.64 475.52 586.58 685.59 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.48 416.68 421.84 474.14 603.18 691.68 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.27 402.36 410.34 468.11 614.63 705.96 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.97 387.79 398.92 457.85 622.25 725.31 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.76 373.34 389.09 444.61 627.23 746.46 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.07 359.11 382.21 429.79 629.86 767.30 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.72 345.44 378.70 414.87 629.95 786.58 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.50 333.11 377.42 401.98 627.25 803.57 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.53 323.43 374.32 395.67 621.62 817.81 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.66 318.45 367.19 398.49 613.01 829.00 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.35 319.97 360.63 405.98 601.52 837.04 -------------------------------------------------------------------------------- K point *** = 0.359375 0.859375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.11 327.12 357.32 415.45 587.38 841.96 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.89 310.51 357.41 409.33 566.07 869.56 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.62 321.49 362.17 419.52 547.97 870.09 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.83 333.81 370.31 429.26 528.74 868.04 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.34 346.09 380.79 437.83 509.38 863.99 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.75 356.74 392.58 444.62 491.36 858.57 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.46 363.79 404.79 449.38 476.61 852.37 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.74 365.50 416.68 452.70 466.75 845.81 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.54 362.28 427.54 456.18 461.32 839.08 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.23 357.95 436.48 458.33 461.19 832.11 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.99 357.38 442.05 458.48 466.61 824.65 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.45 361.27 443.92 461.77 471.92 816.32 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.81 366.78 444.97 466.03 476.37 806.78 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.19 372.18 447.64 469.51 479.62 795.71 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.34 377.28 452.93 471.79 481.56 782.95 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.38 383.84 460.12 473.95 482.18 768.48 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.92 395.63 463.44 481.19 482.32 752.48 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 364.73 411.91 460.76 479.38 498.44 735.37 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.19 427.93 455.43 476.32 519.66 717.91 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.66 438.08 449.68 473.72 543.89 701.41 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.82 434.92 446.25 474.78 568.93 688.08 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.13 425.40 438.63 477.76 591.44 681.61 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.92 414.24 426.80 477.22 607.23 686.57 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.42 402.09 412.71 471.02 615.57 703.27 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.68 388.43 398.66 459.70 620.17 726.31 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.66 372.37 387.41 444.93 623.22 751.11 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.32 355.16 379.64 428.42 624.82 775.34 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.01 338.48 375.31 411.58 624.45 797.81 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.53 323.43 374.32 395.67 621.62 817.81 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.84 310.87 375.12 382.97 616.03 834.87 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.15 302.04 368.12 383.55 607.57 848.67 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.24 298.94 360.49 390.54 596.28 859.06 -------------------------------------------------------------------------------- K point *** = 0.359375 0.890625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.42 302.35 356.77 399.43 582.34 865.98 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.59 286.04 358.84 394.74 559.10 891.93 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.49 295.05 363.41 404.53 541.38 893.78 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.94 306.48 371.38 414.50 522.43 892.58 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.76 318.85 381.63 423.97 503.19 888.90 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.55 330.54 393.05 432.20 485.01 883.39 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.80 339.65 404.69 438.55 469.81 876.73 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.91 344.27 415.84 442.77 459.66 869.44 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.22 343.70 426.00 446.01 454.82 861.85 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.80 340.01 434.75 450.44 452.84 853.98 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.02 337.71 441.46 452.08 456.57 845.64 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.91 340.44 445.05 453.61 463.21 836.47 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.40 345.97 446.75 456.74 469.50 826.08 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.54 351.89 449.44 459.42 474.82 814.10 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.36 358.91 453.98 461.54 478.83 800.29 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.45 371.43 456.86 467.21 481.33 784.53 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.82 389.81 455.37 478.92 482.92 766.87 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.52 410.06 451.63 480.58 497.93 747.60 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.43 428.87 446.69 477.95 520.06 727.29 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.97 436.09 448.20 474.40 545.79 706.99 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.45 428.86 453.62 474.19 573.05 688.72 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.16 419.50 447.58 479.15 597.87 676.77 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.34 409.23 435.71 481.13 612.80 679.39 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.17 398.53 420.54 476.59 616.07 698.84 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.72 387.71 403.02 465.69 616.15 725.63 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.91 375.68 385.67 450.42 616.57 753.77 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.59 357.91 374.81 433.06 616.85 781.00 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.74 337.61 369.27 415.34 615.94 806.29 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.66 318.45 367.19 398.49 613.01 829.00 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.15 302.04 368.12 383.55 607.57 848.67 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.14 289.41 370.08 373.10 599.41 864.97 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.80 281.83 362.58 378.05 588.49 877.66 -------------------------------------------------------------------------------- K point *** = 0.359375 0.921875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.05 281.00 358.46 385.72 574.96 886.63 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.21 265.99 362.08 382.76 549.79 910.74 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.39 272.16 366.34 391.46 532.61 914.09 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.18 281.92 374.11 400.87 514.14 913.98 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.32 293.79 384.17 410.48 495.25 910.94 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.45 306.03 395.21 419.65 477.19 905.61 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.11 316.73 406.18 427.52 461.78 898.72 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.79 323.91 416.41 433.16 451.37 890.87 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.98 326.28 425.56 436.50 447.41 882.49 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.12 324.69 433.47 440.32 447.11 873.74 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.57 322.23 440.01 446.30 447.49 864.49 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.80 323.18 444.67 448.08 454.02 854.44 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.61 328.74 447.11 450.33 461.75 843.18 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.27 335.49 449.63 452.72 468.80 830.33 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.28 346.80 451.59 456.76 474.64 815.58 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.86 364.48 450.96 465.17 479.01 798.76 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.52 385.49 448.52 476.66 482.92 779.82 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.64 407.53 444.53 480.49 497.28 758.91 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.40 428.25 439.44 479.09 519.69 736.41 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.97 431.39 448.01 475.48 546.56 713.06 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.56 423.49 460.69 471.88 576.01 690.33 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.36 414.40 457.02 478.02 604.35 671.92 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.58 404.57 445.70 483.40 619.93 670.27 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.34 394.40 430.90 482.00 616.25 693.13 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.70 384.39 412.92 473.14 610.44 723.54 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.58 375.03 392.14 458.62 607.50 754.53 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.84 364.81 371.55 441.25 606.15 784.28 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.38 343.25 363.57 423.24 604.57 811.97 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.35 319.97 360.63 405.98 601.52 837.04 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.24 298.94 360.49 390.54 596.28 859.06 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.80 281.83 362.58 378.05 588.49 877.66 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.75 269.87 364.54 371.41 578.06 892.57 -------------------------------------------------------------------------------- K point *** = 0.359375 0.953125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.72 264.64 362.01 375.35 565.08 903.61 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.45 251.69 366.65 374.54 538.10 925.68 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.07 254.25 369.95 381.88 521.59 930.69 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.13 261.76 377.24 390.05 503.75 931.92 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.48 272.61 387.26 398.70 485.40 929.82 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.89 284.90 398.33 407.58 467.70 924.99 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.95 296.63 408.84 416.22 452.38 918.16 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.19 305.75 417.89 423.37 441.98 910.00 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.13 310.67 424.81 427.98 439.17 901.03 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.28 311.56 429.23 433.50 441.03 891.49 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.22 310.76 435.56 438.89 443.04 881.36 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.54 311.40 443.02 443.99 444.65 870.41 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.52 316.30 446.08 446.39 452.94 858.26 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.35 325.28 447.90 449.30 461.48 844.53 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.45 339.89 448.24 454.50 469.02 828.91 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.14 358.87 447.12 462.70 475.30 811.15 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.43 380.68 444.54 473.27 481.53 791.18 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.34 403.40 440.51 478.92 495.57 769.04 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.97 425.10 435.13 479.46 517.84 744.96 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.44 428.30 444.71 477.24 545.39 719.39 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.91 420.41 461.34 472.45 576.51 693.24 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.53 411.53 464.98 474.53 608.64 668.65 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.47 401.95 454.65 483.12 628.34 659.55 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.83 392.03 441.15 485.35 616.02 686.94 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.62 382.25 424.15 479.79 603.45 720.47 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.76 373.23 403.51 467.25 596.42 753.66 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.08 365.64 379.63 450.70 593.02 785.35 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.48 353.36 360.45 432.88 590.61 814.94 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.11 327.12 357.32 415.45 587.38 841.96 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.42 302.35 356.77 399.43 582.34 865.98 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.05 281.00 358.46 385.72 574.96 886.63 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.72 264.64 362.01 375.35 565.08 903.61 -------------------------------------------------------------------------------- K point *** = 0.359375 0.984375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.09 254.35 366.22 370.05 552.72 916.66 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.40 259.28 364.01 368.76 566.64 906.57 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.58 259.51 365.53 375.36 551.22 913.72 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.14 265.08 371.32 383.29 533.90 917.02 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.99 274.78 380.61 392.02 515.26 916.82 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.99 286.90 391.78 401.37 496.15 913.64 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.83 299.65 402.97 411.19 477.79 908.16 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.10 311.06 412.98 420.77 461.88 901.11 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.33 319.12 421.69 428.68 450.68 893.16 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.05 322.43 429.31 434.07 445.91 884.74 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.81 321.58 435.90 438.74 445.75 876.03 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.19 319.27 441.39 444.70 446.96 866.88 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.84 318.73 445.59 446.97 453.30 856.98 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.99 322.80 448.28 448.64 461.27 845.90 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.06 331.02 450.00 451.44 468.62 833.23 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.28 345.07 450.08 456.96 474.74 818.63 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.08 363.63 448.68 465.73 479.37 801.92 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.47 385.14 445.79 477.14 483.60 783.05 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.53 407.67 441.44 480.98 498.00 762.14 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.35 429.18 435.79 479.65 520.29 739.59 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.08 428.59 448.30 476.02 547.07 716.13 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.91 420.41 461.34 472.45 576.51 693.24 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.01 411.28 457.43 478.86 604.91 674.62 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.56 401.47 445.93 484.21 620.96 672.42 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.69 391.36 430.94 482.57 617.78 694.81 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.45 381.44 412.64 473.29 612.13 725.21 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.77 372.30 391.26 458.29 609.27 756.33 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.48 364.30 367.80 440.52 607.96 786.28 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.47 342.20 359.42 422.26 606.41 814.17 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.85 317.77 356.47 404.93 603.35 839.45 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.02 295.71 356.13 389.60 598.08 861.65 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.62 277.75 358.11 377.26 590.23 880.42 -------------------------------------------------------------------------------- K point *** = 0.390625 0.015625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.33 265.24 361.90 369.03 579.72 895.45 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.58 259.51 365.53 375.36 551.22 913.72 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.23 258.11 363.73 381.52 536.72 922.69 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.95 261.87 365.71 389.46 520.35 927.73 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.71 269.74 371.58 398.20 502.69 929.05 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.13 280.42 380.35 407.20 484.57 927.09 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.80 292.22 390.75 415.85 467.22 922.44 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.26 303.21 401.55 423.23 452.52 915.78 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.98 311.37 411.83 427.78 443.47 907.76 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.42 315.23 421.01 429.07 441.98 898.86 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.02 315.23 428.67 432.20 443.35 889.32 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.10 314.09 435.75 437.96 444.49 879.12 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.36 315.83 441.81 444.91 445.78 868.03 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.19 322.02 444.93 447.67 453.74 855.72 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.44 329.74 447.27 450.49 461.92 841.81 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.10 341.87 449.11 454.63 469.10 826.02 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.65 359.97 448.90 462.39 475.04 808.13 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.27 381.27 446.88 472.96 480.90 788.07 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.32 403.49 443.28 478.50 494.90 765.89 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.94 424.56 438.40 478.90 517.28 741.83 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.29 431.01 444.57 476.64 544.89 716.34 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.56 423.49 460.69 471.88 576.01 690.33 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.92 414.72 464.47 473.71 608.09 665.92 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.54 405.17 454.26 482.25 627.05 657.65 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.54 395.25 440.90 484.61 614.19 685.62 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.95 385.46 424.11 479.36 601.65 719.06 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.68 376.40 403.84 467.25 594.63 752.05 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.59 368.49 380.82 451.10 591.23 783.52 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.60 353.69 364.93 433.58 588.82 812.88 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.90 328.74 361.49 416.29 585.62 839.66 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.00 304.94 361.05 400.26 580.61 863.46 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.64 284.44 362.85 386.45 573.29 883.93 -------------------------------------------------------------------------------- K point *** = 0.390625 0.046875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.57 268.67 365.91 376.41 563.48 900.76 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.14 265.08 371.32 383.29 533.90 917.02 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.95 261.87 365.71 389.46 520.35 927.73 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 242.89 264.82 363.63 397.18 505.03 934.53 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.27 271.88 365.65 405.41 488.49 937.55 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.03 281.64 371.36 413.48 471.63 937.11 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.80 292.52 379.84 420.50 455.88 933.68 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.01 302.66 389.97 424.64 444.10 927.87 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.02 310.09 400.67 423.24 440.60 920.24 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.11 313.44 410.98 421.52 441.80 911.27 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.43 313.47 420.03 424.71 443.02 901.25 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.81 313.38 428.08 431.47 443.64 890.23 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.96 316.98 436.02 438.22 444.68 878.09 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.50 324.42 440.34 445.00 448.82 864.58 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.39 333.44 442.45 450.28 456.10 849.44 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.14 344.24 445.05 454.78 463.49 832.42 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.08 359.39 447.42 460.70 470.10 813.35 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.59 378.80 447.80 469.35 477.13 792.15 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.50 399.58 445.96 475.14 491.20 768.84 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.42 419.33 442.34 477.04 513.37 743.59 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.65 433.67 440.42 476.61 541.22 716.71 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.45 428.86 453.62 474.19 573.05 688.72 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.04 420.86 463.48 472.15 607.18 660.51 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.61 411.83 458.92 478.70 631.78 643.99 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.30 402.28 448.27 483.62 608.51 678.58 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.14 392.78 433.77 482.36 590.00 713.53 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.07 383.94 415.34 473.94 578.59 747.38 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.98 376.24 393.52 460.25 572.77 779.61 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.87 365.28 374.45 444.19 569.37 809.79 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.04 341.31 369.95 427.62 565.96 837.51 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.10 316.81 369.39 411.55 561.20 862.42 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.85 294.78 371.14 396.81 554.40 884.16 -------------------------------------------------------------------------------- K point *** = 0.390625 0.078125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.01 276.81 374.05 384.96 545.31 902.45 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.99 274.78 380.61 392.02 515.26 916.82 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.71 269.74 371.58 398.20 502.69 929.05 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 241.27 271.88 365.65 405.41 488.49 937.55 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.81 278.55 363.64 412.74 473.29 942.35 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.00 287.89 365.63 419.27 458.19 943.67 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.79 298.13 371.20 423.20 445.63 941.84 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 244.76 307.31 379.51 420.83 440.52 937.32 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.24 313.34 389.55 415.68 441.22 930.58 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.39 315.13 400.27 414.69 442.33 922.04 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.14 314.13 410.75 418.96 442.60 911.96 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.05 314.07 420.47 426.34 442.42 900.46 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.93 318.42 429.27 433.47 443.52 887.50 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.20 327.16 434.62 439.57 448.44 872.93 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.43 338.09 436.26 447.02 455.04 856.60 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.00 350.28 438.33 454.31 461.14 838.35 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.01 364.29 441.46 461.93 466.33 818.06 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.83 380.76 444.64 469.54 472.94 795.70 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.38 398.54 446.20 472.82 488.01 771.31 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.90 415.61 445.37 474.67 509.83 745.03 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.92 430.42 442.74 475.30 537.38 717.14 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.82 434.92 446.25 474.78 568.93 688.08 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.97 428.76 455.36 474.04 602.60 658.70 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.64 420.77 457.50 476.39 625.47 641.67 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.05 411.95 451.52 480.93 600.69 674.49 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.30 402.97 440.35 482.36 578.03 709.14 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.39 394.48 424.61 477.75 562.23 742.88 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.29 387.02 404.75 467.19 553.51 775.15 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.11 377.29 385.76 453.24 548.86 805.51 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.21 354.40 380.73 438.09 545.15 833.60 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.28 329.96 380.02 422.74 540.57 859.07 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.19 307.36 381.68 407.85 534.25 881.62 -------------------------------------------------------------------------------- K point *** = 0.390625 0.109375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.60 288.21 384.87 394.49 525.83 900.95 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.99 286.90 391.78 401.37 496.15 913.64 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.13 280.42 380.35 407.20 484.57 927.09 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.03 281.64 371.36 413.48 471.63 937.11 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.00 287.89 365.63 419.27 458.19 943.67 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.35 296.81 363.68 422.78 446.34 946.87 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.49 306.26 365.63 420.10 440.79 946.91 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.33 313.86 371.11 413.29 441.11 944.08 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.40 317.32 379.37 409.65 442.09 938.71 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.87 316.25 389.47 411.68 442.17 931.09 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.61 313.25 400.41 418.03 441.43 921.44 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.05 312.37 411.35 425.63 441.06 909.89 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.77 316.92 421.49 430.37 444.20 896.44 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.65 326.95 427.92 434.10 451.24 881.06 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.04 340.13 428.84 442.10 458.69 863.68 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.71 354.86 429.97 450.55 465.09 844.25 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.63 370.54 432.56 459.26 470.20 822.75 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.97 386.68 436.47 468.33 475.31 799.20 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.15 402.19 440.65 472.92 487.67 773.69 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.40 415.98 443.65 473.98 508.38 746.40 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.57 427.72 444.55 474.00 535.06 717.64 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.81 436.55 444.03 473.73 565.58 687.94 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.45 436.33 447.89 473.83 597.23 658.80 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.89 430.57 451.36 475.28 614.44 645.29 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.46 423.14 449.61 478.27 592.00 672.91 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.42 415.04 442.52 480.48 566.76 706.12 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.91 407.08 430.33 478.81 546.88 739.04 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.01 399.86 413.28 471.56 534.74 770.73 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.92 389.29 397.06 460.14 528.44 800.71 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.10 366.73 392.77 446.92 524.25 828.61 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.29 343.00 391.80 433.02 519.72 854.12 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.42 320.66 393.12 418.90 513.77 876.96 -------------------------------------------------------------------------------- K point *** = 0.390625 0.140625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.15 301.25 396.36 405.04 505.94 896.87 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.83 299.65 402.97 411.19 477.79 908.16 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.80 292.22 390.75 415.85 467.22 922.44 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.80 292.52 379.84 420.50 455.88 933.68 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.79 298.13 371.20 423.20 445.63 941.84 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 232.49 306.26 365.63 420.10 440.79 946.91 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.77 314.13 363.73 412.70 441.12 948.96 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 230.94 318.76 365.64 407.68 442.06 948.11 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 235.83 318.19 371.10 408.37 442.06 944.49 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.85 313.59 379.42 414.18 441.13 938.26 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.96 308.43 389.72 421.73 440.46 929.52 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.59 306.48 401.04 425.93 443.53 918.37 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.96 310.84 412.41 425.42 451.21 904.85 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.27 321.81 420.41 426.63 459.81 889.00 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.64 337.03 420.29 435.92 467.61 870.84 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.08 354.46 420.31 445.81 474.15 850.40 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.99 372.95 421.98 455.42 479.49 827.77 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.06 391.27 425.45 464.87 484.65 803.05 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.00 407.59 430.33 472.42 493.53 776.39 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.94 420.34 435.61 475.25 511.04 748.03 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.35 429.59 440.15 474.96 535.89 718.33 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.86 435.98 443.36 473.57 564.87 687.97 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 364.32 439.16 445.27 472.69 594.20 659.07 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.80 438.25 445.89 473.52 606.88 647.88 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.61 433.85 444.48 475.80 584.61 672.72 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.10 427.48 439.97 478.00 557.49 704.33 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.62 420.44 431.27 478.03 534.10 736.10 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.40 413.51 417.69 473.69 518.11 766.84 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.78 398.18 408.89 464.77 509.65 796.01 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.26 376.59 405.26 453.62 504.72 823.25 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.71 354.28 403.82 441.62 500.07 848.31 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.15 333.01 404.47 429.07 494.30 870.94 -------------------------------------------------------------------------------- K point *** = 0.390625 0.171875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.33 314.16 406.92 416.22 486.89 890.95 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.10 311.06 412.98 420.77 461.88 901.11 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.26 303.21 401.55 423.23 452.52 915.78 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.01 302.66 389.97 424.64 444.10 927.87 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 244.76 307.31 379.51 420.83 440.52 937.32 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 236.33 313.86 371.11 413.29 441.11 944.08 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 230.94 318.76 365.64 407.68 442.06 948.11 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 229.25 318.95 363.74 407.46 442.06 949.34 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.46 314.06 365.64 412.84 441.11 947.72 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.33 306.63 371.14 420.34 440.66 943.22 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.08 299.92 379.65 423.77 444.88 935.82 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.31 297.02 390.32 421.64 454.20 925.53 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.00 300.82 402.18 417.82 464.50 912.40 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.51 312.16 412.28 416.40 473.98 896.49 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.68 328.75 410.68 427.57 482.05 877.91 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.69 348.27 409.57 439.41 488.55 856.77 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.18 369.29 410.34 450.73 493.72 833.23 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.09 390.38 413.12 461.45 498.49 807.47 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.38 409.51 417.75 470.79 505.43 779.71 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.30 423.63 424.47 476.32 519.09 750.24 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.40 430.11 434.28 477.29 540.94 719.46 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.33 435.71 440.34 475.69 567.93 688.14 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.74 438.93 444.25 473.47 595.36 658.70 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.29 439.62 445.55 472.46 604.51 648.74 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.76 438.40 443.20 473.49 580.44 672.94 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.24 434.90 438.35 475.38 551.54 703.42 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.00 427.79 432.87 476.35 525.33 734.06 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.41 416.58 427.00 474.42 505.47 763.69 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.90 400.85 421.60 467.82 494.24 791.80 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.13 381.87 417.59 458.31 488.41 818.08 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.07 361.86 415.42 448.12 483.49 842.29 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.96 342.51 415.14 437.50 477.66 864.28 -------------------------------------------------------------------------------- K point *** = 0.390625 0.203125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.71 325.02 416.31 426.55 470.44 883.92 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.33 319.12 421.69 428.68 450.68 893.16 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.98 311.37 411.83 427.78 443.47 907.76 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.02 310.09 400.67 423.24 440.60 920.24 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.24 313.34 389.55 415.68 441.22 930.58 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.40 317.32 379.37 409.65 442.09 938.71 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 235.83 318.19 371.10 408.37 442.06 944.49 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 231.46 314.06 365.64 412.84 441.11 947.72 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 230.81 306.15 363.71 420.03 440.84 948.17 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.01 297.13 365.63 422.88 446.15 945.59 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.71 289.55 371.27 419.72 457.27 939.84 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.84 285.84 380.08 414.44 469.69 930.81 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.38 288.75 391.27 408.85 481.43 918.50 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.83 299.81 403.73 404.09 491.72 903.00 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.62 317.02 400.11 417.37 500.24 884.44 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.06 337.78 398.08 430.90 506.92 863.01 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.89 360.48 398.12 444.13 512.03 838.91 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.21 383.56 400.50 456.77 516.34 812.40 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.11 402.63 407.59 468.17 521.79 783.74 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.93 410.15 424.34 476.39 532.03 753.25 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.32 417.52 437.24 479.45 550.11 721.37 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.11 425.11 445.04 478.36 574.62 688.78 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.10 432.07 448.19 475.68 600.89 657.70 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.00 437.28 447.23 473.62 607.59 647.84 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.45 438.18 444.73 473.13 580.27 673.07 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.09 432.31 443.96 473.74 549.58 702.98 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.70 423.27 441.99 474.48 521.38 732.70 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.30 411.80 438.24 474.09 498.40 761.27 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.16 397.54 433.51 470.40 483.46 788.25 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.93 381.05 429.14 461.99 476.68 813.39 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.81 363.86 426.15 452.82 471.72 836.51 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.35 347.18 424.83 443.81 465.84 857.54 -------------------------------------------------------------------------------- K point *** = 0.390625 0.234375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.85 331.83 424.72 434.73 458.69 876.42 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.05 322.43 429.31 434.07 445.91 884.74 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.42 315.23 421.01 429.07 441.98 898.86 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.11 313.44 410.98 421.52 441.80 911.27 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.39 315.13 400.27 414.69 442.33 922.04 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.87 316.25 389.47 411.68 442.17 931.09 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 243.85 313.59 379.42 414.18 441.13 938.26 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 237.33 306.63 371.14 420.34 440.66 943.22 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.01 297.13 365.63 422.88 446.15 945.59 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 234.36 287.35 363.66 419.13 458.51 944.97 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.44 279.30 365.64 412.92 472.87 941.02 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.72 274.92 371.47 406.07 486.98 933.54 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.55 276.64 380.61 399.51 499.88 922.45 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.68 286.77 391.09 395.02 511.03 907.80 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.92 303.82 388.85 406.34 520.18 889.75 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.67 325.00 386.33 420.69 527.27 868.49 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.72 348.59 385.91 435.41 532.52 844.30 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.21 372.73 388.21 449.97 536.57 817.46 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.31 389.61 399.26 463.64 540.89 788.27 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.44 396.80 419.21 474.79 548.30 757.08 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.35 404.64 435.64 480.83 562.33 724.29 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.96 413.15 447.25 481.00 583.72 690.45 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.25 421.66 453.75 477.64 609.27 656.92 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.11 429.45 453.85 474.66 614.89 645.75 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.32 435.53 447.63 474.19 583.39 673.16 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.56 434.03 443.32 474.47 551.11 702.77 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.44 422.18 445.01 474.32 521.71 731.71 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.58 407.71 445.05 473.46 497.18 759.31 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.62 391.71 442.80 471.67 478.94 785.20 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.54 375.43 439.13 465.82 469.35 809.16 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.27 360.16 435.64 456.69 465.08 831.09 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.86 346.20 433.36 448.61 459.55 850.96 -------------------------------------------------------------------------------- K point *** = 0.390625 0.265625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.29 333.41 432.18 440.69 452.83 868.82 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.81 321.58 435.90 438.74 445.75 876.03 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.02 315.23 428.67 432.20 443.35 889.32 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.43 313.47 420.03 424.71 443.02 901.25 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.14 314.13 410.75 418.96 442.60 911.96 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.61 313.25 400.41 418.03 441.43 921.44 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.96 308.43 389.72 421.73 440.46 929.52 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.08 299.92 379.65 423.77 444.88 935.82 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 240.71 289.55 371.27 419.72 457.27 939.84 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 238.44 279.30 365.64 412.92 472.87 941.02 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 239.67 270.92 363.63 405.19 489.01 938.90 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 244.46 265.99 365.68 397.43 504.44 933.14 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.90 266.39 371.61 390.39 518.41 923.56 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.42 274.90 379.08 386.41 530.46 910.16 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.96 290.96 377.72 395.48 540.34 893.07 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.96 311.72 375.10 409.58 547.97 872.50 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.12 335.44 374.47 425.05 553.52 848.72 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.63 360.19 376.64 441.02 557.48 822.06 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.71 377.57 388.39 456.70 560.98 792.86 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.87 384.96 410.24 470.66 566.15 761.47 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.91 393.11 429.46 480.31 576.25 728.29 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.89 402.17 444.55 483.31 593.60 693.77 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.86 411.51 455.40 480.18 617.29 658.45 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.82 420.49 460.83 474.49 622.73 644.92 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.66 428.56 455.41 473.78 587.90 673.77 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.18 434.45 443.72 475.60 554.73 702.72 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.12 425.53 442.39 476.17 524.73 730.81 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.18 408.04 445.66 474.99 499.63 757.45 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.98 388.77 447.10 471.72 481.13 782.29 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.93 369.82 446.18 465.01 470.95 805.11 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.50 353.75 443.43 457.99 464.69 825.84 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.99 341.28 440.60 452.15 458.21 844.48 -------------------------------------------------------------------------------- K point *** = 0.390625 0.296875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.60 330.77 438.61 445.80 451.49 861.15 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.19 319.27 441.39 444.70 446.96 866.88 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.10 314.09 435.75 437.96 444.49 879.12 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.81 313.38 428.08 431.47 443.64 890.23 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.05 314.07 420.47 426.34 442.42 900.46 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.05 312.37 411.35 425.63 441.06 909.89 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.59 306.48 401.04 425.93 443.53 918.37 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.31 297.02 390.32 421.64 454.20 925.53 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.84 285.84 380.08 414.44 469.69 930.81 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.72 274.92 371.47 406.07 486.98 933.54 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 244.46 265.99 365.68 397.43 504.44 933.14 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.43 260.50 363.66 389.15 521.01 929.14 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.69 259.68 365.71 381.93 536.01 921.26 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.31 265.94 369.75 378.19 548.98 909.42 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.04 280.09 368.10 385.42 559.63 893.69 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.25 299.47 365.50 398.40 567.87 874.28 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.47 322.51 364.79 413.78 573.79 851.44 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.90 347.45 366.69 430.47 577.78 825.53 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.86 367.78 376.11 447.57 580.67 796.89 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.93 375.71 398.82 463.81 584.06 765.93 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.03 384.11 419.97 476.88 590.57 733.11 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.27 393.51 437.58 483.81 602.97 699.00 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.76 403.30 451.53 483.26 621.42 664.81 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.54 412.91 462.03 476.47 623.94 651.26 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.53 421.86 464.02 470.71 591.42 675.83 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.58 429.68 449.93 475.24 558.61 703.00 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.49 430.69 438.29 477.74 528.69 729.80 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.07 411.91 442.63 477.85 503.42 755.33 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.12 390.54 446.34 474.77 484.74 779.08 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.40 369.06 448.38 465.84 475.58 800.79 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.42 349.95 448.38 457.26 469.52 820.34 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.08 336.13 446.32 452.30 462.58 837.76 -------------------------------------------------------------------------------- K point *** = 0.390625 0.328125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.40 326.97 443.89 448.78 454.65 853.20 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.84 318.73 445.59 446.97 453.30 856.98 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.36 315.83 441.81 444.91 445.78 868.03 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.96 316.98 436.02 438.22 444.68 878.09 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.93 318.42 429.27 433.47 443.52 887.50 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.77 316.92 421.49 430.37 444.20 896.44 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.96 310.84 412.41 425.42 451.21 904.85 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.00 300.82 402.18 417.82 464.50 912.40 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.38 288.75 391.27 408.85 481.43 918.50 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.55 276.64 380.61 399.51 499.88 922.45 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.90 266.39 371.61 390.39 518.41 923.56 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.69 259.68 365.71 381.93 536.01 921.26 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.24 257.72 363.84 374.62 551.98 915.17 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.42 261.46 364.53 370.69 565.84 905.10 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.33 272.72 361.56 376.48 577.28 891.07 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.71 289.67 358.78 387.85 586.15 873.22 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.93 311.09 357.98 402.42 592.48 851.82 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.25 335.36 359.67 419.11 596.54 827.19 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.10 359.73 364.92 436.94 598.94 799.73 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.16 369.82 386.10 454.70 600.85 769.90 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.44 378.35 408.46 470.45 604.16 738.30 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.08 387.92 427.77 481.29 611.14 705.87 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.22 397.94 443.70 484.74 621.44 675.51 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.88 407.85 456.32 480.70 618.98 663.50 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.97 417.23 464.90 471.72 592.13 680.05 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.34 425.73 455.17 473.95 561.17 703.81 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.82 432.68 437.94 478.16 532.08 728.59 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.22 416.63 439.59 480.01 507.05 752.65 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.39 394.44 444.33 478.69 487.94 775.16 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.19 372.18 447.64 469.51 479.62 795.71 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.54 351.89 449.44 459.42 474.82 814.10 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.27 335.49 449.63 452.72 468.80 830.33 -------------------------------------------------------------------------------- K point *** = 0.390625 0.359375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.35 325.28 447.90 449.30 461.48 844.53 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.99 322.80 448.28 448.64 461.27 845.90 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.19 322.02 444.93 447.67 453.74 855.72 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.50 324.42 440.34 445.00 448.82 864.58 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.20 327.16 434.62 439.57 448.44 872.93 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.65 326.95 427.92 434.10 451.24 881.06 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.27 321.81 420.41 426.63 459.81 889.00 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.51 312.16 412.28 416.40 473.98 896.49 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.83 299.81 403.73 404.09 491.72 903.00 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.68 286.77 391.09 395.02 511.03 907.80 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.42 274.90 379.08 386.41 530.46 910.16 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.31 265.94 369.75 378.19 548.98 909.42 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.42 261.46 364.53 370.69 565.84 905.10 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.67 262.67 364.24 364.24 580.55 896.93 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.74 270.17 359.23 369.05 592.73 884.83 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.17 283.75 356.04 378.50 602.21 868.89 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.36 302.47 355.06 391.76 608.94 849.35 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.67 324.81 356.61 407.85 613.08 826.51 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.59 349.02 360.81 425.74 615.06 800.82 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.90 367.42 373.30 444.27 615.65 772.81 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.63 375.90 396.10 461.75 616.09 743.26 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.96 385.54 416.37 475.64 617.74 713.62 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.00 395.68 433.59 483.19 619.62 687.80 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.75 405.77 447.49 483.11 612.26 676.82 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.11 415.39 457.09 477.21 589.61 686.28 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.91 424.22 455.45 474.22 561.43 705.30 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.95 432.01 440.35 477.92 533.86 727.18 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.04 420.29 438.59 481.01 509.54 749.23 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.02 398.16 443.84 481.61 490.16 770.21 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.73 376.02 447.66 472.96 482.57 789.46 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.09 355.94 450.01 462.22 479.40 806.64 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.06 339.70 450.88 454.94 474.71 821.68 -------------------------------------------------------------------------------- K point *** = 0.390625 0.390625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.66 328.51 450.29 450.70 468.53 834.68 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.06 331.02 450.00 451.44 468.62 833.23 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.44 329.74 447.27 450.49 461.92 841.81 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.39 333.44 442.45 450.28 456.10 849.44 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.43 338.09 436.26 447.02 455.04 856.60 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.04 340.13 428.84 442.10 458.69 863.68 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.64 337.03 420.29 435.92 467.61 870.84 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.68 328.75 410.68 427.57 482.05 877.91 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.62 317.02 400.11 417.37 500.24 884.44 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.92 303.82 388.85 406.34 520.18 889.75 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.96 290.96 377.72 395.48 540.34 893.07 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.04 280.09 368.10 385.42 559.63 893.69 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.33 272.72 361.56 376.48 577.28 891.07 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.74 270.17 359.23 369.05 592.73 884.83 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.28 274.10 360.15 364.95 605.59 874.82 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.56 283.67 357.93 370.85 615.61 861.06 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.99 298.38 356.55 382.53 622.69 843.73 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.67 317.31 357.75 397.68 626.88 823.15 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.08 338.87 361.80 415.16 628.43 799.76 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.04 360.95 368.89 433.77 627.80 774.21 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.61 375.70 384.75 452.02 625.66 747.47 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.97 385.82 404.72 467.80 622.53 721.33 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.22 396.19 422.48 478.57 617.33 699.70 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.36 406.50 437.19 482.43 605.55 689.39 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.26 416.37 447.79 479.94 584.75 693.61 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.71 425.43 450.40 476.19 559.25 707.44 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.50 433.13 440.53 477.65 533.56 725.60 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.40 421.71 440.70 481.00 510.34 745.04 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.20 400.64 446.10 483.05 491.09 764.07 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.75 379.24 450.12 475.02 484.28 781.75 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.89 359.88 452.63 463.91 482.75 797.60 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.43 344.55 453.52 456.51 479.52 811.41 -------------------------------------------------------------------------------- K point *** = 0.390625 0.421875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.95 335.94 451.86 453.37 474.70 823.21 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.28 345.07 450.08 456.96 474.74 818.63 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.10 341.87 449.11 454.63 469.10 826.02 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.14 344.24 445.05 454.78 463.49 832.42 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.00 350.28 438.33 454.31 461.14 838.35 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.71 354.86 429.97 450.55 465.09 844.25 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.08 354.46 420.31 445.81 474.15 850.40 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.69 348.27 409.57 439.41 488.55 856.77 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.06 337.78 398.08 430.90 506.92 863.01 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.67 325.00 386.33 420.69 527.27 868.49 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.96 311.72 375.10 409.58 547.97 872.50 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.25 299.47 365.50 398.40 567.87 874.28 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.71 289.67 358.78 387.85 586.15 873.22 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.17 283.75 356.04 378.50 602.21 868.89 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.56 283.67 357.93 370.85 615.61 861.06 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.65 289.86 363.86 366.03 626.07 849.67 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.70 300.49 362.19 375.68 633.39 834.86 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.00 314.97 362.28 390.01 637.55 816.93 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.49 332.59 365.55 406.81 638.61 796.36 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.68 351.99 371.92 424.94 636.79 773.84 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.58 371.12 381.39 443.06 632.33 750.50 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.38 386.41 395.47 459.46 625.27 728.22 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.21 398.22 411.96 472.04 614.84 710.19 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.07 409.20 426.73 478.90 599.49 700.47 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.81 419.54 437.98 479.67 578.90 701.01 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.20 428.85 443.01 477.29 555.25 709.96 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.98 433.82 440.71 477.31 531.36 723.94 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.86 420.86 445.84 480.17 509.41 740.16 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.57 401.75 451.41 483.00 490.67 756.74 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.76 381.92 455.53 475.49 484.72 772.50 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.74 364.61 457.75 464.59 484.63 786.78 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.06 354.20 455.47 460.22 482.85 799.24 -------------------------------------------------------------------------------- K point *** = 0.390625 0.453125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.30 349.41 451.66 459.10 479.47 809.81 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.08 363.63 448.68 465.73 479.37 801.92 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.65 359.97 448.90 462.39 475.04 808.13 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.08 359.39 447.42 460.70 470.10 813.35 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.01 364.29 441.46 461.93 466.33 818.06 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.63 370.54 432.56 459.26 470.20 822.75 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.99 372.95 421.98 455.42 479.49 827.77 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.18 369.29 410.34 450.73 493.72 833.23 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.89 360.48 398.12 444.13 512.03 838.91 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.72 348.59 385.91 435.41 532.52 844.30 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.12 335.44 374.47 425.05 553.52 848.72 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.47 322.51 364.79 413.78 573.79 851.44 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.93 311.09 357.98 402.42 592.48 851.82 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.36 302.47 355.06 391.76 608.94 849.35 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.99 298.38 356.55 382.53 622.69 843.73 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.70 300.49 362.19 375.68 633.39 834.86 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.39 307.91 367.52 375.80 640.80 822.83 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.05 318.87 367.40 387.77 644.77 807.91 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.22 332.52 369.50 403.33 645.25 790.59 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.94 348.26 374.90 420.30 642.24 771.60 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.69 365.27 383.21 437.36 635.76 752.08 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.41 382.37 393.66 453.08 625.71 733.71 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.24 398.22 405.60 465.83 611.87 718.78 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.18 411.86 418.10 474.04 594.16 709.68 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.11 423.47 429.06 477.05 573.22 707.75 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.75 431.86 437.03 476.46 550.59 712.54 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.77 430.28 445.12 476.32 528.12 722.26 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.74 418.83 452.80 478.59 507.41 734.81 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.08 402.48 458.93 481.61 489.57 748.42 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.57 386.16 462.70 475.68 483.91 761.83 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.33 375.42 460.27 469.70 484.92 774.21 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.76 370.84 453.91 469.38 484.48 785.10 -------------------------------------------------------------------------------- K point *** = 0.390625 0.484375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.22 367.46 449.95 468.27 482.59 794.32 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.47 385.14 445.79 477.14 483.60 783.05 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.27 381.27 446.88 472.96 480.90 788.07 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.59 378.80 447.80 469.35 477.13 792.15 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.83 380.76 444.64 469.54 472.94 795.70 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.97 386.68 436.47 468.33 475.31 799.20 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.06 391.27 425.45 464.87 484.65 803.05 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.09 390.38 413.12 461.45 498.49 807.47 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.21 383.56 400.50 456.77 516.34 812.40 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.21 372.73 388.21 449.97 536.57 817.46 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.63 360.19 376.64 441.02 557.48 822.06 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.90 347.45 366.69 430.47 577.78 825.53 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.25 335.36 359.67 419.11 596.54 827.19 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.67 324.81 356.61 407.85 613.08 826.51 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.67 317.31 357.75 397.68 626.88 823.15 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.00 314.97 362.28 390.01 637.55 816.93 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.05 318.87 367.40 387.77 644.77 807.91 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.19 327.40 369.40 394.56 648.32 796.33 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.41 338.62 371.06 407.29 648.06 782.65 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.48 351.41 375.50 422.19 643.88 767.57 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.69 365.27 383.21 437.36 635.76 752.08 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.46 379.98 393.32 451.37 623.75 737.48 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.57 395.23 404.43 462.87 608.07 725.27 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.92 410.35 415.21 470.66 589.30 716.93 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.34 423.22 425.62 474.21 568.39 713.44 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.49 428.50 438.31 474.58 546.65 714.96 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.87 426.73 449.65 474.70 525.52 720.71 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.69 417.80 458.87 476.58 506.35 729.38 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.41 405.63 465.00 479.41 490.76 739.56 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.09 396.37 464.52 481.89 482.69 750.09 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.65 392.63 457.32 482.18 483.70 760.12 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.59 390.85 450.62 482.03 484.85 769.11 -------------------------------------------------------------------------------- K point *** = 0.390625 0.515625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.76 388.53 446.74 480.32 484.93 776.77 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.53 407.67 441.44 480.98 498.00 762.14 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.32 403.49 443.28 478.50 494.90 765.89 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.50 399.58 445.96 475.14 491.20 768.84 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.38 398.54 446.20 472.82 488.01 771.31 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.15 402.19 440.65 472.92 487.67 773.69 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.00 407.59 430.33 472.42 493.53 776.39 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.38 409.51 417.75 470.79 505.43 779.71 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.11 402.63 407.59 468.17 521.79 783.74 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.31 389.61 399.26 463.64 540.89 788.27 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.71 377.57 388.39 456.70 560.98 792.86 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.86 367.78 376.11 447.57 580.67 796.89 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.10 359.73 364.92 436.94 598.94 799.73 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.59 349.02 360.81 425.74 615.06 800.82 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.08 338.87 361.80 415.16 628.43 799.76 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.49 332.59 365.55 406.81 638.61 796.36 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.22 332.52 369.50 403.33 645.25 790.59 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.41 338.62 371.06 407.29 648.06 782.65 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.87 348.58 371.57 417.26 646.86 772.91 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.61 360.07 374.27 429.93 641.59 761.95 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.58 371.12 381.39 443.06 632.33 750.50 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.24 381.85 392.34 455.10 619.37 739.42 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.03 394.06 404.14 464.81 603.21 729.68 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.50 407.86 414.95 471.23 584.66 722.27 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.28 422.13 423.70 474.05 564.73 717.97 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.83 427.87 436.65 474.29 544.66 717.13 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.33 426.73 449.26 474.27 525.82 719.50 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.27 420.46 459.02 475.43 509.95 724.37 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.98 413.69 463.38 477.03 499.93 730.82 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.61 410.97 459.72 479.06 497.58 737.97 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.41 411.29 452.29 481.03 498.86 745.10 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.97 411.70 445.81 482.14 500.03 751.69 -------------------------------------------------------------------------------- K point *** = 0.390625 0.546875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.99 410.61 442.08 482.17 499.82 757.42 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.35 429.18 435.79 479.65 520.29 739.59 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.94 424.56 438.40 478.90 517.28 741.83 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.42 419.33 442.34 477.04 513.37 743.59 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.90 415.61 445.37 474.67 509.83 745.03 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.40 415.98 443.65 473.98 508.38 746.40 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.94 420.34 435.61 475.25 511.04 748.03 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.30 423.63 424.47 476.32 519.09 750.24 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.93 410.15 424.34 476.39 532.03 753.25 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.44 396.80 419.21 474.79 548.30 757.08 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.87 384.96 410.24 470.66 566.15 761.47 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.93 375.71 398.82 463.81 584.06 765.93 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.16 369.82 386.10 454.70 600.85 769.90 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.90 367.42 373.30 444.27 615.65 772.81 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.04 360.95 368.89 433.77 627.80 774.21 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.68 351.99 371.92 424.94 636.79 773.84 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.94 348.26 374.90 420.30 642.24 771.60 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.48 351.41 375.50 422.19 643.88 767.57 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.61 360.07 374.27 429.93 641.59 761.95 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.34 371.67 373.82 440.67 635.44 755.10 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.61 375.70 384.75 452.02 625.66 747.47 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.43 381.07 397.76 462.32 612.72 739.60 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.34 389.84 409.96 470.34 597.28 732.19 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.73 401.47 420.48 475.26 580.20 725.95 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.94 414.92 428.26 476.99 562.55 721.50 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.17 428.87 431.98 476.56 545.61 719.18 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.21 430.58 441.86 475.67 530.91 718.95 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.99 426.04 451.74 474.97 520.43 720.45 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.75 422.95 455.55 474.82 515.84 723.14 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.08 423.97 452.18 476.33 516.28 726.51 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.59 427.21 445.87 478.00 518.81 730.12 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.13 430.12 440.06 479.04 520.99 733.64 -------------------------------------------------------------------------------- K point *** = 0.390625 0.578125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.04 431.29 436.17 479.59 521.60 736.84 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.08 428.59 448.30 476.02 547.07 716.13 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.29 431.01 444.57 476.64 544.89 716.34 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.65 433.67 440.42 476.61 541.22 716.71 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.92 430.42 442.74 475.30 537.38 717.14 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.57 427.72 444.55 474.00 535.06 717.64 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.35 429.59 440.15 474.96 535.89 718.33 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.40 430.11 434.28 477.29 540.94 719.46 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.32 417.52 437.24 479.45 550.11 721.37 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.35 404.64 435.64 480.83 562.33 724.29 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.91 393.11 429.46 480.31 576.25 728.29 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.03 384.11 419.97 476.88 590.57 733.11 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.44 378.35 408.46 470.45 604.16 738.30 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.63 375.90 396.10 461.75 616.09 743.26 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.61 375.70 384.75 452.02 625.66 747.47 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.58 371.12 381.39 443.06 632.33 750.50 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.69 365.27 383.21 437.36 635.76 752.08 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.69 365.27 383.21 437.36 635.76 752.08 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.58 371.12 381.39 443.06 632.33 750.50 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.61 375.70 384.75 452.02 625.66 747.47 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.63 375.90 396.10 461.75 616.09 743.26 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.44 378.35 408.46 470.45 604.16 738.30 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.03 384.11 419.97 476.88 590.57 733.11 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.91 393.11 429.46 480.31 576.25 728.29 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.35 404.64 435.64 480.83 562.33 724.29 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.32 417.52 437.24 479.45 550.11 721.37 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.40 430.11 434.28 477.29 540.94 719.46 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.35 429.59 440.15 474.96 535.89 718.33 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.57 427.72 444.55 474.00 535.06 717.64 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.92 430.42 442.74 475.30 537.38 717.14 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.65 433.67 440.42 476.61 541.22 716.71 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.29 431.01 444.57 476.64 544.89 716.34 -------------------------------------------------------------------------------- K point *** = 0.390625 0.609375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.08 428.59 448.30 476.02 547.07 716.13 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.91 420.41 461.34 472.45 576.51 693.24 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.56 423.49 460.69 471.88 576.01 690.33 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.45 428.86 453.62 474.19 573.05 688.72 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.82 434.92 446.25 474.78 568.93 688.08 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.81 436.55 444.03 473.73 565.58 687.94 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.86 435.98 443.36 473.57 564.87 687.97 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.33 435.71 440.34 475.69 567.93 688.14 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.11 425.11 445.04 478.36 574.62 688.78 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.96 413.15 447.25 481.00 583.72 690.45 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.89 402.17 444.55 483.31 593.60 693.77 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.27 393.51 437.58 483.81 602.97 699.00 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.08 387.92 427.77 481.29 611.14 705.87 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.96 385.54 416.37 475.64 617.74 713.62 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.97 385.82 404.72 467.80 622.53 721.33 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.38 386.41 395.47 459.46 625.27 728.22 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.41 382.37 393.66 453.08 625.71 733.71 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.46 379.98 393.32 451.37 623.75 737.48 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.24 381.85 392.34 455.10 619.37 739.42 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.43 381.07 397.76 462.32 612.72 739.60 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.44 378.35 408.46 470.45 604.16 738.30 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.82 377.55 420.02 477.57 594.20 735.89 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.19 379.90 430.40 482.39 583.62 732.87 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.45 385.64 438.02 484.38 573.37 729.70 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.01 394.39 441.36 483.88 564.54 726.71 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.87 405.23 439.58 481.76 558.07 723.99 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.53 416.67 433.94 478.65 554.54 721.40 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.76 426.43 427.94 475.41 553.96 718.65 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.01 425.70 431.63 474.10 555.85 715.44 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.82 428.49 431.61 475.74 559.61 711.58 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.94 426.48 437.15 478.00 564.60 707.08 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.69 422.47 446.07 478.43 569.88 702.17 -------------------------------------------------------------------------------- K point *** = 0.390625 0.640625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.32 420.14 454.76 476.28 574.24 697.35 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.01 411.28 457.43 478.86 604.91 674.62 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.92 414.72 464.47 473.71 608.09 665.92 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.04 420.86 463.48 472.15 607.18 660.51 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.97 428.76 455.36 474.04 602.60 658.70 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.45 436.33 447.89 473.83 597.23 658.80 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 364.32 439.16 445.27 472.69 594.20 659.07 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.74 438.93 444.25 473.47 595.36 658.70 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.10 432.07 448.19 475.68 600.89 657.70 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.25 421.66 453.75 477.64 609.27 656.92 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.86 411.51 455.40 480.18 617.29 658.45 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.76 403.30 451.53 483.26 621.42 664.81 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.22 397.94 443.70 484.74 621.44 675.51 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.00 395.68 433.59 483.19 619.62 687.80 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.22 396.19 422.48 478.57 617.33 699.70 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.21 398.22 411.96 472.04 614.84 710.19 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.24 398.22 405.60 465.83 611.87 718.78 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.57 395.23 404.43 462.87 608.07 725.27 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.03 394.06 404.14 464.81 603.21 729.68 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.34 389.84 409.96 470.34 597.28 732.19 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.03 384.11 419.97 476.88 590.57 733.11 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.19 379.90 430.40 482.39 583.62 732.87 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.01 378.55 438.84 485.72 577.22 731.90 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.92 380.59 443.34 486.63 572.24 730.55 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.73 385.94 442.60 485.56 569.31 729.02 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.64 393.97 437.01 482.82 568.68 727.23 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.30 403.41 428.82 478.72 570.08 724.93 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.58 412.13 421.49 474.50 572.96 721.74 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.91 416.38 419.65 472.50 576.82 717.31 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.26 418.67 420.93 474.28 581.43 711.38 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.77 416.28 428.12 478.18 586.79 703.84 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.58 412.80 437.99 481.22 592.88 694.83 -------------------------------------------------------------------------------- K point *** = 0.390625 0.671875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.95 410.76 448.19 481.60 599.28 684.78 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.56 401.47 445.93 484.21 620.96 672.42 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.54 405.17 454.26 482.25 627.05 657.65 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.61 411.83 458.92 478.70 631.78 643.99 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.64 420.77 457.50 476.39 625.47 641.67 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.89 430.57 451.36 475.28 614.44 645.29 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.80 438.25 445.89 473.52 606.88 647.88 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.29 439.62 445.55 472.46 604.51 648.74 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.00 437.28 447.23 473.62 607.59 647.84 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.11 429.45 453.85 474.66 614.89 645.75 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.82 420.49 460.83 474.49 622.73 644.92 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.54 412.91 462.03 476.47 623.94 651.26 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.88 407.85 456.32 480.70 618.98 663.50 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.75 405.77 447.49 483.11 612.26 676.82 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.36 406.50 437.19 482.43 605.55 689.39 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.07 409.20 426.73 478.90 599.49 700.47 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.18 411.86 418.10 474.04 594.16 709.68 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.92 410.35 415.21 470.66 589.30 716.93 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.50 407.86 414.95 471.23 584.66 722.27 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.73 401.47 420.48 475.26 580.20 725.95 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.91 393.11 429.46 480.31 576.25 728.29 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.45 385.64 438.02 484.38 573.37 729.70 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.92 380.59 443.34 486.63 572.24 730.55 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.24 378.76 443.59 487.00 573.22 731.09 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.68 380.36 438.64 485.38 576.25 731.33 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.88 385.03 430.02 481.58 580.81 731.06 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.81 391.77 420.06 476.12 586.15 729.92 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.63 398.55 411.83 470.55 591.58 727.47 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.79 401.92 409.45 467.30 596.66 723.33 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.60 404.27 410.49 468.45 601.29 717.22 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.42 404.96 415.14 473.32 605.65 708.99 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.19 402.46 424.84 479.05 610.16 698.63 -------------------------------------------------------------------------------- K point *** = 0.390625 0.703125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.19 400.76 435.70 483.12 615.22 686.32 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.69 391.36 430.94 482.57 617.78 694.81 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.54 395.25 440.90 484.61 614.19 685.62 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.30 402.28 448.27 483.62 608.51 678.58 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.05 411.95 451.52 480.93 600.69 674.49 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.46 423.14 449.61 478.27 592.00 672.91 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.61 433.85 444.48 475.80 584.61 672.72 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.76 438.40 443.20 473.49 580.44 672.94 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.45 438.18 444.73 473.13 580.27 673.07 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.32 435.53 447.63 474.19 583.39 673.16 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.66 428.56 455.41 473.78 587.90 673.77 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.53 421.86 464.02 470.71 591.42 675.83 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.97 417.23 464.90 471.72 592.13 680.05 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.11 415.39 457.09 477.21 589.61 686.28 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.26 416.37 447.79 479.94 584.75 693.61 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.81 419.54 437.98 479.67 578.90 701.01 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.11 423.47 429.06 477.05 573.22 707.75 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.34 423.22 425.62 474.21 568.39 713.44 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.28 422.13 423.70 474.05 564.73 717.97 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.94 414.92 428.26 476.99 562.55 721.50 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.35 404.64 435.64 480.83 562.33 724.29 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.01 394.39 441.36 483.88 564.54 726.71 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.73 385.94 442.60 485.56 569.31 729.02 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.68 380.36 438.64 485.38 576.25 731.33 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.54 378.14 430.53 482.67 584.56 733.50 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.44 379.23 419.99 477.39 593.28 735.18 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.88 382.84 408.94 470.36 601.53 735.92 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.48 386.91 400.20 463.22 608.65 735.28 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.95 387.54 398.23 458.31 614.21 732.89 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.05 388.62 399.24 458.08 618.03 728.57 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.10 392.24 400.59 462.82 620.12 722.26 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.70 391.79 408.50 470.19 620.64 714.17 -------------------------------------------------------------------------------- K point *** = 0.390625 0.734375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.17 390.51 419.65 477.43 619.84 704.74 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.45 381.44 412.64 473.29 612.13 725.21 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.95 385.46 424.11 479.36 601.65 719.06 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.14 392.78 433.77 482.36 590.00 713.53 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.30 402.97 440.35 482.36 578.03 709.14 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.42 415.04 442.52 480.48 566.76 706.12 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.10 427.48 439.97 478.00 557.49 704.33 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.24 434.90 438.35 475.38 551.54 703.42 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.09 432.31 443.96 473.74 549.58 702.98 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.56 434.03 443.32 474.47 551.11 702.77 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.18 434.45 443.72 475.60 554.73 702.72 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.58 429.68 449.93 475.24 558.61 703.00 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.34 425.73 455.17 473.95 561.17 703.81 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.91 424.22 455.45 474.22 561.43 705.30 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.71 425.43 450.40 476.19 559.25 707.44 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.20 428.85 443.01 477.29 555.25 709.96 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.75 431.86 437.03 476.46 550.59 712.54 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.49 428.50 438.31 474.58 546.65 714.96 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.83 427.87 436.65 474.29 544.66 717.13 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.17 428.87 431.98 476.56 545.61 719.18 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.32 417.52 437.24 479.45 550.11 721.37 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.87 405.23 439.58 481.76 558.07 723.99 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.64 393.97 437.01 482.82 568.68 727.23 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.88 385.03 430.02 481.58 580.81 731.06 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.44 379.23 419.99 477.39 593.28 735.18 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.86 376.80 408.32 470.49 605.04 739.11 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.16 377.24 396.49 461.88 615.24 742.33 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.66 378.01 387.64 453.09 623.25 744.38 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.64 374.06 387.21 446.35 628.62 744.92 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.67 372.44 388.43 444.28 631.09 743.81 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.87 376.55 387.69 448.03 630.54 741.03 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.20 380.84 390.20 455.82 627.03 736.75 -------------------------------------------------------------------------------- K point *** = 0.390625 0.765625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.97 380.47 400.60 464.95 620.77 731.31 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.77 372.30 391.26 458.29 609.27 756.33 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.68 376.40 403.84 467.25 594.63 752.05 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.07 383.94 415.34 473.94 578.59 747.38 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.39 394.48 424.61 477.75 562.23 742.88 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.91 407.08 430.33 478.81 546.88 739.04 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.62 420.44 431.27 478.03 534.10 736.10 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.00 427.79 432.87 476.35 525.33 734.06 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.70 423.27 441.99 474.48 521.38 732.70 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.44 422.18 445.01 474.32 521.71 731.71 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.12 425.53 442.39 476.17 524.73 730.81 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.49 430.69 438.29 477.74 528.69 729.80 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.82 432.68 437.94 478.16 532.08 728.59 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.95 432.01 440.35 477.92 533.86 727.18 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.50 433.13 440.53 477.65 533.56 725.60 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.98 433.82 440.71 477.31 531.36 723.94 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.77 430.28 445.12 476.32 528.12 722.26 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.87 426.73 449.65 474.70 525.52 720.71 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.33 426.73 449.26 474.27 525.82 719.50 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.21 430.58 441.86 475.67 530.91 718.95 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.40 430.11 434.28 477.29 540.94 719.46 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.53 416.67 433.94 478.65 554.54 721.40 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.30 403.41 428.82 478.72 570.08 724.93 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.81 391.77 420.06 476.12 586.15 729.92 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.88 382.84 408.94 470.36 601.53 735.92 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.16 377.24 396.49 461.88 615.24 742.33 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.13 374.90 383.80 451.68 626.48 748.51 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.76 370.72 376.53 441.24 634.65 753.94 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.19 361.40 378.19 432.62 639.35 758.20 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.44 356.57 379.22 428.53 640.34 761.01 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.66 358.49 377.64 430.85 637.61 762.21 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.63 366.01 374.98 438.28 631.29 761.74 -------------------------------------------------------------------------------- K point *** = 0.390625 0.796875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.54 371.17 379.10 448.13 621.69 759.70 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.48 364.30 367.80 440.52 607.96 786.28 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.59 368.49 380.82 451.10 591.23 783.52 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.98 376.24 393.52 460.25 572.77 779.61 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.29 387.02 404.75 467.19 553.51 775.15 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.01 399.86 413.28 471.56 534.74 770.73 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.40 413.51 417.69 473.69 518.11 766.84 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.41 416.58 427.00 474.42 505.47 763.69 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.30 411.80 438.24 474.09 498.40 761.27 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.58 407.71 445.05 473.46 497.18 759.31 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.18 408.04 445.66 474.99 499.63 757.45 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.07 411.91 442.63 477.85 503.42 755.33 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.22 416.63 439.59 480.01 507.05 752.65 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.04 420.29 438.59 481.01 509.54 749.23 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.40 421.71 440.70 481.00 510.34 745.04 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.86 420.86 445.84 480.17 509.41 740.16 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.74 418.83 452.80 478.59 507.41 734.81 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.69 417.80 458.87 476.58 506.35 729.38 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.27 420.46 459.02 475.43 509.95 724.37 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.99 426.04 451.74 474.97 520.43 720.45 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.35 429.59 440.15 474.96 535.89 718.33 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.76 426.43 427.94 475.41 553.96 718.65 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.58 412.13 421.49 474.50 572.96 721.74 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.63 398.55 411.83 470.55 591.58 727.47 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.48 386.91 400.20 463.22 608.65 735.28 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.66 378.01 387.64 453.09 623.25 744.38 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.76 370.72 376.53 441.24 634.65 753.94 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.25 359.90 372.70 429.07 642.36 763.22 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.16 349.15 372.66 418.47 646.10 771.57 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.48 341.76 372.67 412.26 645.81 778.46 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.27 340.31 370.27 412.99 641.58 783.52 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.83 345.52 366.46 419.71 633.62 786.51 -------------------------------------------------------------------------------- K point *** = 0.390625 0.828125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.73 355.39 363.96 429.58 622.28 787.38 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.47 342.20 359.42 422.26 606.41 814.17 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.60 353.69 364.93 433.58 588.82 812.88 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.87 365.28 374.45 444.19 569.37 809.79 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.11 377.29 385.76 453.24 548.86 805.51 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.92 389.29 397.06 460.14 528.44 800.71 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.78 398.18 408.89 464.77 509.65 796.01 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.90 400.85 421.60 467.82 494.24 791.80 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.16 397.54 433.51 470.40 483.46 788.25 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.62 391.71 442.80 471.67 478.94 785.20 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.98 388.77 447.10 471.72 481.13 782.29 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.12 390.54 446.34 474.77 484.74 779.08 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.39 394.44 444.33 478.69 487.94 775.16 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.02 398.16 443.84 481.61 490.16 770.21 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.20 400.64 446.10 483.05 491.09 764.07 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.57 401.75 451.41 483.00 490.67 756.74 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.08 402.48 458.93 481.61 489.57 748.42 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.41 405.63 465.00 479.41 490.76 739.56 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.98 413.69 463.38 477.03 499.93 730.82 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.75 422.95 455.55 474.82 515.84 723.14 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.57 427.72 444.55 474.00 535.06 717.64 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.01 425.70 431.63 474.10 555.85 715.44 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.91 416.38 419.65 472.50 576.82 717.31 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.79 401.92 409.45 467.30 596.66 723.33 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.95 387.54 398.23 458.31 614.21 732.89 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.64 374.06 387.21 446.35 628.62 744.92 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.19 361.40 378.19 432.62 639.35 758.20 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.16 349.15 372.66 418.47 646.10 771.57 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.18 337.75 370.46 405.62 648.82 784.05 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.37 328.54 369.36 396.87 647.54 794.89 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.72 323.62 365.96 395.85 642.41 803.54 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.62 324.94 361.20 401.76 633.63 809.68 -------------------------------------------------------------------------------- K point *** = 0.390625 0.859375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.39 331.92 358.42 411.23 621.51 813.20 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.85 317.77 356.47 404.93 603.35 839.45 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.90 328.74 361.49 416.29 585.62 839.66 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.04 341.31 369.95 427.62 565.96 837.51 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.21 354.40 380.73 438.09 545.15 833.60 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.10 366.73 392.77 446.92 524.25 828.61 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.26 376.59 405.26 453.62 504.72 823.25 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.13 381.87 417.59 458.31 488.41 818.08 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.93 381.05 429.14 461.99 476.68 813.39 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.54 375.43 439.13 465.82 469.35 809.16 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.93 369.82 446.18 465.01 470.95 805.11 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.40 369.06 448.38 465.84 475.58 800.79 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.19 372.18 447.64 469.51 479.62 795.71 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.73 376.02 447.66 472.96 482.57 789.46 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.75 379.24 450.12 475.02 484.28 781.75 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.76 381.92 455.53 475.49 484.72 772.50 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.57 386.16 462.70 475.68 483.91 761.83 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.09 396.37 464.52 481.89 482.69 750.09 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.61 410.97 459.72 479.06 497.58 737.97 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.08 423.97 452.18 476.33 516.28 726.51 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.92 430.42 442.74 475.30 537.38 717.14 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.82 428.49 431.61 475.74 559.61 711.58 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.26 418.67 420.93 474.28 581.43 711.38 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.60 404.27 410.49 468.45 601.29 717.22 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.05 388.62 399.24 458.08 618.03 728.57 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.67 372.44 388.43 444.28 631.09 743.81 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.44 356.57 379.22 428.53 640.34 761.01 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.48 341.76 372.67 412.26 645.81 778.46 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.37 328.54 369.36 396.87 647.54 794.89 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.92 317.47 368.42 384.48 645.57 809.38 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.49 309.53 365.00 380.60 639.98 821.35 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.09 306.53 358.95 385.68 630.91 830.42 -------------------------------------------------------------------------------- K point *** = 0.390625 0.890625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.59 309.74 355.62 394.41 618.59 836.45 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.02 295.71 356.13 389.60 598.08 861.65 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.00 304.94 361.05 400.26 580.61 863.46 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.10 316.81 369.39 411.55 561.20 862.42 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.28 329.96 380.02 422.74 540.57 859.07 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.29 343.00 391.80 433.02 519.72 854.12 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.71 354.28 403.82 441.62 500.07 848.31 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.07 361.86 415.42 448.12 483.49 842.29 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.81 363.86 426.15 452.82 471.72 836.51 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.27 360.16 435.64 456.69 465.08 831.09 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.50 353.75 443.43 457.99 464.69 825.84 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.42 349.95 448.38 457.26 469.52 820.34 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.54 351.89 449.44 459.42 474.82 814.10 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.09 355.94 450.01 462.22 479.40 806.64 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.89 359.88 452.63 463.91 482.75 797.60 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.74 364.61 457.75 464.59 484.63 786.78 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.33 375.42 460.27 469.70 484.92 774.21 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.65 392.63 457.32 482.18 483.70 760.12 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.41 411.29 452.29 481.03 498.86 745.10 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.59 427.21 445.87 478.00 518.81 730.12 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.65 433.67 440.42 476.61 541.22 716.71 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.94 426.48 437.15 478.00 564.60 707.08 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.77 416.28 428.12 478.18 586.79 703.84 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.42 404.96 415.14 473.32 605.65 708.99 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.10 392.24 400.59 462.82 620.12 722.26 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.87 376.55 387.69 448.03 630.54 741.03 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.66 358.49 377.64 430.85 637.61 762.21 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.27 340.31 370.27 412.99 641.58 783.52 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.72 323.62 365.96 395.85 642.41 803.54 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.49 309.53 365.00 380.60 639.98 821.35 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.62 298.69 366.72 368.84 634.23 836.35 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.72 291.81 359.55 372.68 625.22 848.17 -------------------------------------------------------------------------------- K point *** = 0.390625 0.921875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.67 290.70 355.51 380.21 613.08 856.61 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.62 277.75 358.11 377.26 590.23 880.42 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.64 284.44 362.85 386.45 573.29 883.93 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.85 294.78 371.14 396.81 554.40 884.16 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.19 307.36 381.68 407.85 534.25 881.62 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.42 320.66 393.12 418.90 513.77 876.96 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.15 333.01 404.47 429.07 494.30 870.94 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.96 342.51 415.14 437.50 477.66 864.28 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.35 347.18 424.83 443.81 465.84 857.54 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.86 346.20 433.36 448.61 459.55 850.96 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.99 341.28 440.60 452.15 458.21 844.48 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.08 336.13 446.32 452.30 462.58 837.76 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.27 335.49 449.63 452.72 468.80 830.33 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.06 339.70 450.88 454.94 474.71 821.68 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.43 344.55 453.52 456.51 479.52 811.41 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.06 354.20 455.47 460.22 482.85 799.24 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.76 370.84 453.91 469.38 484.48 785.10 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.59 390.85 450.62 482.03 484.85 769.11 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.97 411.70 445.81 482.14 500.03 751.69 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.13 430.12 440.06 479.04 520.99 733.64 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.29 431.01 444.57 476.64 544.89 716.34 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.69 422.47 446.07 478.43 569.88 702.17 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.58 412.80 437.99 481.22 592.88 694.83 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.19 402.46 424.84 479.05 610.16 698.63 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.70 391.79 408.50 470.19 620.64 714.17 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.20 380.84 390.20 455.82 627.03 736.75 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.63 366.01 374.98 438.28 631.29 761.74 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.83 345.52 366.46 419.71 633.62 786.51 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.62 324.94 361.20 401.76 633.63 809.68 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.09 306.53 358.95 385.68 630.91 830.42 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.72 291.81 359.55 372.68 625.22 848.17 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.52 281.58 360.97 365.44 616.47 862.55 -------------------------------------------------------------------------------- K point *** = 0.390625 0.953125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.24 276.34 357.80 369.70 604.74 873.33 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.33 265.24 361.90 369.03 579.72 895.45 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.57 268.67 365.91 376.41 563.48 900.76 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.01 276.81 374.05 384.96 545.31 902.45 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.60 288.21 384.87 394.49 525.83 900.95 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.15 301.25 396.36 405.04 505.94 896.87 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.33 314.16 406.92 416.22 486.89 890.95 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.71 325.02 416.31 426.55 470.44 883.92 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.85 331.83 424.72 434.73 458.69 876.42 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.29 333.41 432.18 440.69 452.83 868.82 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.60 330.77 438.61 445.80 451.49 861.15 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.40 326.97 443.89 448.78 454.65 853.20 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.35 325.28 447.90 449.30 461.48 844.53 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.66 328.51 450.29 450.70 468.53 834.68 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.95 335.94 451.86 453.37 474.70 823.21 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.30 349.41 451.66 459.10 479.47 809.81 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.22 367.46 449.95 468.27 482.59 794.32 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.76 388.53 446.74 480.32 484.93 776.77 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.99 410.61 442.08 482.17 499.82 757.42 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.04 431.29 436.17 479.59 521.60 736.84 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.08 428.59 448.30 476.02 547.07 716.13 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.32 420.14 454.76 476.28 574.24 697.35 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.95 410.76 448.19 481.60 599.28 684.78 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.19 400.76 435.70 483.12 615.22 686.32 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.17 390.51 419.65 477.43 619.84 704.74 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.97 380.47 400.60 464.95 620.77 731.31 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.54 371.17 379.10 448.13 621.69 759.70 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.73 355.39 363.96 429.58 622.28 787.38 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.39 331.92 358.42 411.23 621.51 813.20 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.59 309.74 355.62 394.41 618.59 836.45 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.67 290.70 355.51 380.21 613.08 856.61 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.24 276.34 357.80 369.70 604.74 873.33 -------------------------------------------------------------------------------- K point *** = 0.390625 0.984375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.98 267.70 361.30 364.55 593.57 886.32 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.01 271.43 359.13 363.30 606.48 876.27 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.24 272.57 361.23 369.68 591.87 883.40 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.42 278.86 367.82 377.75 574.79 886.90 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.68 289.10 377.86 387.17 555.75 887.07 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.92 301.83 389.28 398.10 535.42 884.42 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.92 315.47 400.15 410.44 514.74 879.63 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.34 328.31 410.04 422.70 495.01 873.49 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.76 338.42 419.12 433.18 478.04 866.75 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.73 343.83 427.38 441.12 465.86 859.97 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.82 343.57 434.74 446.92 459.43 853.42 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.64 339.12 441.04 451.03 458.14 847.05 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.82 333.85 446.17 451.77 462.31 840.48 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.06 331.02 450.00 451.44 468.62 833.23 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.53 333.40 452.08 452.53 474.72 824.76 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.03 340.05 453.46 455.03 479.74 814.64 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.52 352.87 452.96 460.89 483.23 802.58 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.58 370.34 450.93 470.24 484.99 788.50 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.28 390.81 447.39 482.74 485.55 772.50 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.72 412.11 442.40 482.70 500.79 755.02 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.04 431.29 436.17 479.59 521.60 736.84 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.44 428.30 444.71 477.24 545.39 719.39 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.14 419.59 446.29 479.19 570.33 705.04 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.37 410.01 438.01 481.96 593.40 697.53 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.35 399.85 424.59 479.49 610.93 701.12 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.25 389.47 407.82 470.12 621.79 716.45 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.18 379.31 388.46 455.18 628.50 738.95 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.08 366.44 370.73 437.11 632.98 763.97 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.82 344.47 362.80 418.20 635.45 788.85 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.22 322.72 357.43 400.13 635.52 812.16 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.29 303.12 354.80 384.23 632.82 833.04 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.32 287.34 354.95 371.62 627.10 850.93 -------------------------------------------------------------------------------- K point *** = 0.421875 0.015625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.83 276.72 357.49 363.44 618.30 865.42 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.24 272.57 361.23 369.68 591.87 883.40 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.54 270.70 359.39 376.07 578.12 892.48 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.45 274.78 361.78 384.38 562.01 897.78 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.73 283.19 368.20 393.86 543.98 899.53 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.36 294.53 377.56 404.03 524.67 898.13 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.10 307.25 388.52 414.32 504.99 894.18 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.58 319.67 399.87 424.00 486.23 888.40 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.35 329.86 410.78 432.23 470.17 881.50 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.92 335.87 420.78 438.39 458.94 874.07 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.80 336.62 429.64 442.91 453.44 866.47 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.46 333.38 437.21 447.43 451.88 858.73 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.23 329.58 443.29 449.78 455.10 850.65 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.44 329.74 447.27 450.49 461.92 841.81 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.23 334.64 449.11 452.77 468.75 831.78 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.27 340.43 451.72 454.74 474.67 820.15 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.60 350.91 453.72 458.63 479.22 806.61 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.23 368.11 452.64 467.52 482.15 791.03 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.96 388.69 449.77 479.71 484.22 773.45 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.20 410.29 445.38 481.63 499.07 754.13 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.13 430.12 440.06 479.04 520.99 733.64 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.97 431.39 448.01 475.48 546.56 713.06 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.93 423.15 454.33 475.58 573.77 694.45 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.25 413.76 447.95 480.78 598.74 682.09 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.13 403.66 435.67 482.44 614.36 683.97 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.73 393.26 419.91 477.12 618.55 702.73 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.12 382.98 401.34 465.16 619.20 729.38 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.24 372.69 381.30 448.85 619.96 757.68 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.92 355.66 368.18 430.68 620.45 785.22 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.06 333.57 362.37 412.52 619.63 810.86 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.75 312.54 359.78 395.66 616.71 833.93 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.47 294.58 359.99 381.23 611.23 853.93 -------------------------------------------------------------------------------- K point *** = 0.421875 0.046875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.03 280.99 362.22 370.66 602.95 870.51 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.42 278.86 367.82 377.75 574.79 886.90 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.45 274.78 361.78 384.38 562.01 897.78 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.52 277.35 359.83 392.62 546.96 904.88 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.05 284.53 362.20 401.73 530.07 908.31 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.40 294.74 368.37 411.12 511.96 908.39 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.41 306.47 377.37 420.14 493.54 905.62 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.69 318.10 388.08 428.06 476.14 900.61 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.72 327.74 399.44 434.04 461.78 894.00 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.90 333.47 410.62 437.30 452.99 886.36 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.54 334.33 421.02 439.04 450.05 878.06 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.75 331.94 430.19 442.67 449.41 869.25 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.08 330.38 437.65 448.15 449.83 859.80 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.39 333.44 442.45 450.28 456.10 849.44 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.87 339.65 444.79 453.47 463.16 837.83 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.63 346.59 447.39 456.65 469.48 824.63 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.83 354.84 451.38 459.53 474.62 809.57 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.58 368.23 454.22 465.35 478.39 792.51 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.00 387.02 453.43 476.23 481.66 773.44 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.73 407.66 450.33 479.56 496.21 752.51 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.59 427.21 445.87 478.00 518.81 730.12 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.97 436.09 448.20 474.40 545.79 706.99 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.15 429.34 459.56 470.76 575.25 684.56 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.41 420.40 456.27 476.39 603.44 666.57 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.98 410.53 445.29 481.81 617.96 666.13 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.01 400.24 430.91 480.92 613.26 689.94 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.57 390.01 413.59 472.91 607.15 720.35 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.59 380.10 394.15 459.37 604.04 751.04 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.94 367.01 377.71 442.84 602.58 780.41 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.59 346.21 370.76 425.37 600.95 807.68 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.85 324.77 368.14 408.29 597.91 832.33 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.39 305.47 368.50 392.63 592.73 853.96 -------------------------------------------------------------------------------- K point *** = 0.421875 0.078125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.10 289.73 371.03 379.64 585.06 872.24 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.68 289.10 377.86 387.17 555.75 887.07 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.73 283.19 368.20 393.86 543.98 899.53 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 257.05 284.53 362.20 401.73 530.07 908.31 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.31 291.03 360.34 410.17 514.44 913.46 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.52 300.70 362.62 418.55 497.72 915.21 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.84 311.88 368.56 426.12 480.90 913.93 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.04 322.83 377.31 431.97 465.60 910.10 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.59 331.62 387.85 434.69 454.64 904.26 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.81 336.31 399.20 433.88 450.40 896.90 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.77 336.31 410.51 434.14 449.66 888.38 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.24 333.99 421.03 437.89 449.45 878.86 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.58 333.69 430.03 443.03 450.45 868.32 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.43 338.09 436.26 447.02 455.04 856.60 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.68 345.73 439.24 451.88 461.24 843.47 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.89 354.43 441.63 457.27 466.91 828.69 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.13 363.64 445.42 462.30 471.47 812.06 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.97 374.52 450.52 467.78 474.83 793.47 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.72 389.00 454.37 475.62 478.40 772.92 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.08 406.39 454.68 477.14 493.72 750.51 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.08 423.97 452.18 476.33 516.28 726.51 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.66 438.08 449.68 473.72 543.89 701.41 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.40 437.18 458.41 469.11 574.74 676.06 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.73 429.43 462.06 470.00 606.35 652.54 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.97 420.14 452.48 478.20 620.37 649.61 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.32 410.19 439.94 481.17 605.28 679.94 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.90 400.19 424.33 477.50 592.94 712.74 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.67 390.60 406.17 467.59 586.02 744.68 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.58 379.21 389.19 453.58 582.59 774.98 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.75 359.87 381.46 437.67 580.18 803.14 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.66 338.60 378.74 421.27 577.05 828.75 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.16 318.72 379.09 405.31 572.21 851.47 -------------------------------------------------------------------------------- K point *** = 0.421875 0.109375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.10 301.69 381.98 390.62 565.17 870.99 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.92 301.83 389.28 398.10 535.42 884.42 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.36 294.53 377.56 404.03 524.67 898.13 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.40 294.74 368.37 411.12 511.96 908.39 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.52 300.70 362.62 418.55 497.72 915.21 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.22 310.09 360.81 425.54 482.67 918.71 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.17 320.89 362.98 431.13 468.11 919.15 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.42 331.09 368.72 433.69 456.58 916.86 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.61 338.41 377.29 431.76 451.36 912.25 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.07 340.86 387.76 429.58 450.34 905.69 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.82 338.66 399.15 431.42 449.97 897.46 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.47 335.24 410.55 435.99 450.09 887.71 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.33 334.97 420.96 439.65 452.84 876.47 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.04 340.13 428.84 442.10 458.69 863.68 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.97 349.31 432.59 447.13 465.13 849.21 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.47 360.23 434.64 453.97 470.74 832.92 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.94 371.69 437.74 460.90 475.02 814.72 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.07 383.49 442.70 467.89 478.08 794.56 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.42 395.96 448.75 474.34 482.22 772.47 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.63 409.29 453.65 475.95 494.88 748.59 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.75 422.95 455.55 474.82 515.84 723.14 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 367.12 435.79 454.59 472.62 542.72 696.50 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.48 443.43 454.84 469.57 573.44 669.23 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.53 439.48 460.36 467.57 606.33 642.19 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.79 431.51 455.63 473.68 616.56 640.22 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.66 422.28 445.86 478.70 594.30 674.07 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.35 412.73 432.62 478.74 577.39 707.28 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.94 403.44 416.34 472.79 566.91 739.29 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.51 392.41 400.57 462.00 561.43 769.64 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.34 373.54 393.34 448.44 558.17 797.95 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.07 352.79 390.49 433.63 554.93 823.86 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.64 332.97 390.50 418.46 550.42 847.08 -------------------------------------------------------------------------------- K point *** = 0.421875 0.140625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.90 315.44 392.87 403.74 544.00 867.35 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.92 315.47 400.15 410.44 514.74 879.63 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.10 307.25 388.52 414.32 504.99 894.18 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.41 306.47 377.37 420.14 493.54 905.62 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.84 311.88 368.56 426.12 480.90 913.93 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 249.17 320.89 362.98 431.13 468.11 919.15 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.49 331.04 361.14 433.44 457.40 921.43 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.24 339.74 363.19 431.15 452.10 920.95 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.34 344.15 368.79 427.76 451.00 917.95 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.31 342.72 377.28 428.43 450.70 912.65 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.25 337.41 387.79 432.54 450.86 905.22 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.78 332.34 399.30 435.71 453.67 895.76 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.15 331.53 410.71 435.81 460.07 884.30 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.64 337.03 420.29 435.92 467.61 870.84 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.09 347.54 425.00 440.44 474.62 855.32 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.72 360.66 426.54 448.48 480.46 837.74 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.11 374.81 428.74 456.78 485.04 818.08 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.38 389.16 432.86 464.53 488.77 796.38 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.89 402.94 438.91 471.23 493.34 772.75 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.87 415.32 445.83 475.07 502.83 747.35 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.99 426.04 451.74 474.97 520.43 720.45 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 371.49 435.47 455.42 472.35 544.92 692.43 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.17 443.40 456.62 469.02 573.77 663.91 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 371.37 446.87 455.90 467.77 604.16 636.43 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.71 442.84 453.37 471.01 605.37 640.41 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.78 435.15 447.21 475.54 581.55 672.24 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.06 426.38 437.17 477.58 561.58 704.34 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.83 417.50 423.48 475.01 547.91 735.47 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.35 404.70 411.51 467.61 540.28 765.12 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.07 385.73 405.67 456.88 536.09 792.90 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.78 365.91 402.53 444.35 532.66 818.48 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.56 346.76 401.87 430.92 528.41 841.61 -------------------------------------------------------------------------------- K point *** = 0.421875 0.171875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.27 329.44 403.07 417.57 522.54 862.06 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.34 328.31 410.04 422.70 495.01 873.49 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.58 319.67 399.87 424.00 486.23 888.40 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.69 318.10 388.08 428.06 476.14 900.61 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.04 322.83 377.31 431.97 465.60 910.10 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 252.42 331.09 368.72 433.69 456.58 916.86 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.24 339.74 363.19 431.15 452.10 920.95 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.29 345.33 361.30 427.32 451.27 922.40 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.85 345.03 363.23 427.42 451.20 921.27 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.70 339.22 368.77 431.34 451.80 917.60 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.19 331.24 377.30 434.06 455.68 911.42 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.08 324.84 387.95 432.81 463.73 902.74 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.64 323.34 399.64 429.76 473.15 891.57 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.68 328.75 410.68 427.57 482.05 877.91 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.46 340.08 416.66 431.10 489.67 861.79 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.06 354.82 417.46 440.68 495.76 843.26 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.15 371.24 418.64 450.99 500.42 822.41 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.07 388.26 421.75 460.50 504.22 799.35 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.53 404.79 427.03 468.56 508.60 774.26 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.24 419.29 434.13 474.03 516.45 747.35 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.21 430.58 441.86 475.67 530.91 718.95 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.72 438.85 448.68 473.89 552.26 689.50 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.16 444.33 454.30 470.07 578.25 659.77 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.01 447.00 457.65 466.77 603.94 633.29 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.14 447.04 454.00 469.05 595.21 643.57 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.89 444.00 447.00 473.18 569.62 673.31 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.84 436.74 439.68 475.85 547.03 703.81 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.55 426.05 431.52 475.35 530.44 733.56 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.55 411.57 423.93 470.71 520.64 761.98 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.50 394.39 418.04 462.69 515.43 788.69 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.43 376.26 414.28 452.68 511.74 813.39 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.54 358.45 412.71 441.53 507.61 835.87 -------------------------------------------------------------------------------- K point *** = 0.421875 0.203125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.84 342.00 412.67 430.17 502.14 855.95 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.76 338.42 419.12 433.18 478.04 866.75 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.35 329.86 410.78 432.23 470.17 881.50 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.72 327.74 399.44 434.04 461.78 894.00 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.59 331.62 387.85 434.69 454.64 904.26 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.61 338.41 377.29 431.76 451.36 912.25 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.34 344.15 368.79 427.76 451.00 917.95 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 246.85 345.03 363.23 427.42 451.20 921.27 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 245.69 339.92 361.25 431.09 452.20 922.09 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.02 331.04 363.10 433.50 457.19 920.27 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.47 321.57 368.65 431.43 467.12 915.67 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.12 314.33 377.33 426.89 478.81 908.19 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.36 312.09 388.27 421.69 490.16 897.78 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.62 317.02 400.11 417.37 500.24 884.44 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.50 328.55 407.78 418.99 508.61 868.22 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.89 344.22 407.55 430.21 515.14 849.22 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.52 362.14 407.65 442.77 519.98 827.60 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.80 381.10 409.87 454.65 523.69 803.53 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.65 400.01 414.43 465.08 527.52 777.25 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.01 417.42 421.06 472.89 533.83 749.02 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.17 428.87 431.98 476.56 545.61 719.18 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.70 437.31 442.33 475.84 564.03 688.19 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.21 444.68 449.15 472.25 587.46 656.86 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.20 447.76 454.74 468.20 609.13 630.52 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 375.04 445.75 457.28 467.60 589.86 647.51 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.26 440.35 454.93 471.17 561.27 676.23 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 367.74 432.87 450.33 474.46 535.74 705.26 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.86 423.47 443.95 475.39 516.06 733.50 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.31 411.59 436.62 472.65 504.00 760.45 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.09 397.30 430.04 466.49 497.93 785.75 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.53 381.72 425.35 458.53 494.05 809.17 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.18 366.05 422.77 449.59 489.94 830.54 -------------------------------------------------------------------------------- K point *** = 0.421875 0.234375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.21 351.20 421.64 440.30 484.68 849.75 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.73 343.83 427.38 441.12 465.86 859.97 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.92 335.87 420.78 438.39 458.94 874.07 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.90 333.47 410.62 437.30 452.99 886.36 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.81 336.31 399.20 433.88 450.40 896.90 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.07 340.86 387.76 429.58 450.34 905.69 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 258.31 342.72 377.28 428.43 450.70 912.65 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.70 339.22 368.77 431.34 451.80 917.60 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 248.02 331.04 363.10 433.50 457.19 920.27 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 247.67 320.68 361.00 431.03 468.45 920.33 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.68 310.52 362.81 425.68 482.22 917.50 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.50 302.77 368.47 419.12 496.11 911.53 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.84 299.76 377.44 412.37 508.97 902.30 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.92 303.82 388.85 406.34 520.18 889.75 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.64 314.99 398.60 404.94 529.40 873.94 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.66 330.92 396.95 417.65 536.54 855.01 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.68 349.62 396.06 432.09 541.74 833.15 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.13 369.74 397.64 446.25 545.46 808.57 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.03 389.87 402.12 459.35 548.73 781.56 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.47 405.59 412.35 470.21 553.50 752.42 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.94 414.92 428.26 476.99 562.55 721.50 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.20 424.14 441.78 478.32 577.97 689.21 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.12 433.18 451.63 474.85 599.25 656.10 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 364.44 441.06 457.20 469.39 619.67 627.52 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.76 445.32 456.10 468.19 589.13 652.46 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 370.48 440.07 455.70 470.76 557.85 680.40 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.94 429.70 455.63 473.58 529.65 708.13 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.58 418.19 452.85 475.46 506.71 734.93 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.34 406.10 447.44 474.74 491.50 760.38 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.09 393.47 440.94 469.71 484.65 784.15 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.60 380.54 435.43 462.68 481.15 806.06 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.02 367.60 431.85 455.27 477.26 826.01 -------------------------------------------------------------------------------- K point *** = 0.421875 0.265625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.94 355.06 429.84 447.66 472.16 843.97 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.82 343.57 434.74 446.92 459.43 853.42 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.80 336.62 429.64 442.91 453.44 866.47 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.54 334.33 421.02 439.04 450.05 878.06 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.77 336.31 410.51 434.14 449.66 888.38 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.82 338.66 399.15 431.42 449.97 897.46 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.25 337.41 387.79 432.54 450.86 905.22 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.19 331.24 377.30 434.06 455.68 911.42 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 253.47 321.57 368.65 431.43 467.12 915.67 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 250.68 310.52 362.81 425.68 482.22 917.50 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 251.11 300.05 360.58 418.36 498.27 916.46 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.65 291.92 362.41 410.41 513.82 912.18 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.50 288.13 368.28 402.56 528.02 904.42 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.96 290.96 377.72 395.48 540.34 893.07 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.26 301.19 389.40 390.34 550.48 878.17 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.76 316.72 385.85 404.28 558.33 859.84 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.04 335.53 384.30 419.69 563.98 838.31 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.50 356.23 385.50 435.50 567.81 813.83 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.21 376.96 390.19 450.90 570.62 786.70 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.41 391.95 402.58 464.77 573.95 757.28 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.73 401.47 420.48 475.26 580.20 725.95 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.10 411.11 436.51 480.16 591.92 693.18 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.53 420.93 449.44 478.66 609.64 659.69 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.94 430.24 459.20 472.00 621.56 636.42 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.12 438.17 461.23 467.03 590.35 659.37 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.71 441.15 452.46 471.54 558.22 685.65 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.25 430.45 453.38 474.50 528.77 711.93 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.06 415.16 455.21 476.04 503.80 737.31 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.29 399.45 454.15 476.38 485.10 761.29 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.24 385.27 449.77 472.79 475.97 783.54 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.02 373.41 444.18 465.38 473.80 803.89 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.63 362.89 439.80 459.12 470.32 822.28 -------------------------------------------------------------------------------- K point *** = 0.421875 0.296875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.64 352.86 437.10 452.85 465.42 838.75 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.64 339.12 441.04 451.03 458.14 847.05 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.46 333.38 437.21 447.43 451.88 858.73 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.75 331.94 430.19 442.67 449.41 869.25 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.24 333.99 421.03 437.89 449.45 878.86 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.47 335.24 410.55 435.99 450.09 887.71 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.78 332.34 399.30 435.71 453.67 895.76 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.08 324.84 387.95 432.81 463.73 902.74 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.12 314.33 377.33 426.89 478.81 908.19 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 256.50 302.77 368.47 419.12 496.11 911.53 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 254.65 291.92 362.41 410.41 513.82 912.18 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 255.80 283.38 360.08 401.46 530.77 909.63 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.67 278.75 361.99 392.93 546.21 903.52 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.04 280.09 368.10 385.42 559.63 893.69 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.66 288.78 376.91 380.49 570.72 880.12 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.49 303.16 374.78 391.51 579.31 862.90 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.93 321.41 373.08 406.65 585.46 842.27 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.26 342.17 374.14 423.17 589.43 818.49 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.60 363.55 378.73 440.13 591.84 791.93 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.36 379.83 390.93 456.43 593.84 762.99 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.34 389.84 409.96 470.34 597.28 732.19 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.59 399.78 427.83 479.42 604.41 700.31 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.21 409.99 442.89 481.73 615.41 669.49 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.18 419.96 454.86 477.37 616.49 653.72 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.39 429.12 462.68 469.12 590.61 668.89 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.61 436.53 453.83 471.78 559.82 691.99 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.54 433.55 447.33 475.91 530.69 716.28 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.83 416.31 451.13 478.03 505.42 740.08 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.99 396.88 454.05 477.81 485.81 762.59 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.09 378.42 454.37 470.23 477.97 783.36 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.78 364.22 451.04 463.17 474.66 802.18 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.59 354.60 446.47 459.27 470.22 819.00 -------------------------------------------------------------------------------- K point *** = 0.421875 0.328125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.92 346.60 443.28 455.35 464.61 833.89 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.82 333.85 446.17 451.77 462.31 840.48 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.23 329.58 443.29 449.78 455.10 850.65 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.08 330.38 437.65 448.15 449.83 859.80 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.58 333.69 430.03 443.03 450.45 868.32 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.33 334.97 420.96 439.65 452.84 876.47 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.15 331.53 410.71 435.81 460.07 884.30 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.64 323.34 399.64 429.76 473.15 891.57 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.36 312.09 388.27 421.69 490.16 897.78 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.84 299.76 377.44 412.37 508.97 902.30 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.50 288.13 368.28 402.56 528.02 904.42 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 259.67 278.75 361.99 392.93 546.21 903.52 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.45 273.09 359.59 384.04 562.81 899.17 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.33 272.72 361.56 376.48 577.28 891.07 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.01 279.28 366.37 372.21 589.28 879.15 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.08 291.70 364.92 380.26 598.62 863.48 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.57 308.59 363.42 393.99 605.26 844.26 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.63 328.83 364.51 410.24 609.37 821.81 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.49 350.73 368.77 427.88 611.38 796.50 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.77 369.99 378.68 445.77 612.08 768.86 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.43 381.07 397.76 462.32 612.72 739.60 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.61 391.17 416.92 475.21 614.70 710.07 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.43 401.55 433.55 481.94 617.24 683.84 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.91 411.80 447.03 481.46 610.94 671.81 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.91 421.47 456.25 475.66 588.66 680.67 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.26 430.10 454.43 473.13 560.50 699.34 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.73 435.07 442.47 476.83 532.81 720.91 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.07 419.31 445.27 479.92 508.29 742.77 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.03 398.31 449.85 480.69 488.65 763.67 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.34 377.28 452.93 471.79 481.56 782.95 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.36 358.91 453.98 461.54 478.83 800.29 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.28 346.80 451.59 456.76 474.64 815.58 -------------------------------------------------------------------------------- K point *** = 0.421875 0.359375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.45 339.89 448.24 454.50 469.02 828.91 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.06 331.02 450.00 451.44 468.62 833.23 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.44 329.74 447.27 450.49 461.92 841.81 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.39 333.44 442.45 450.28 456.10 849.44 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.43 338.09 436.26 447.02 455.04 856.60 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.04 340.13 428.84 442.10 458.69 863.68 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.64 337.03 420.29 435.92 467.61 870.84 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.68 328.75 410.68 427.57 482.05 877.91 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.62 317.02 400.11 417.37 500.24 884.44 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.92 303.82 388.85 406.34 520.18 889.75 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.96 290.96 377.72 395.48 540.34 893.07 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.04 280.09 368.10 385.42 559.63 893.69 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.33 272.72 361.56 376.48 577.28 891.07 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.74 270.17 359.23 369.05 592.73 884.83 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.28 274.10 360.15 364.95 605.59 874.82 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.56 283.67 357.93 370.85 615.61 861.06 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.99 298.38 356.55 382.53 622.69 843.73 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.67 317.31 357.75 397.68 626.88 823.15 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.08 338.87 361.80 415.16 628.43 799.76 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.04 360.95 368.89 433.77 627.80 774.21 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.61 375.70 384.75 452.02 625.66 747.47 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.97 385.82 404.72 467.80 622.53 721.33 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.22 396.19 422.48 478.57 617.33 699.70 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.36 406.50 437.19 482.43 605.55 689.39 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.26 416.37 447.79 479.94 584.75 693.61 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.71 425.43 450.40 476.19 559.25 707.44 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.50 433.13 440.53 477.65 533.56 725.60 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.40 421.71 440.70 481.00 510.34 745.04 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.20 400.64 446.10 483.05 491.09 764.07 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.75 379.24 450.12 475.02 484.28 781.75 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.89 359.88 452.63 463.91 482.75 797.60 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.43 344.55 453.52 456.51 479.52 811.41 -------------------------------------------------------------------------------- K point *** = 0.421875 0.390625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.95 335.94 451.86 453.37 474.70 823.21 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.53 333.40 452.08 452.53 474.72 824.76 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.23 334.64 449.11 452.77 468.75 831.78 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.87 339.65 444.79 453.47 463.16 837.83 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.68 345.73 439.24 451.88 461.24 843.47 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.97 349.31 432.59 447.13 465.13 849.21 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.09 347.54 425.00 440.44 474.62 855.32 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.46 340.08 416.66 431.10 489.67 861.79 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.50 328.55 407.78 418.99 508.61 868.22 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.64 314.99 398.60 404.94 529.40 873.94 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.26 301.19 389.40 390.34 550.48 878.17 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.66 288.78 376.91 380.49 570.72 880.12 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.01 279.28 366.37 372.21 589.28 879.15 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.28 274.10 360.15 364.95 605.59 874.82 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.29 274.29 359.12 359.12 619.20 866.89 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.65 280.38 355.20 363.51 629.80 855.33 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.83 292.14 353.64 372.89 637.21 840.30 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.25 308.65 354.81 386.44 641.37 822.11 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.51 328.49 358.81 403.10 642.33 801.28 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.49 350.02 365.34 421.66 640.28 778.56 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.34 371.67 373.82 440.67 635.44 755.10 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.22 383.53 392.17 458.24 627.79 732.88 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.22 393.82 410.58 472.04 616.64 715.10 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.31 404.16 426.19 479.87 600.66 705.71 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.33 414.13 437.95 481.14 579.75 706.57 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.07 423.40 443.24 478.69 556.07 715.83 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.29 431.72 437.57 478.45 532.37 730.15 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.75 422.09 438.89 481.28 510.70 746.68 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.23 402.04 444.76 484.12 492.24 763.48 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.57 381.23 449.22 477.16 485.85 779.35 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.62 362.32 452.20 465.99 485.60 793.61 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.30 347.30 453.67 458.40 483.57 805.94 -------------------------------------------------------------------------------- K point *** = 0.421875 0.421875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.59 337.48 453.62 454.11 479.84 816.26 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.03 340.05 453.46 455.03 479.74 814.64 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.27 340.43 451.72 454.74 474.67 820.15 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.63 346.59 447.39 456.65 469.48 824.63 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.89 354.43 441.63 457.27 466.91 828.69 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.47 360.23 434.64 453.97 470.74 832.92 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.72 360.66 426.54 448.48 480.46 837.74 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.06 354.82 417.46 440.68 495.76 843.26 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.89 344.22 407.55 430.21 515.14 849.22 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.66 330.92 396.95 417.65 536.54 855.01 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.76 316.72 385.85 404.28 558.33 859.84 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.49 303.16 374.78 391.51 579.31 862.90 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.08 291.70 364.92 380.26 598.62 863.48 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.56 283.67 357.93 370.85 615.61 861.06 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.65 280.38 355.20 363.51 629.80 855.33 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.73 283.89 356.59 359.41 640.81 846.22 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.88 291.77 355.39 365.64 648.38 833.85 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.74 304.33 355.95 377.57 652.31 818.54 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.49 320.91 359.51 393.11 652.52 800.84 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.05 340.02 365.80 411.02 648.96 781.58 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.61 360.07 374.27 429.93 641.59 761.95 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.38 379.28 384.58 448.15 630.34 743.69 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.47 393.27 399.33 463.65 615.13 729.04 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.81 404.14 414.99 474.38 596.18 720.27 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.26 414.40 427.49 479.11 574.45 718.72 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.56 423.92 434.56 479.07 551.57 724.02 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.45 431.08 433.93 478.62 529.35 734.39 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.67 419.99 440.32 480.73 509.19 747.61 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.97 401.91 446.46 483.84 491.81 761.78 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.13 382.30 451.21 477.54 486.20 775.55 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.97 364.34 454.46 466.60 487.08 788.04 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.27 350.31 456.11 459.14 486.25 798.78 -------------------------------------------------------------------------------- K point *** = 0.421875 0.453125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.29 343.33 454.77 456.42 483.74 807.62 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.52 352.87 452.96 460.89 483.23 802.58 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.60 350.91 453.72 458.63 479.22 806.61 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.83 354.84 451.38 459.53 474.62 809.57 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.13 363.64 445.42 462.30 471.47 812.06 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.94 371.69 437.74 460.90 475.02 814.72 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.11 374.81 428.74 456.78 485.04 818.08 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.15 371.24 418.64 450.99 500.42 822.41 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.52 362.14 407.65 442.77 519.98 827.60 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.68 349.62 396.06 432.09 541.74 833.15 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.04 335.53 384.30 419.69 563.98 838.31 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.93 321.41 373.08 406.65 585.46 842.27 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.57 308.59 363.42 393.99 605.26 844.26 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.99 298.38 356.55 382.53 622.69 843.73 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.83 292.14 353.64 372.89 637.21 840.30 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.88 291.77 355.39 365.64 648.38 833.85 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.69 296.83 360.20 362.95 655.83 824.47 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.36 305.70 359.67 373.17 659.29 812.49 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.95 318.20 361.97 387.49 658.53 798.44 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.68 333.82 367.47 404.25 653.41 783.12 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.48 351.41 375.50 422.19 643.88 767.57 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.56 369.64 385.25 439.86 630.07 753.04 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.08 387.21 395.95 455.59 612.41 740.97 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.02 402.94 407.02 467.63 591.72 732.78 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.20 415.85 417.75 474.68 569.25 729.55 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.38 424.98 426.87 477.02 546.56 731.59 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.25 425.35 436.10 477.46 525.19 738.20 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.47 416.28 444.18 479.24 506.20 747.89 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.72 400.59 450.89 482.26 489.96 759.07 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.65 382.85 456.06 476.27 485.34 770.36 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.49 367.05 459.41 466.00 487.07 780.80 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.39 358.30 457.69 462.32 487.34 789.79 -------------------------------------------------------------------------------- K point *** = 0.421875 0.484375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.93 355.48 453.95 462.27 486.03 797.06 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.58 370.34 450.93 470.24 484.99 788.50 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.23 368.11 452.64 467.52 482.15 791.03 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.58 368.23 454.22 465.35 478.39 792.51 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.97 374.52 450.52 467.78 474.83 793.47 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.07 383.49 442.70 467.89 478.08 794.56 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.38 389.16 432.86 464.53 488.77 796.38 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.07 388.26 421.75 460.50 504.22 799.35 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.80 381.10 409.87 454.65 523.69 803.53 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.13 369.74 397.64 446.25 545.46 808.57 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.50 356.23 385.50 435.50 567.81 813.83 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.26 342.17 374.14 423.17 589.43 818.49 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.63 328.83 364.51 410.24 609.37 821.81 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.67 317.31 357.75 397.68 626.88 823.15 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.25 308.65 354.81 386.44 641.37 822.11 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.74 304.33 355.95 377.57 652.31 818.54 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.36 305.70 359.67 373.17 659.29 812.49 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.90 311.94 361.51 377.78 661.94 804.23 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.14 321.55 363.05 389.49 660.01 794.24 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.68 333.82 367.47 404.25 653.41 783.12 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.94 348.26 374.90 420.30 642.24 771.60 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.71 364.16 384.52 436.25 626.90 760.47 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.02 380.53 395.30 450.73 608.08 750.64 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.88 396.23 406.34 462.35 586.74 743.10 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.13 409.71 417.23 470.00 564.12 738.79 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.49 418.26 428.39 473.63 541.68 738.31 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.59 419.58 439.24 475.04 520.89 741.55 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.97 412.67 448.73 476.90 502.74 747.72 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.02 399.65 456.47 479.79 487.57 755.62 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.50 385.39 461.83 475.09 483.34 764.07 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.31 376.21 460.97 470.22 485.62 772.10 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.29 373.58 455.21 471.31 486.78 779.05 -------------------------------------------------------------------------------- K point *** = 0.421875 0.515625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.15 372.27 451.59 471.59 486.57 784.55 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.28 390.81 447.39 482.74 485.55 772.50 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.96 388.69 449.77 479.71 484.22 773.45 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.00 387.02 453.43 476.23 481.66 773.44 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.72 389.00 454.37 475.62 478.40 772.92 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.42 395.96 448.75 474.34 482.22 772.47 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.89 402.94 438.91 471.23 493.34 772.75 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.53 404.79 427.03 468.56 508.60 774.26 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.65 400.01 414.43 465.08 527.52 777.25 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.03 389.87 402.12 459.35 548.73 781.56 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.21 376.96 390.19 450.90 570.62 786.70 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.60 363.55 378.73 440.13 591.84 791.93 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.49 350.73 368.77 427.88 611.38 796.50 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.08 338.87 361.80 415.16 628.43 799.76 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.51 328.49 358.81 403.10 642.33 801.28 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.49 320.91 359.51 393.11 652.52 800.84 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.95 318.20 361.97 387.49 658.53 798.44 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.14 321.55 363.05 389.49 660.01 794.24 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.18 329.49 363.28 398.48 656.80 788.51 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.05 340.02 365.80 411.02 648.96 781.58 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.68 351.99 371.92 424.94 636.79 773.84 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.67 365.05 381.17 438.77 620.86 765.76 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.68 379.09 392.16 451.27 601.90 757.96 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.53 393.51 403.57 461.30 580.87 751.22 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.96 406.61 414.98 468.07 558.89 746.39 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.63 415.12 427.24 471.57 537.31 744.09 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.02 416.95 439.61 473.19 517.56 744.54 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.33 411.78 450.55 475.04 500.70 747.40 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.13 402.21 458.77 477.84 487.53 751.91 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.61 394.17 461.33 479.87 481.52 757.18 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.71 391.69 456.67 480.96 483.57 762.40 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.40 391.94 451.05 483.49 484.88 766.92 -------------------------------------------------------------------------------- K point *** = 0.421875 0.546875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.04 391.96 447.72 484.32 485.50 770.34 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.72 412.11 442.40 482.70 500.79 755.02 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.20 410.29 445.38 481.63 499.07 754.13 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.73 407.66 450.33 479.56 496.21 752.51 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.08 406.39 454.68 477.14 493.72 750.51 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.63 409.29 453.65 475.95 494.88 748.59 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.87 415.32 445.83 475.07 502.83 747.35 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.24 419.29 434.13 474.03 516.45 747.35 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.01 417.42 421.06 472.89 533.83 749.02 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.47 405.59 412.35 470.21 553.50 752.42 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.41 391.95 402.58 464.77 573.95 757.28 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.36 379.83 390.93 456.43 593.84 762.99 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.77 369.99 378.68 445.77 612.08 768.86 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.04 360.95 368.89 433.77 627.80 774.21 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.49 350.02 365.34 421.66 640.28 778.56 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.05 340.02 365.80 411.02 648.96 781.58 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.68 333.82 367.47 404.25 653.41 783.12 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.68 333.82 367.47 404.25 653.41 783.12 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.05 340.02 365.80 411.02 648.96 781.58 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.49 350.02 365.34 421.66 640.28 778.56 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.04 360.95 368.89 433.77 627.80 774.21 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.77 369.99 378.68 445.77 612.08 768.86 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.36 379.83 390.93 456.43 593.84 762.99 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.41 391.95 402.58 464.77 573.95 757.28 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.47 405.59 412.35 470.21 553.50 752.42 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.01 417.42 421.06 472.89 533.83 749.02 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.24 419.29 434.13 474.03 516.45 747.35 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.87 415.32 445.83 475.07 502.83 747.35 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.63 409.29 453.65 475.95 494.88 748.59 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.08 406.39 454.68 477.14 493.72 750.51 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.73 407.66 450.33 479.56 496.21 752.51 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.20 410.29 445.38 481.63 499.07 754.13 -------------------------------------------------------------------------------- K point *** = 0.421875 0.578125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.72 412.11 442.40 482.70 500.79 755.02 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.04 431.29 436.17 479.59 521.60 736.84 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.13 430.12 440.06 479.04 520.99 733.64 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.59 427.21 445.87 478.00 518.81 730.12 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.08 423.97 452.18 476.33 516.28 726.51 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.75 422.95 455.55 474.82 515.84 723.14 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.99 426.04 451.74 474.97 520.43 720.45 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.21 430.58 441.86 475.67 530.91 718.95 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.17 428.87 431.98 476.56 545.61 719.18 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.94 414.92 428.26 476.99 562.55 721.50 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.73 401.47 420.48 475.26 580.20 725.95 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.34 389.84 409.96 470.34 597.28 732.19 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.43 381.07 397.76 462.32 612.72 739.60 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.61 375.70 384.75 452.02 625.66 747.47 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.34 371.67 373.82 440.67 635.44 755.10 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.61 360.07 374.27 429.93 641.59 761.95 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.48 351.41 375.50 422.19 643.88 767.57 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.94 348.26 374.90 420.30 642.24 771.60 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.68 351.99 371.92 424.94 636.79 773.84 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.04 360.95 368.89 433.77 627.80 774.21 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.90 367.42 373.30 444.27 615.65 772.81 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.16 369.82 386.10 454.70 600.85 769.90 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.93 375.71 398.82 463.81 584.06 765.93 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.87 384.96 410.24 470.66 566.15 761.47 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.44 396.80 419.21 474.79 548.30 757.08 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.93 410.15 424.34 476.39 532.03 753.25 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.30 423.63 424.47 476.32 519.09 750.24 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.94 420.34 435.61 475.25 511.04 748.03 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.40 415.98 443.65 473.98 508.38 746.40 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.90 415.61 445.37 474.67 509.83 745.03 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.42 419.33 442.34 477.04 513.37 743.59 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.94 424.56 438.40 478.90 517.28 741.83 -------------------------------------------------------------------------------- K point *** = 0.421875 0.609375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.35 429.18 435.79 479.65 520.29 739.59 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.44 428.30 444.71 477.24 545.39 719.39 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.97 431.39 448.01 475.48 546.56 713.06 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.97 436.09 448.20 474.40 545.79 706.99 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.66 438.08 449.68 473.72 543.89 701.41 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 367.12 435.79 454.59 472.62 542.72 696.50 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 371.49 435.47 455.42 472.35 544.92 692.43 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.72 438.85 448.68 473.89 552.26 689.50 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.70 437.31 442.33 475.84 564.03 688.19 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.20 424.14 441.78 478.32 577.97 689.21 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.10 411.11 436.51 480.16 591.92 693.18 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.59 399.78 427.83 479.42 604.41 700.31 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.61 391.17 416.92 475.21 614.70 710.07 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.97 385.82 404.72 467.80 622.53 721.33 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.22 383.53 392.17 458.24 627.79 732.88 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.38 379.28 384.58 448.15 630.34 743.69 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.56 369.64 385.25 439.86 630.07 753.04 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.71 364.16 384.52 436.25 626.90 760.47 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.67 365.05 381.17 438.77 620.86 765.76 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.77 369.99 378.68 445.77 612.08 768.86 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.16 369.82 386.10 454.70 600.85 769.90 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.51 369.24 398.03 463.67 587.60 769.17 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.53 371.74 410.06 471.33 573.01 767.07 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.24 377.76 420.48 476.79 558.08 764.07 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.23 386.93 427.73 479.57 544.23 760.60 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.73 398.40 430.32 479.78 533.25 757.01 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.62 410.89 427.74 477.94 526.61 753.43 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.19 421.70 422.95 474.95 524.48 749.82 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.02 417.45 431.25 472.62 525.70 746.02 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.48 417.81 434.33 473.16 528.92 741.81 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.24 422.92 432.85 475.91 533.26 737.03 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.89 428.66 431.77 478.15 538.00 731.63 -------------------------------------------------------------------------------- K point *** = 0.421875 0.640625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.16 427.72 438.60 478.52 542.34 725.68 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.14 419.59 446.29 479.19 570.33 705.04 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.93 423.15 454.33 475.58 573.77 694.45 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.15 429.34 459.56 470.76 575.25 684.56 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.40 437.18 458.41 469.11 574.74 676.06 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.48 443.43 454.84 469.57 573.44 669.23 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.17 443.40 456.62 469.02 573.77 663.91 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.16 444.33 454.30 470.07 578.25 659.77 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.21 444.68 449.15 472.25 587.46 656.86 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.12 433.18 451.63 474.85 599.25 656.10 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.53 420.93 449.44 478.66 609.64 659.69 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.21 409.99 442.89 481.73 615.41 669.49 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.43 401.55 433.55 481.94 617.24 683.84 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.22 396.19 422.48 478.57 617.33 699.70 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.22 393.82 410.58 472.04 616.64 715.10 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.47 393.27 399.33 463.65 615.13 729.04 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.08 387.21 395.95 455.59 612.41 740.97 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.02 380.53 395.30 450.73 608.08 750.64 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.68 379.09 392.16 451.27 601.90 757.96 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.36 379.83 390.93 456.43 593.84 762.99 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.93 375.71 398.82 463.81 584.06 765.93 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.53 371.74 410.06 471.33 573.01 767.07 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.47 370.53 421.01 477.59 561.51 766.76 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.25 372.80 429.49 481.62 550.85 765.37 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.79 378.58 433.62 482.93 542.76 763.20 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.50 387.30 432.26 481.52 538.71 760.42 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.30 397.89 426.23 478.03 538.72 757.03 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.54 408.55 418.63 473.71 541.50 752.91 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.87 412.14 418.39 470.57 545.65 747.85 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.52 412.51 422.45 470.78 550.34 741.64 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.60 418.17 422.23 474.24 555.28 734.16 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.33 420.16 427.01 478.16 560.42 725.40 -------------------------------------------------------------------------------- K point *** = 0.421875 0.671875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.37 418.80 436.85 480.12 565.61 715.57 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.37 410.01 438.01 481.96 593.40 697.53 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.25 413.76 447.95 480.78 598.74 682.09 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.41 420.40 456.27 476.39 603.44 666.57 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.73 429.43 462.06 470.00 606.35 652.54 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.53 439.48 460.36 467.57 606.33 642.19 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 371.37 446.87 455.90 467.77 604.16 636.43 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.01 447.00 457.65 466.77 603.94 633.29 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.20 447.76 454.74 468.20 609.13 630.52 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 364.44 441.06 457.20 469.39 619.68 627.52 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.94 430.24 459.20 472.00 621.56 636.42 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.18 419.96 454.86 477.37 616.49 653.72 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.91 411.80 447.03 481.46 610.94 671.81 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.36 406.50 437.19 482.43 605.55 689.39 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.31 404.16 426.19 479.87 600.66 705.71 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.81 404.14 414.99 474.38 596.18 720.27 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.02 402.94 407.02 467.63 591.72 732.78 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.88 396.23 406.34 462.35 586.74 743.10 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.53 393.51 403.57 461.30 580.87 751.22 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.41 391.95 402.58 464.77 573.95 757.28 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.87 384.96 410.24 470.66 566.15 761.47 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.24 377.76 420.48 476.79 558.08 764.07 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.25 372.80 429.49 481.62 550.85 765.37 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.86 371.11 434.68 484.15 546.11 765.64 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.40 373.02 434.42 483.84 545.26 765.01 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.61 378.31 428.82 480.82 548.33 763.50 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.69 386.17 419.89 475.88 553.91 760.96 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.14 395.00 410.80 470.32 560.44 757.16 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.77 400.27 407.43 466.04 566.89 751.83 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.53 401.25 410.93 465.34 572.79 744.75 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.86 406.63 411.93 468.99 578.10 735.74 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.56 409.90 416.57 474.77 583.09 724.77 -------------------------------------------------------------------------------- K point *** = 0.421875 0.703125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.25 409.04 427.18 479.72 588.11 711.94 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.35 399.85 424.59 479.49 610.93 701.12 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.13 403.66 435.67 482.44 614.36 683.97 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.98 410.53 445.29 481.81 617.96 666.13 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.97 420.14 452.48 478.20 620.37 649.61 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.79 431.51 455.63 473.68 616.56 640.22 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.71 442.84 453.37 471.01 605.37 640.41 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.14 447.04 454.00 469.05 595.21 643.57 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 375.04 445.75 457.28 467.60 589.86 647.51 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.76 445.32 456.10 468.19 589.13 652.46 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.12 438.17 461.23 467.03 590.35 659.37 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.39 429.12 462.68 469.12 590.61 668.89 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.91 421.47 456.25 475.66 588.66 680.67 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.26 416.37 447.79 479.94 584.75 693.61 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.33 414.13 437.95 481.14 579.75 706.57 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.26 414.40 427.49 479.11 574.45 718.72 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.20 415.85 417.75 474.68 569.25 729.55 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.13 409.71 417.23 470.00 564.12 738.79 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.96 406.61 414.98 468.07 558.89 746.39 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.47 405.59 412.35 470.21 553.50 752.42 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.44 396.80 419.21 474.79 548.30 757.08 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.23 386.93 427.73 479.57 544.23 760.60 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.79 378.58 433.62 482.93 542.76 763.20 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.40 373.02 434.42 483.84 545.26 765.01 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.73 370.92 429.71 481.90 551.71 766.02 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.97 372.38 420.87 477.38 560.65 766.07 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.69 376.91 410.08 471.05 570.40 764.89 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.76 383.09 400.10 464.11 579.75 762.13 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.24 386.51 396.36 458.35 587.99 757.51 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.88 386.78 399.64 456.15 594.80 750.75 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.31 391.56 401.32 459.08 600.17 741.70 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.84 398.34 402.94 465.85 604.32 730.34 -------------------------------------------------------------------------------- K point *** = 0.421875 0.734375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.04 398.74 412.98 473.47 607.72 716.73 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.25 389.47 407.82 470.12 621.79 716.45 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.73 393.26 419.91 477.12 618.55 702.73 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.01 400.24 430.91 480.92 613.26 689.94 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.32 410.19 439.94 481.17 605.28 679.94 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.66 422.28 445.86 478.70 594.30 674.07 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.78 435.15 447.21 475.54 581.55 672.24 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.89 444.00 447.00 473.18 569.62 673.31 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.26 440.35 454.93 471.17 561.27 676.23 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 370.48 440.07 455.70 470.76 557.85 680.40 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.71 441.15 452.46 471.54 558.22 685.65 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.61 436.53 453.83 471.78 559.82 691.99 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.26 430.10 454.43 473.13 560.50 699.34 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.71 425.43 450.40 476.19 559.25 707.44 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.07 423.40 443.24 478.69 556.07 715.83 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.56 423.92 434.56 479.07 551.57 724.02 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.38 424.98 426.87 477.02 546.56 731.59 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.49 418.26 428.39 473.63 541.68 738.31 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.63 415.12 427.24 471.57 537.31 744.09 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.01 417.42 421.06 472.89 533.83 749.02 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.93 410.15 424.34 476.39 532.03 753.25 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.73 398.40 430.32 479.78 533.25 757.01 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.50 387.30 432.26 481.52 538.71 760.42 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.61 378.31 428.82 480.82 548.33 763.50 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.97 372.38 420.87 477.38 560.65 766.07 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.07 369.96 410.07 471.44 573.90 767.82 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.93 370.90 398.21 463.70 586.71 768.35 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.96 373.89 387.71 455.29 598.18 767.23 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.66 373.54 384.81 447.88 607.74 764.14 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.80 371.39 388.44 443.80 615.08 758.84 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.18 374.84 390.48 445.25 620.07 751.25 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.40 383.12 390.33 451.91 622.73 741.43 -------------------------------------------------------------------------------- K point *** = 0.421875 0.765625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.94 388.24 395.79 461.09 623.22 729.65 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.18 379.31 388.46 455.18 628.50 738.95 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.12 382.98 401.34 465.16 619.20 729.38 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.57 390.01 413.59 472.91 607.15 720.35 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.90 400.19 424.33 477.50 592.94 712.74 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.35 412.73 432.62 478.74 577.39 707.28 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.06 426.38 437.17 477.58 561.58 704.34 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.84 436.74 439.68 475.85 547.03 703.81 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 367.74 432.87 450.33 474.46 535.74 705.26 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.94 429.70 455.63 473.58 529.65 708.13 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.25 430.45 453.38 474.50 528.77 711.93 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.54 433.55 447.33 475.91 530.69 716.28 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.73 435.07 442.47 476.83 532.81 720.91 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.50 433.13 440.53 477.65 533.56 725.60 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.29 431.72 437.57 478.45 532.37 730.15 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.45 431.08 433.93 478.62 529.35 734.39 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.25 425.35 436.10 477.46 525.19 738.20 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.59 419.58 439.24 475.04 520.89 741.55 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.02 416.95 439.61 473.19 517.56 744.54 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.24 419.29 434.13 474.03 516.45 747.35 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.30 423.63 424.47 476.32 519.09 750.24 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.62 410.89 427.74 477.94 526.61 753.43 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.30 397.89 426.23 478.03 538.72 757.03 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.69 386.17 419.89 475.88 553.91 760.96 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.69 376.91 410.08 471.05 570.40 764.89 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.93 370.90 398.21 463.70 586.71 768.35 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.79 368.38 385.62 454.53 601.75 770.81 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.20 368.05 374.68 444.63 614.75 771.80 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.34 361.71 374.33 435.54 625.15 770.97 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.41 356.39 378.09 429.44 632.56 768.12 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.55 357.52 380.21 428.95 636.70 763.24 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.34 364.78 379.74 434.71 637.41 756.50 -------------------------------------------------------------------------------- K point *** = 0.421875 0.796875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.05 375.63 378.84 444.37 634.65 748.22 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.08 366.44 370.73 437.11 632.98 763.97 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.24 372.69 381.30 448.85 619.96 757.68 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.59 380.10 394.15 459.37 604.04 751.04 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.67 390.60 406.17 467.59 586.02 744.68 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.94 403.44 416.34 472.79 566.91 739.29 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.83 417.50 423.48 475.01 547.91 735.47 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.55 426.05 431.52 475.35 530.44 733.56 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.86 423.47 443.95 475.39 516.06 733.50 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.58 418.19 452.85 475.46 506.71 734.93 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.06 415.16 455.21 476.04 503.80 737.31 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.83 416.31 451.13 478.03 505.42 740.08 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.07 419.31 445.27 479.92 508.29 742.77 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.40 421.71 440.70 481.00 510.34 745.04 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.75 422.09 438.89 481.28 510.70 746.68 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.67 419.99 440.32 480.73 509.19 747.61 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.47 416.28 444.18 479.24 506.20 747.89 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.97 412.67 448.73 476.90 502.74 747.72 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.33 411.78 450.55 475.04 500.70 747.40 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.87 415.32 445.83 475.07 502.83 747.35 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.94 420.34 435.61 475.25 511.04 748.03 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.19 421.70 422.95 474.95 524.48 749.82 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.54 408.55 418.63 473.71 541.50 752.91 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.14 395.00 410.80 470.32 560.44 757.16 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.76 383.09 400.10 464.11 579.75 762.13 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.96 373.89 387.71 455.29 598.18 767.23 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.20 368.05 374.68 444.63 614.75 771.80 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.80 361.37 366.40 433.21 628.69 775.31 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.66 350.31 367.19 422.45 639.40 777.36 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.79 342.58 369.75 414.36 646.39 777.78 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.34 340.76 371.37 411.77 649.32 776.53 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.63 345.65 370.57 416.18 648.00 773.69 -------------------------------------------------------------------------------- K point *** = 0.421875 0.828125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.36 355.23 369.29 425.57 642.48 769.42 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.82 344.47 362.80 418.20 635.45 788.85 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.92 355.66 368.18 430.68 620.45 785.22 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.94 367.01 377.71 442.84 602.58 780.41 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.58 379.21 389.19 453.58 582.59 774.98 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.51 392.41 400.57 462.00 561.43 769.64 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.35 404.70 411.51 467.61 540.28 765.12 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.55 411.57 423.93 470.71 520.64 761.98 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.31 411.59 436.62 472.65 504.00 760.45 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.34 406.10 447.44 474.74 491.50 760.38 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.29 399.45 454.15 476.38 485.10 761.29 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.99 396.88 454.05 477.81 485.81 762.59 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.03 398.31 449.85 480.69 488.65 763.67 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.20 400.64 446.10 483.05 491.09 764.07 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.23 402.04 444.76 484.12 492.24 763.48 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.97 401.91 446.46 483.84 491.81 761.78 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.72 400.59 450.89 482.26 489.96 759.07 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.02 399.65 456.47 479.79 487.57 755.62 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.13 402.21 458.77 477.84 487.53 751.91 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.63 409.29 453.65 475.95 494.88 748.59 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.40 415.98 443.65 473.98 508.38 746.40 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.02 417.45 431.25 472.62 525.70 746.02 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.87 412.14 418.39 470.57 545.65 747.85 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.77 400.27 407.43 466.04 566.89 751.83 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.24 386.51 396.36 458.35 587.99 757.51 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.66 373.54 384.81 447.88 607.74 764.14 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.34 361.71 374.33 435.54 625.15 770.97 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.66 350.31 367.19 422.45 639.40 777.36 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.96 339.37 364.29 409.96 649.83 782.86 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.21 330.42 364.45 399.89 655.94 787.15 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.39 325.72 364.90 395.13 657.48 790.03 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.06 327.26 363.36 398.03 654.42 791.33 -------------------------------------------------------------------------------- K point *** = 0.421875 0.859375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.72 334.31 361.71 406.69 646.95 790.93 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.22 322.72 357.43 400.13 635.52 812.16 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.06 333.57 362.37 412.52 619.63 810.86 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.59 346.21 370.76 425.37 600.95 807.68 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.75 359.87 381.46 437.67 580.18 803.14 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.34 373.54 393.34 448.44 558.17 797.95 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.07 385.73 405.67 456.88 536.09 792.90 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.50 394.39 418.04 462.69 515.43 788.69 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.09 397.30 430.04 466.49 497.93 785.75 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.09 393.47 440.94 469.71 484.65 784.15 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.24 385.27 449.77 472.79 475.97 783.54 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.09 378.42 454.37 470.23 477.97 783.36 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.34 377.28 452.93 471.79 481.56 782.95 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.75 379.24 450.12 475.02 484.28 781.75 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.57 381.23 449.22 477.16 485.85 779.35 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.13 382.30 451.21 477.54 486.20 775.55 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.65 382.85 456.06 476.27 485.34 770.36 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.50 385.39 461.83 475.09 483.34 764.07 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.61 394.17 461.33 479.87 481.52 757.18 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.08 406.39 454.68 477.14 493.72 750.51 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.90 415.61 445.37 474.67 509.83 745.03 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.48 417.81 434.33 473.16 528.92 741.81 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.52 412.51 422.45 470.78 550.34 741.64 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.53 401.25 410.93 465.34 572.79 744.75 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.88 386.78 399.64 456.15 594.80 750.75 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.80 371.39 388.44 443.80 615.08 758.84 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.41 356.39 378.09 429.44 632.56 768.12 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.79 342.58 369.75 414.36 646.39 777.78 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.21 330.42 364.45 399.89 655.94 787.15 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.17 320.36 362.35 387.61 660.87 795.65 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.85 313.35 361.52 380.38 661.08 802.78 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.40 311.10 358.82 381.67 656.70 808.08 -------------------------------------------------------------------------------- K point *** = 0.421875 0.890625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.93 314.67 356.48 389.33 648.05 811.25 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.29 303.12 354.80 384.23 632.82 833.04 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.75 312.54 359.78 395.66 616.71 833.93 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.85 324.77 368.14 408.29 597.91 832.33 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.66 338.60 378.74 421.27 577.05 828.75 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.07 352.79 390.49 433.63 554.93 823.86 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.78 365.91 402.53 444.35 532.66 818.48 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.43 376.26 414.28 452.68 511.74 813.39 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.53 381.72 425.35 458.53 494.05 809.17 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.60 380.54 435.43 462.68 481.15 806.06 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.02 373.41 444.18 465.38 473.80 803.89 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.78 364.22 451.04 463.17 474.66 802.18 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.36 358.91 453.98 461.54 478.83 800.29 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.89 359.88 452.63 463.91 482.75 797.60 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.62 362.32 452.20 465.99 485.60 793.61 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.97 364.34 454.46 466.60 487.08 788.04 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.49 367.05 459.41 466.00 487.07 780.80 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.31 376.21 460.97 470.22 485.62 772.10 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.71 391.69 456.67 480.96 483.57 762.40 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.73 407.66 450.33 479.56 496.21 752.51 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.42 419.33 442.34 477.04 513.37 743.59 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.24 422.92 432.85 475.91 533.26 737.03 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.60 418.17 422.23 474.24 555.28 734.16 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.86 406.63 411.93 468.99 578.10 735.74 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.31 391.56 401.32 459.08 600.17 741.70 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.18 374.84 390.48 445.25 620.07 751.25 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.55 357.52 380.21 428.95 636.70 763.24 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.34 340.76 371.37 411.77 649.32 776.53 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.39 325.72 364.90 395.13 657.48 790.03 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.85 313.35 361.52 380.38 661.08 802.78 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.41 304.12 360.79 369.43 660.16 813.97 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.70 298.51 357.44 368.35 654.94 822.98 -------------------------------------------------------------------------------- K point *** = 0.421875 0.921875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.93 297.93 354.05 374.78 645.71 829.40 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.32 287.34 354.95 371.62 627.10 850.93 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.47 294.58 359.99 381.23 611.23 853.93 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.39 305.47 368.50 392.63 592.73 853.96 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.16 318.72 379.09 405.31 572.21 851.47 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.64 332.97 390.50 418.46 550.42 847.08 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.56 346.76 401.87 430.92 528.41 841.61 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.54 358.45 412.71 441.53 507.61 835.87 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.18 366.05 422.77 449.59 489.94 830.54 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.02 367.60 431.85 455.27 477.26 826.01 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.63 362.89 439.80 459.12 470.32 822.28 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.59 354.60 446.47 459.27 470.22 819.00 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.28 346.80 451.59 456.76 474.64 815.58 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.43 344.55 453.52 456.51 479.52 811.41 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.30 347.30 453.67 458.40 483.57 805.94 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.27 350.31 456.11 459.14 486.25 798.78 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.39 358.30 457.69 462.32 487.34 789.79 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.29 373.58 455.21 471.31 486.78 779.05 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.40 391.94 451.05 483.49 484.88 766.92 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.20 410.29 445.38 481.63 499.07 754.13 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.94 424.56 438.40 478.90 517.28 741.83 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.89 428.66 431.77 478.15 538.00 731.63 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.33 420.16 427.01 478.16 560.42 725.40 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.56 409.90 416.57 474.77 583.09 724.77 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.84 398.34 402.94 465.85 604.32 730.34 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.40 383.12 390.33 451.91 622.73 741.43 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.34 364.78 379.74 434.71 637.41 756.50 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.63 345.65 370.57 416.18 648.00 773.69 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.06 327.26 363.36 398.03 654.42 791.33 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.40 311.10 358.82 381.67 656.70 808.08 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.70 298.51 357.44 368.35 654.94 822.98 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.79 290.05 358.63 359.74 649.28 835.34 -------------------------------------------------------------------------------- K point *** = 0.421875 0.953125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.91 285.60 354.47 364.21 639.91 844.73 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.83 276.72 357.49 363.44 618.30 865.42 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.03 280.99 362.22 370.66 602.95 870.51 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.10 289.73 371.03 379.64 585.06 872.24 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.10 301.69 381.98 390.62 565.17 870.99 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.90 315.44 392.87 403.74 544.00 867.35 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.27 329.44 403.07 417.57 522.54 862.06 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.84 342.00 412.67 430.17 502.14 855.95 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.21 351.20 421.64 440.30 484.68 849.75 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.94 355.06 429.84 447.66 472.16 843.97 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.64 352.86 437.10 452.85 465.42 838.75 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.92 346.60 443.28 455.35 464.61 833.89 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.45 339.89 448.24 454.50 469.02 828.91 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.95 335.94 451.86 453.37 474.70 823.21 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.59 337.48 453.62 454.11 479.84 816.26 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.29 343.33 454.77 456.42 483.74 807.62 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.93 355.48 453.95 462.27 486.03 797.06 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.15 372.27 451.59 471.59 486.57 784.55 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.04 391.96 447.72 484.32 485.50 770.34 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.72 412.11 442.40 482.70 500.79 755.02 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.35 429.18 435.79 479.65 520.29 739.59 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.16 427.72 438.60 478.52 542.34 725.68 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.37 418.80 436.85 480.12 565.61 715.57 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.25 409.04 427.18 479.72 588.11 711.94 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.04 398.74 412.98 473.47 607.72 716.73 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.94 388.24 395.79 461.09 623.22 729.65 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.05 375.63 378.84 444.37 634.65 748.22 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.36 355.23 369.29 425.57 642.48 769.42 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.72 334.31 361.71 406.69 646.95 790.93 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.93 314.67 356.48 389.33 648.05 811.25 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.93 297.93 354.05 374.78 645.71 829.40 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.91 285.60 354.47 364.21 639.91 844.73 -------------------------------------------------------------------------------- K point *** = 0.421875 0.984375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.55 278.54 356.81 359.21 630.71 856.81 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.87 281.05 354.92 358.18 641.76 847.67 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.52 283.18 357.53 364.04 628.86 853.91 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.68 290.18 364.70 372.21 612.86 856.91 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.58 301.01 374.71 382.89 594.22 856.90 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.23 314.39 385.27 396.37 573.54 854.33 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.51 328.90 395.54 411.35 551.57 849.86 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.14 343.05 405.50 425.83 529.35 844.29 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.78 355.18 415.04 438.20 508.33 838.47 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.03 363.31 423.98 447.62 490.43 833.12 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.47 365.46 432.12 454.17 477.60 828.62 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.72 361.25 439.28 458.50 470.65 825.00 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.42 353.19 445.32 459.22 470.37 821.87 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.28 345.07 450.08 456.96 474.74 818.63 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.03 340.05 453.46 455.03 479.74 814.64 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.83 340.74 454.88 455.41 483.92 809.31 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.74 345.80 455.77 457.48 486.73 802.26 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.54 357.22 454.62 463.22 487.89 793.32 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.94 373.23 451.92 472.28 487.36 782.55 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.04 391.96 447.72 484.32 485.50 770.34 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.99 410.61 442.08 482.17 499.82 757.42 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.97 425.10 435.13 479.46 517.84 744.96 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.22 426.86 430.91 478.79 538.43 734.59 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.01 417.76 426.71 478.73 560.85 728.23 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.60 407.85 415.90 474.98 583.65 727.51 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.27 397.38 401.17 465.46 605.12 733.01 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.22 383.24 387.36 450.82 623.81 744.07 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.59 364.17 377.19 432.93 638.79 759.11 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.37 344.32 368.09 413.86 649.62 776.30 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.42 325.04 360.67 395.44 656.21 793.98 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.50 307.80 355.61 379.20 658.60 810.80 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.47 294.12 353.40 366.45 656.87 825.78 -------------------------------------------------------------------------------- K point *** = 0.453125 0.015625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.42 285.32 354.09 358.37 651.19 838.22 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.52 283.18 357.53 364.04 628.86 853.91 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.41 281.24 355.58 370.40 616.54 862.46 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.64 285.79 358.33 378.92 601.31 867.53 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.64 294.75 365.18 389.11 583.56 869.29 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.67 306.68 374.91 400.53 563.83 868.10 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.63 320.21 386.12 412.58 542.83 864.56 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.25 333.86 397.66 424.40 521.57 859.39 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.15 345.96 408.80 434.93 501.41 853.38 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.91 354.59 419.16 443.33 484.23 847.24 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.06 357.78 428.53 449.46 471.95 841.46 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.14 354.96 436.75 453.96 465.26 836.17 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.70 348.36 443.69 455.88 464.57 831.17 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.10 341.87 449.11 454.63 469.10 826.02 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.27 340.43 451.72 454.74 474.67 820.15 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.08 343.92 452.41 456.84 479.65 813.02 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.77 347.84 454.99 457.99 483.38 804.25 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.66 356.66 456.80 461.46 485.55 793.61 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.45 372.67 454.77 470.66 486.01 781.08 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.40 391.94 451.05 483.49 484.88 766.92 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.97 411.70 445.81 482.14 500.03 751.69 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.40 428.25 439.44 479.09 519.69 736.41 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.93 430.22 438.72 477.87 541.87 722.67 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.82 421.47 436.87 479.39 565.19 712.72 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.35 411.54 427.44 479.18 587.60 709.22 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.76 400.90 413.64 473.38 606.97 714.13 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.26 389.58 397.40 461.62 622.14 727.16 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.94 375.05 382.67 445.53 633.24 745.80 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.76 355.87 372.51 427.26 640.83 766.98 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.54 335.98 364.92 408.69 645.13 788.43 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.07 317.46 360.03 391.33 646.15 808.65 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.38 301.91 358.17 376.44 643.78 826.69 -------------------------------------------------------------------------------- K point *** = 0.453125 0.046875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.10 290.43 359.22 365.26 638.00 841.91 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.68 290.18 364.70 372.21 612.86 856.91 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.64 285.79 358.33 378.92 601.31 867.53 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.00 288.00 356.54 387.45 587.02 874.55 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.81 295.29 359.25 397.25 570.35 878.09 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.88 305.86 365.85 407.77 551.77 878.45 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.27 318.26 375.33 418.34 531.97 876.10 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.75 331.06 386.51 428.23 511.92 871.69 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.91 342.62 398.36 436.71 492.99 865.91 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.27 351.04 410.07 443.21 477.06 859.44 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.23 354.42 421.06 447.85 465.99 852.77 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.14 352.32 430.90 451.77 459.97 846.12 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.06 347.29 439.18 455.00 458.50 839.44 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.14 344.24 445.05 454.78 463.49 832.42 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.63 346.59 447.39 456.65 469.48 824.63 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.14 351.40 448.50 459.67 474.92 815.63 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.62 356.32 451.19 461.86 479.24 805.04 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.00 362.17 456.12 463.24 482.16 792.65 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.37 373.82 458.89 468.68 483.49 778.38 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.71 391.69 456.67 480.96 483.57 762.40 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.41 411.29 452.29 481.03 498.86 745.10 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.43 428.87 446.69 477.95 520.06 727.29 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.19 435.39 445.20 475.46 544.17 710.31 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.04 427.91 445.83 476.94 569.23 696.48 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.28 418.13 438.09 479.79 592.07 689.49 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.16 407.43 425.48 478.24 608.81 693.73 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.87 396.15 410.03 470.42 618.49 709.70 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.49 383.82 393.71 457.25 624.19 732.47 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.93 367.76 380.83 440.79 627.98 757.38 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.03 348.77 372.55 422.98 630.04 781.94 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.76 330.08 367.70 405.35 629.90 804.84 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.50 313.43 366.17 389.09 627.14 825.28 -------------------------------------------------------------------------------- K point *** = 0.453125 0.078125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.17 299.87 367.79 375.23 621.49 842.76 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.58 301.01 374.71 382.89 594.22 856.90 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.64 294.75 365.18 389.11 583.56 869.29 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.81 295.29 359.25 397.25 570.35 878.09 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.96 301.50 357.59 406.47 554.88 883.39 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.34 311.28 360.20 416.08 537.62 885.39 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.37 322.96 366.56 425.39 519.23 884.49 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.99 335.06 375.79 433.69 500.71 881.18 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.82 345.96 386.82 440.30 483.52 876.09 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.28 353.72 398.69 444.76 469.74 869.77 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.65 356.53 410.57 447.33 461.23 862.70 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.94 354.45 421.72 449.86 457.34 855.12 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.65 350.78 431.36 453.13 456.63 847.06 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.00 350.28 438.33 454.31 461.14 838.35 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.89 354.43 441.63 457.27 466.91 828.69 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.19 360.70 443.26 461.75 472.09 817.76 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.22 367.20 445.93 465.87 476.16 805.27 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.81 373.61 450.89 469.04 478.94 791.03 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.24 381.52 457.60 472.30 480.41 774.97 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.61 394.17 461.33 479.87 481.52 757.18 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.61 410.97 459.72 479.06 497.58 737.97 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.19 427.93 455.43 476.32 519.66 717.91 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.61 439.56 451.74 472.79 545.42 698.02 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.54 436.43 453.17 472.17 572.62 680.25 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.43 427.42 447.33 476.80 597.12 668.94 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.61 416.94 436.06 479.29 610.81 672.82 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.29 405.78 421.80 475.98 612.59 693.37 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.56 394.12 405.93 466.71 611.79 720.34 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.36 380.37 391.70 453.09 611.66 748.19 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.64 362.95 382.59 437.05 611.62 774.95 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.63 344.63 377.64 420.19 610.54 799.70 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.03 327.44 376.13 403.67 607.58 821.86 -------------------------------------------------------------------------------- K point *** = 0.453125 0.109375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.81 312.52 377.59 388.64 602.22 841.03 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.23 314.39 385.27 396.37 573.54 854.33 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.67 306.68 374.91 400.53 563.83 868.10 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 271.88 305.86 365.85 407.77 551.77 878.45 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.34 311.28 360.20 416.08 537.62 885.39 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.59 320.70 358.57 424.58 521.82 889.08 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.54 332.09 361.03 432.50 505.10 889.79 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.42 343.75 367.16 439.09 488.56 887.92 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.02 353.89 376.12 443.59 474.02 883.94 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.78 360.36 386.96 445.42 464.01 878.28 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.89 361.43 398.79 445.79 459.52 871.34 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.18 358.06 410.65 447.40 458.38 863.34 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.96 354.43 421.51 449.23 460.25 854.34 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.71 354.86 429.97 450.55 465.09 844.25 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.47 360.23 434.64 453.97 470.74 832.92 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.50 368.22 436.80 459.54 475.78 820.13 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.92 376.84 439.33 465.38 479.62 805.70 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.90 385.16 443.90 470.60 482.11 789.51 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.96 393.24 450.91 475.09 483.68 771.55 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.13 402.21 458.77 477.84 487.53 751.91 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.98 413.69 463.38 477.03 499.93 730.82 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 372.48 427.26 463.01 474.37 520.68 708.72 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 370.92 440.10 459.66 470.66 546.74 686.32 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.63 444.90 458.78 466.94 575.44 664.97 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.50 438.41 454.72 471.11 602.53 648.53 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.07 428.69 444.77 476.71 611.60 653.80 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.70 417.92 431.95 477.69 603.43 680.68 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.55 406.73 417.18 472.88 596.39 710.74 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.68 394.11 403.12 462.98 592.65 740.22 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.24 377.77 393.88 449.70 590.73 768.11 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.71 359.97 388.80 434.62 588.86 793.83 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.99 342.69 387.00 419.03 585.81 816.98 -------------------------------------------------------------------------------- K point *** = 0.453125 0.140625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.04 327.06 387.65 404.31 580.82 837.23 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.51 328.90 395.54 411.35 551.57 849.86 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.63 320.21 386.12 412.58 542.83 864.56 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.27 318.26 375.33 418.34 531.97 876.10 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.37 322.96 366.56 425.39 519.23 884.49 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 264.54 332.09 361.03 432.50 505.10 889.79 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.10 343.30 359.34 438.76 490.43 892.21 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.66 354.37 361.64 443.24 476.72 892.01 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.27 363.00 367.56 444.97 466.47 889.49 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.56 366.77 376.20 444.44 461.64 884.97 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.76 364.37 386.97 444.88 460.64 878.70 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.69 358.54 398.76 446.10 462.56 870.82 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.64 353.97 410.39 445.98 467.64 861.40 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.08 354.46 420.31 445.81 474.15 850.40 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.72 360.66 426.54 448.48 480.46 837.74 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.36 370.32 429.27 454.49 485.84 823.31 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.04 381.28 431.57 461.38 490.07 807.05 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.07 392.25 435.52 467.51 493.30 788.93 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.47 402.52 441.96 472.22 496.25 769.00 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.33 411.78 450.55 475.04 500.70 747.40 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.27 420.46 459.02 475.43 509.95 724.37 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 377.08 429.60 464.29 473.24 526.85 700.29 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 379.78 439.61 465.52 469.06 550.65 675.73 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 377.97 448.71 463.29 464.49 578.77 651.52 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 372.84 449.11 458.68 465.63 608.11 629.71 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.39 441.22 450.63 472.08 606.11 642.77 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.29 431.31 439.69 476.04 590.07 673.88 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.94 420.77 426.41 475.34 578.65 704.70 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.61 408.29 413.79 469.60 571.97 734.33 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.69 392.02 405.56 459.81 568.37 762.24 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.89 374.78 400.42 447.41 565.81 788.04 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.24 357.84 398.08 433.73 562.72 811.41 -------------------------------------------------------------------------------- K point *** = 0.453125 0.171875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.69 342.12 397.75 420.27 558.14 832.09 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.14 343.05 405.50 425.83 529.35 844.29 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.25 333.86 397.66 424.40 521.57 859.39 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.75 331.06 386.51 428.23 511.92 871.69 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.99 335.06 375.79 433.69 500.71 881.18 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 267.42 343.75 367.16 439.09 488.56 887.92 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.66 354.37 361.64 443.24 476.72 892.01 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.67 359.80 364.10 444.93 467.43 893.58 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.83 361.85 369.64 444.24 462.94 892.79 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.03 367.44 368.61 444.28 462.43 889.77 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.71 361.88 376.20 445.09 465.36 884.64 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.80 353.72 386.92 444.02 471.97 877.43 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.68 348.11 398.56 441.46 480.31 868.15 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.69 348.27 409.57 439.41 488.55 856.77 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.06 354.82 417.46 440.68 495.76 843.26 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.15 365.68 420.86 446.93 501.59 827.61 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.93 378.54 422.80 455.34 506.04 809.81 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.79 392.00 426.00 463.23 509.51 789.94 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.97 405.13 431.53 469.41 512.84 768.12 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.02 416.95 439.61 473.19 517.56 744.54 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.33 426.73 449.26 474.27 525.82 719.50 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.35 434.71 457.87 472.94 539.71 693.39 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 381.67 441.82 462.99 470.01 559.85 666.77 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 384.29 448.71 462.80 467.47 584.95 640.41 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 382.14 454.03 457.81 466.71 611.63 616.76 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.07 450.01 453.87 469.03 592.29 643.12 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 367.13 441.63 446.22 473.11 573.50 673.13 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.17 432.02 435.21 474.91 559.62 702.71 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.80 419.20 425.08 472.78 550.81 731.20 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.72 403.74 417.41 466.66 545.81 758.16 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.90 387.57 411.97 457.46 542.62 783.20 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.50 371.48 408.94 446.35 539.47 806.05 -------------------------------------------------------------------------------- K point *** = 0.453125 0.203125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.51 356.25 407.70 434.76 535.24 826.47 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.78 355.18 415.04 438.20 508.33 838.47 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.15 345.96 408.80 434.93 501.41 853.38 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.91 342.62 398.36 436.71 492.99 865.91 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.82 345.96 386.82 440.30 483.52 876.09 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.02 353.89 376.12 443.59 474.02 883.94 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.27 363.00 367.56 444.97 466.47 889.49 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.83 361.85 369.64 444.24 462.94 892.79 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 260.38 359.89 370.00 444.24 463.11 893.82 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.11 361.69 363.93 444.94 467.19 892.54 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.74 354.13 367.38 443.35 475.66 888.90 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.45 344.55 375.98 439.55 486.36 882.81 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.80 338.18 386.68 434.89 497.15 874.20 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.06 337.78 398.08 430.90 506.92 863.01 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.89 344.22 407.55 430.21 515.14 849.22 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.25 355.65 411.78 436.17 521.59 832.87 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.97 369.71 413.22 446.27 526.38 814.03 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.49 384.90 415.61 456.59 529.90 792.82 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.11 400.32 420.21 465.39 533.05 769.43 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.63 415.12 427.24 471.57 537.31 744.09 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.83 427.87 436.65 474.29 544.66 717.13 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.69 437.78 447.06 473.52 556.79 688.96 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.37 445.66 455.31 470.43 574.20 660.15 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 382.90 451.33 459.07 467.82 596.00 631.64 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 385.23 451.63 460.53 467.73 602.35 622.86 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 382.74 446.89 461.25 468.86 577.72 649.30 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 375.79 440.53 456.74 471.71 556.56 676.97 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.40 432.71 448.23 473.89 540.76 704.48 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.73 422.83 438.19 473.71 530.52 731.13 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.95 410.45 429.42 470.44 524.56 756.45 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.38 396.43 423.11 464.26 520.87 780.06 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.42 381.92 419.26 455.90 517.63 801.72 -------------------------------------------------------------------------------- K point *** = 0.453125 0.234375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.15 367.79 417.24 446.47 513.66 821.23 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.03 363.31 423.98 447.62 490.43 833.12 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.91 354.59 419.16 443.33 484.23 847.24 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.27 351.04 410.07 443.21 477.06 859.44 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.28 353.72 398.69 444.76 469.74 869.77 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.78 360.36 386.96 445.42 464.01 878.28 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.56 366.77 376.20 444.44 461.64 884.97 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.03 367.44 368.61 444.28 462.43 889.77 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 262.11 361.69 363.93 444.94 467.19 892.54 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 261.25 354.50 359.61 443.20 477.08 893.07 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.48 343.39 361.37 438.84 489.95 891.12 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.31 333.11 366.89 432.92 503.41 886.48 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.61 326.14 375.56 426.49 516.10 878.98 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.67 325.00 386.33 420.69 527.27 868.49 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.66 330.92 396.95 417.65 536.54 855.01 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.05 342.37 402.25 422.41 543.77 838.58 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.55 356.98 403.03 433.97 549.03 819.30 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.55 373.16 404.59 446.73 552.69 797.36 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.39 389.96 408.52 458.52 555.53 772.96 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.96 406.61 414.98 468.07 558.89 746.39 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.28 422.13 423.70 474.05 564.73 717.97 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.67 432.79 436.54 475.51 574.97 688.13 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.70 442.43 447.73 472.64 590.36 657.36 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.88 450.92 455.23 467.42 610.18 626.41 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 380.47 452.08 460.50 465.40 595.89 633.39 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 382.44 444.55 465.33 467.24 567.46 658.25 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 379.76 436.10 464.00 471.48 542.77 683.83 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 372.14 428.07 458.63 474.18 524.05 709.24 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.59 419.77 450.04 474.66 512.36 733.85 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.86 410.18 440.86 472.71 506.07 757.21 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.92 399.06 433.56 468.45 502.37 778.98 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.60 386.97 428.83 462.29 499.19 798.96 -------------------------------------------------------------------------------- K point *** = 0.453125 0.265625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.20 374.69 426.15 454.87 495.38 817.03 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.47 365.46 432.12 454.17 477.60 828.62 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.06 357.78 428.53 449.46 471.95 841.46 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.23 354.42 421.06 447.85 465.99 852.77 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.65 356.53 410.57 447.33 461.23 862.70 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.89 361.43 398.79 445.79 459.52 871.34 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.76 364.37 386.97 444.88 460.64 878.70 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.71 361.88 376.20 445.09 465.36 884.64 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.74 354.13 367.38 443.35 475.66 888.90 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.48 343.39 361.37 438.84 489.95 891.12 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 263.22 331.79 358.99 432.36 505.67 890.92 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.84 321.24 360.64 424.77 521.17 887.92 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.58 313.77 366.21 416.88 535.47 881.83 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.96 311.72 375.10 409.58 547.97 872.50 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.76 316.72 385.85 404.28 558.33 859.84 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.94 327.66 392.58 406.66 566.40 843.92 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.05 342.24 392.46 419.25 572.22 824.87 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.38 358.83 393.22 433.97 576.07 802.88 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.22 376.32 396.74 448.40 578.58 778.23 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.53 393.51 403.57 461.30 580.87 751.22 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.50 407.86 414.95 471.23 584.66 722.27 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.74 419.16 429.33 476.58 591.94 691.91 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.06 429.88 442.48 476.45 603.58 661.17 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.29 439.77 453.15 471.50 613.13 636.88 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 370.05 447.05 460.69 464.71 591.63 647.45 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.74 444.74 461.75 467.51 562.28 669.24 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.41 433.89 464.42 471.75 534.94 692.61 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.77 422.16 464.03 475.14 512.46 716.01 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.88 411.81 459.04 476.67 497.72 738.64 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.72 402.86 450.82 475.31 491.04 760.00 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.07 394.09 442.95 471.61 488.23 779.80 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.66 384.78 437.43 466.53 485.71 797.86 -------------------------------------------------------------------------------- K point *** = 0.453125 0.296875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.29 374.99 434.22 460.48 482.25 814.12 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.72 361.25 439.28 458.50 470.65 825.00 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.14 354.96 436.75 453.96 465.26 836.17 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.14 352.32 430.90 451.77 459.97 846.12 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.94 354.45 421.72 449.86 457.34 855.12 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.18 358.06 410.65 447.40 458.38 863.34 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.69 358.54 398.76 446.10 462.56 870.82 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.80 353.72 386.92 444.02 471.97 877.43 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.45 344.55 375.98 439.55 486.36 882.81 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 268.31 333.11 366.89 432.92 503.41 886.48 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 265.84 321.24 360.64 424.77 521.17 887.92 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 266.18 310.49 358.10 415.82 538.34 886.60 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.01 302.55 359.73 406.78 554.10 882.14 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.25 299.47 365.50 398.40 567.87 874.28 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.49 303.16 374.78 391.51 579.31 862.90 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.22 313.06 383.06 390.49 588.23 848.04 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.79 327.01 381.80 403.56 594.62 829.84 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.29 343.46 381.92 419.38 598.67 808.53 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.91 361.31 385.18 435.66 600.82 784.43 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.68 379.09 392.16 451.27 601.90 757.96 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.03 394.06 404.14 464.81 603.21 729.68 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.77 405.95 419.55 474.49 606.21 700.60 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.93 417.16 434.22 478.62 610.77 673.28 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.46 427.85 446.45 476.81 608.33 657.53 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.18 437.28 454.84 471.26 587.71 664.30 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.75 442.54 455.41 469.91 559.95 681.89 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.67 434.56 457.49 473.60 532.46 702.59 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.15 419.61 461.40 476.82 508.18 723.88 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.87 404.27 462.45 478.82 489.44 744.59 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.19 391.96 458.27 477.99 480.23 764.06 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.25 383.34 450.90 473.00 479.74 781.93 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.20 376.07 444.87 468.72 478.14 798.03 -------------------------------------------------------------------------------- K point *** = 0.453125 0.328125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.05 368.70 441.27 463.85 475.09 812.35 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.42 353.19 445.32 459.22 470.37 821.87 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.70 348.36 443.69 455.88 464.57 831.17 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.06 347.29 439.18 455.00 458.50 839.44 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.65 350.78 431.36 453.13 456.63 847.06 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.96 354.43 421.51 449.23 460.25 854.34 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.64 353.97 410.39 445.98 467.64 861.40 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.68 348.11 398.56 441.46 480.31 868.15 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.80 338.18 386.68 434.89 497.15 874.20 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.61 326.14 375.56 426.49 516.10 878.98 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 270.58 313.77 366.21 416.88 535.47 881.83 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.01 302.55 359.73 406.78 554.10 882.14 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 269.92 293.95 357.06 396.89 571.18 879.39 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.71 289.67 358.78 387.85 586.15 873.22 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.08 291.70 364.92 380.26 598.62 863.48 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.10 300.00 374.07 375.65 608.36 850.16 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.98 312.65 371.44 388.57 615.27 833.39 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.48 328.42 371.30 404.30 619.43 813.45 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.65 346.35 374.46 421.39 621.13 790.72 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.67 365.05 381.17 438.77 620.86 765.76 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.24 381.85 392.34 455.10 619.37 739.42 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.42 394.78 407.97 468.61 617.28 713.28 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.33 406.28 423.81 477.25 613.65 690.89 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.97 417.26 437.40 479.68 603.51 679.29 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.21 427.43 447.21 476.80 583.43 682.57 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.80 435.86 449.82 473.67 558.00 695.69 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.42 435.19 448.63 475.48 532.08 713.20 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.69 420.13 453.65 478.80 508.47 732.12 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.06 401.53 458.10 481.03 488.87 750.85 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.38 383.84 460.12 473.95 482.18 768.48 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.45 371.43 456.86 467.21 481.33 784.53 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.86 364.48 450.96 465.17 479.01 798.76 -------------------------------------------------------------------------------- K point *** = 0.453125 0.359375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.14 358.87 447.12 462.70 475.30 811.15 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.28 345.07 450.08 456.96 474.74 818.63 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.10 341.87 449.11 454.63 469.10 826.02 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.14 344.24 445.05 454.78 463.49 832.42 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.00 350.28 438.33 454.31 461.14 838.35 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.71 354.86 429.97 450.55 465.09 844.25 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.08 354.46 420.31 445.81 474.15 850.40 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.69 348.27 409.57 439.41 488.55 856.77 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.06 337.78 398.08 430.90 506.92 863.01 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.67 325.00 386.33 420.69 527.27 868.49 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.96 311.72 375.10 409.58 547.97 872.50 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 273.25 299.47 365.50 398.40 567.87 874.28 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 272.71 289.67 358.78 387.85 586.15 873.22 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.17 283.75 356.04 378.50 602.21 868.89 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.56 283.67 357.93 370.85 615.61 861.06 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.65 289.86 363.86 366.03 626.07 849.67 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.70 300.49 362.19 375.68 633.39 834.86 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.00 314.97 362.28 390.01 637.55 816.93 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.49 332.59 365.55 406.81 638.61 796.36 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.68 351.99 371.92 424.94 636.79 773.84 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.58 371.12 381.39 443.06 632.33 750.50 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.38 386.41 395.47 459.46 625.27 728.22 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.21 398.22 411.96 472.04 614.84 710.19 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.07 409.20 426.73 478.90 599.49 700.47 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.81 419.54 437.98 479.67 578.90 701.01 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.20 428.85 443.01 477.29 555.25 709.96 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.98 433.82 440.71 477.31 531.36 723.94 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.86 420.86 445.84 480.17 509.41 740.16 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.57 401.75 451.41 483.00 490.67 756.74 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.76 381.92 455.53 475.49 484.72 772.50 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.74 364.61 457.75 464.59 484.63 786.78 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.06 354.20 455.47 460.22 482.85 799.24 -------------------------------------------------------------------------------- K point *** = 0.453125 0.390625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.30 349.41 451.66 459.10 479.47 809.81 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.03 340.05 453.46 455.03 479.74 814.64 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.27 340.43 451.72 454.74 474.67 820.15 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.63 346.59 447.39 456.65 469.48 824.63 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.89 354.43 441.63 457.27 466.91 828.69 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.47 360.23 434.64 453.97 470.74 832.92 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.72 360.66 426.54 448.48 480.46 837.74 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.06 354.82 417.46 440.68 495.76 843.26 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.89 344.22 407.55 430.21 515.14 849.22 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.66 330.92 396.95 417.65 536.54 855.01 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.76 316.72 385.85 404.28 558.33 859.84 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.49 303.16 374.78 391.51 579.31 862.90 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.08 291.70 364.92 380.26 598.62 863.48 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.56 283.67 357.93 370.85 615.61 861.06 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.65 280.38 355.20 363.51 629.80 855.33 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.73 283.89 356.59 359.41 640.81 846.22 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.88 291.77 355.39 365.64 648.38 833.85 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.74 304.33 355.95 377.57 652.31 818.54 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.49 320.91 359.51 393.11 652.52 800.84 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.05 340.02 365.80 411.02 648.96 781.58 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.61 360.07 374.27 429.93 641.59 761.95 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.38 379.28 384.58 448.15 630.34 743.69 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.47 393.27 399.33 463.65 615.13 729.04 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.81 404.14 414.99 474.38 596.18 720.27 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.26 414.40 427.49 479.11 574.45 718.72 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.56 423.92 434.56 479.07 551.57 724.02 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.45 431.08 433.93 478.62 529.35 734.39 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.67 419.99 440.32 480.73 509.19 747.61 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.97 401.91 446.46 483.84 491.81 761.78 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.13 382.30 451.21 477.54 486.20 775.55 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.97 364.34 454.46 466.60 487.08 788.04 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.27 350.31 456.11 459.14 486.25 798.78 -------------------------------------------------------------------------------- K point *** = 0.453125 0.421875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.29 343.33 454.77 456.42 483.74 807.62 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.83 340.74 454.88 455.41 483.92 809.31 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.08 343.92 452.41 456.84 479.65 813.02 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.14 351.40 448.50 459.67 474.92 815.63 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.19 360.70 443.26 461.75 472.09 817.76 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.50 368.22 436.80 459.54 475.78 820.13 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.36 370.32 429.27 454.49 485.84 823.31 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.15 365.68 420.86 446.93 501.59 827.61 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.25 355.65 411.78 436.17 521.59 832.87 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.05 342.37 402.25 422.41 543.77 838.58 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.94 327.66 392.58 406.66 566.40 843.92 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.22 313.06 383.06 390.49 588.23 848.04 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.10 300.00 374.07 375.65 608.36 850.16 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.65 289.86 363.86 366.03 626.07 849.67 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.73 283.89 356.59 359.41 640.81 846.22 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.03 283.03 354.76 354.76 652.14 839.69 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.08 287.70 352.59 358.64 659.67 830.20 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.42 297.66 353.31 367.85 663.11 818.08 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.77 312.03 356.99 381.53 662.20 803.91 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.18 329.49 363.28 398.48 656.80 788.51 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.87 348.58 371.57 417.26 646.86 772.91 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.02 367.92 381.15 436.23 632.53 758.39 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.71 386.33 391.40 453.47 614.31 746.35 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.87 401.82 402.83 466.97 593.09 738.21 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.31 411.99 416.29 475.18 570.21 735.07 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.77 421.58 424.96 478.13 547.32 737.31 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.97 425.81 430.32 478.61 526.06 744.20 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.63 416.82 438.00 480.28 507.39 754.24 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.50 400.74 444.45 483.32 491.51 765.74 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.34 382.28 449.54 478.03 486.49 777.29 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.98 365.06 453.17 467.69 488.23 787.86 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.31 351.52 455.29 460.43 488.44 796.87 -------------------------------------------------------------------------------- K point *** = 0.453125 0.453125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.26 343.18 455.85 456.41 486.97 804.01 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.74 345.80 455.77 457.48 486.73 802.26 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.77 347.84 454.99 457.99 483.38 804.25 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.62 356.32 451.19 461.86 479.24 805.04 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.22 367.20 445.93 465.87 476.16 805.27 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.92 376.84 439.33 465.38 479.62 805.70 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.04 381.28 431.57 461.38 490.07 807.05 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.93 378.54 422.80 455.34 506.04 809.81 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.97 369.71 413.22 446.27 526.38 814.03 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.55 356.98 403.03 433.97 549.03 819.30 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.05 342.24 392.46 419.25 572.22 824.87 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.79 327.01 381.80 403.56 594.62 829.84 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.98 312.65 371.44 388.57 615.27 833.39 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.70 300.49 362.19 375.68 633.39 834.86 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.88 291.77 355.39 365.64 648.38 833.85 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.08 287.70 352.59 358.64 659.67 830.20 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.98 289.86 354.73 354.87 666.81 824.00 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.47 296.10 354.37 362.09 669.41 815.59 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.25 306.92 357.25 373.99 667.18 805.46 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.14 321.55 363.05 389.49 660.01 794.24 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.41 338.62 371.06 407.29 648.06 782.65 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.31 356.74 380.53 425.87 631.76 771.45 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.94 374.63 390.78 443.50 611.89 761.55 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.22 391.18 401.27 458.35 589.51 753.95 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.95 405.21 411.54 468.88 565.94 749.69 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.88 415.02 421.33 474.49 542.82 749.44 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.68 417.94 430.46 476.66 521.90 753.15 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.04 411.82 438.55 478.53 504.21 759.97 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.68 398.13 445.38 481.36 489.75 768.57 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.33 381.28 450.85 476.69 485.57 777.63 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.79 365.23 454.83 467.16 487.94 786.09 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.77 352.78 457.25 460.32 489.11 793.23 -------------------------------------------------------------------------------- K point *** = 0.453125 0.484375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.37 347.44 456.45 458.20 488.71 798.65 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.54 357.22 454.62 463.22 487.89 793.32 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.66 356.66 456.80 461.46 485.55 793.61 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.00 362.17 456.12 463.24 482.16 792.65 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.81 373.61 450.89 469.04 478.94 791.03 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.90 385.16 443.90 470.60 482.11 789.51 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.07 392.25 435.52 467.51 493.30 788.93 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.79 392.00 426.00 463.23 509.51 789.94 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.49 384.90 415.61 456.59 529.90 792.82 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.55 373.16 404.59 446.73 552.69 797.36 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.38 358.83 393.22 433.97 576.07 802.88 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.29 343.46 381.92 419.38 598.67 808.53 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.48 328.42 371.30 404.30 619.43 813.45 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.00 314.97 362.28 390.01 637.55 816.93 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.74 304.33 355.95 377.57 652.31 818.54 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.42 297.66 353.31 367.85 663.11 818.08 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.47 296.10 354.37 362.09 669.41 815.59 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.27 299.45 355.62 364.29 670.83 811.28 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.25 306.92 357.25 373.99 667.18 805.46 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.95 318.20 361.97 387.49 658.53 798.44 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.22 332.52 369.50 403.33 645.25 790.59 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.21 348.70 378.96 420.20 627.96 782.33 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.07 365.48 389.49 436.66 607.48 774.30 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.76 381.60 400.41 451.16 584.82 767.32 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.10 395.72 411.24 462.32 561.19 762.34 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.80 406.10 421.73 469.37 538.12 760.17 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.51 410.34 431.67 473.01 517.38 761.12 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.87 406.35 440.66 475.47 500.24 764.83 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.50 394.94 448.33 478.18 486.90 770.40 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.99 380.06 454.49 473.97 483.47 776.73 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.57 366.24 458.86 465.52 486.26 782.81 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.26 359.12 458.14 462.76 488.23 787.87 -------------------------------------------------------------------------------- K point *** = 0.453125 0.515625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.34 358.08 454.96 463.70 488.82 791.43 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.94 373.23 451.92 472.28 487.36 782.55 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.45 372.67 454.77 470.66 486.01 781.08 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.37 373.82 458.89 468.68 483.49 778.38 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.24 381.52 457.60 472.30 480.41 774.97 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.96 393.24 450.91 475.09 483.68 771.55 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.47 402.52 441.96 472.22 496.25 769.00 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.97 405.13 431.53 469.41 512.84 768.12 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.11 400.32 420.21 465.39 533.05 769.43 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.39 389.96 408.52 458.52 555.53 772.96 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.22 376.32 396.74 448.40 578.58 778.23 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.91 361.31 385.18 435.66 600.82 784.43 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.65 346.35 374.46 421.39 621.13 790.72 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.49 332.59 365.55 406.81 638.61 796.36 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.49 320.91 359.51 393.11 652.52 800.84 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.77 312.03 356.99 381.53 662.20 803.91 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.25 306.92 357.25 373.99 667.18 805.46 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.25 306.92 357.25 373.99 667.18 805.46 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.77 312.03 356.99 381.53 662.20 803.91 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.49 320.91 359.51 393.11 652.52 800.84 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.49 332.59 365.55 406.81 638.61 796.36 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.65 346.35 374.46 421.39 621.13 790.72 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.91 361.31 385.18 435.66 600.82 784.43 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.22 376.32 396.74 448.40 578.58 778.23 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.39 389.96 408.52 458.52 555.53 772.96 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.11 400.32 420.21 465.39 533.05 769.43 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.97 405.13 431.53 469.41 512.84 768.12 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.47 402.52 441.96 472.22 496.25 769.00 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.96 393.24 450.91 475.09 483.68 771.55 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.24 381.52 457.60 472.30 480.41 774.97 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.37 373.82 458.89 468.68 483.49 778.38 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.45 372.67 454.77 470.66 486.01 781.08 -------------------------------------------------------------------------------- K point *** = 0.453125 0.546875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.94 373.23 451.92 472.28 487.36 782.55 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.04 391.96 447.72 484.32 485.50 770.34 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.40 391.94 451.05 483.49 484.88 766.92 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.71 391.69 456.67 480.96 483.57 762.40 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.61 394.17 461.33 479.87 481.52 757.18 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.13 402.21 458.77 477.84 487.53 751.91 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.33 411.78 450.55 475.04 500.70 747.40 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.02 416.95 439.61 473.19 517.56 744.54 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.63 415.12 427.24 471.57 537.31 744.09 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.96 406.61 414.98 468.07 558.89 746.39 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.53 393.51 403.57 461.30 580.87 751.22 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.68 379.09 392.16 451.27 601.90 757.96 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.67 365.05 381.17 438.77 620.86 765.76 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.68 351.99 371.92 424.94 636.79 773.84 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.05 340.02 365.80 411.02 648.96 781.58 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.18 329.49 363.28 398.48 656.80 788.51 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.14 321.55 363.05 389.49 660.01 794.24 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.95 318.20 361.97 387.49 658.53 798.44 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.49 320.91 359.51 393.11 652.52 800.84 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.51 328.49 358.81 403.10 642.33 801.28 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.08 338.87 361.80 415.16 628.43 799.76 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.49 350.73 368.77 427.88 611.38 796.50 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.60 363.55 378.73 440.13 591.84 791.93 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.21 376.96 390.19 450.90 570.62 786.70 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.03 389.87 402.12 459.35 548.73 781.56 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.65 400.01 414.43 465.08 527.52 777.25 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.53 404.79 427.03 468.56 508.60 774.26 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.89 402.94 438.91 471.23 493.34 772.75 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.42 395.96 448.75 474.34 482.22 772.47 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.72 389.00 454.37 475.62 478.40 772.92 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.00 387.02 453.43 476.23 481.66 773.44 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.96 388.69 449.77 479.71 484.22 773.45 -------------------------------------------------------------------------------- K point *** = 0.453125 0.578125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.28 390.81 447.39 482.74 485.55 772.50 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.99 410.61 442.08 482.17 499.82 757.42 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.97 411.70 445.81 482.14 500.03 751.69 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.41 411.29 452.29 481.03 498.86 745.10 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.61 410.97 459.72 479.06 497.58 737.97 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.98 413.69 463.38 477.03 499.93 730.82 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.27 420.46 459.02 475.43 509.95 724.37 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.33 426.73 449.26 474.27 525.82 719.50 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.83 427.87 436.65 474.29 544.66 717.13 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.28 422.13 423.70 474.05 564.73 717.97 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.50 407.86 414.95 471.23 584.66 722.27 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.03 394.06 404.14 464.81 603.21 729.68 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.24 381.85 392.34 455.10 619.37 739.42 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.58 371.12 381.39 443.06 632.33 750.50 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.61 360.07 374.27 429.93 641.59 761.95 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.87 348.58 371.57 417.26 646.86 772.91 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.41 338.62 371.06 407.29 648.06 782.65 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.22 332.52 369.50 403.33 645.25 790.59 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.49 332.59 365.55 406.81 638.61 796.36 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.08 338.87 361.80 415.16 628.43 799.76 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.59 349.02 360.81 425.74 615.06 800.82 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.10 359.73 364.92 436.94 598.94 799.73 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.86 367.78 376.11 447.57 580.67 796.89 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.71 377.57 388.39 456.70 560.98 792.86 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.31 389.61 399.26 463.64 540.89 788.27 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.11 402.63 407.59 468.17 521.79 783.74 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.38 409.51 417.75 470.79 505.43 779.71 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.00 407.59 430.33 472.42 493.53 776.39 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.15 402.19 440.65 472.92 487.67 773.69 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.38 398.54 446.20 472.82 488.01 771.31 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.50 399.58 445.96 475.14 491.20 768.84 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.32 403.49 443.28 478.50 494.90 765.89 -------------------------------------------------------------------------------- K point *** = 0.453125 0.609375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.53 407.67 441.44 480.98 498.00 762.14 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.97 425.10 435.13 479.46 517.84 744.96 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.40 428.25 439.44 479.09 519.69 736.41 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.43 428.87 446.69 477.95 520.06 727.29 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.19 427.93 455.43 476.32 519.66 717.91 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 372.48 427.26 463.01 474.37 520.68 708.72 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 377.08 429.60 464.29 473.24 526.85 700.29 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.35 434.71 457.87 472.94 539.71 693.39 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.69 437.78 447.06 473.52 556.79 688.96 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.67 432.79 436.54 475.51 574.97 688.13 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.74 419.16 429.33 476.58 591.94 691.91 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.77 405.95 419.55 474.49 606.21 700.60 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.42 394.78 407.97 468.61 617.28 713.28 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.38 386.41 395.47 459.46 625.27 728.22 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.38 379.28 384.58 448.15 630.34 743.69 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.02 367.92 381.15 436.23 632.53 758.39 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.31 356.74 380.53 425.87 631.76 771.45 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.21 348.70 378.96 420.20 627.96 782.33 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.65 346.35 374.46 421.39 621.13 790.72 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.49 350.73 368.77 427.88 611.38 796.50 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.10 359.73 364.92 436.94 598.94 799.73 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.21 362.69 372.76 446.70 584.17 800.61 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.68 365.26 385.50 455.90 567.60 799.51 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.69 371.44 397.71 463.61 549.99 796.89 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.98 380.85 407.91 469.24 532.49 793.24 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.00 392.61 414.47 472.58 516.80 789.05 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.90 405.58 415.84 473.75 505.16 784.66 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.37 412.10 418.38 472.79 499.47 780.21 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.45 406.57 429.20 470.59 499.27 775.68 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.91 404.06 435.72 469.94 502.11 770.88 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.91 406.69 436.94 472.40 506.15 765.58 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.81 412.63 435.43 475.99 510.51 759.57 -------------------------------------------------------------------------------- K point *** = 0.453125 0.640625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.90 419.39 434.21 478.53 514.62 752.71 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.22 426.86 430.91 478.79 538.43 734.59 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.93 430.22 438.72 477.87 541.87 722.67 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.19 435.39 445.20 475.46 544.17 710.31 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.61 439.56 451.74 472.79 545.42 698.02 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 370.92 440.10 459.66 470.66 546.74 686.32 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 379.78 439.61 465.52 469.06 550.65 675.73 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 381.67 441.82 462.99 470.01 559.85 666.77 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.37 445.66 455.31 470.43 574.20 660.15 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.70 442.43 447.73 472.64 590.36 657.36 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.06 429.88 442.48 476.45 603.58 661.17 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.93 417.16 434.22 478.62 610.77 673.28 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.33 406.28 423.81 477.25 613.65 690.89 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.21 398.22 411.96 472.04 614.84 710.19 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.47 393.27 399.33 463.65 615.13 729.04 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.71 386.33 391.40 453.47 614.31 746.35 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.94 374.63 390.78 443.50 611.89 761.55 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.07 365.48 389.49 436.66 607.48 774.30 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.91 361.31 385.18 435.66 600.82 784.43 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.60 363.55 378.73 440.13 591.84 791.93 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.86 367.78 376.11 447.57 580.67 796.89 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.68 365.26 385.50 455.90 567.60 799.51 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.51 364.18 397.59 463.73 553.20 800.11 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.98 366.64 408.88 470.15 538.39 799.03 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.12 372.70 417.32 474.53 524.73 796.67 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.51 381.83 420.96 476.30 514.60 793.32 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.34 393.05 418.76 475.01 510.30 789.20 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.30 404.85 412.48 471.55 511.40 784.35 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.43 405.15 416.43 468.05 515.31 778.72 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.61 402.63 423.97 466.86 520.11 772.16 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.76 405.85 426.77 469.34 524.98 764.52 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.74 413.14 426.42 473.77 529.69 755.70 -------------------------------------------------------------------------------- K point *** = 0.453125 0.671875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.65 422.06 425.83 477.40 534.24 745.68 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.01 417.76 426.71 478.73 560.85 728.23 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.82 421.47 436.87 479.39 565.19 712.72 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.04 427.91 445.83 476.94 569.23 696.48 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.54 436.43 453.17 472.17 572.62 680.25 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.63 444.90 458.78 466.94 575.44 664.97 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 377.97 448.71 463.29 464.49 578.77 651.52 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 384.29 448.71 462.80 467.47 584.95 640.41 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 382.90 451.33 459.07 467.82 596.00 631.64 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.88 450.92 455.23 467.42 610.18 626.41 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.29 439.77 453.15 471.50 613.13 636.88 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.46 427.85 446.45 476.81 608.33 657.53 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.97 417.26 437.40 479.68 603.51 679.29 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.07 409.20 426.73 478.90 599.49 700.47 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.81 404.14 414.99 474.38 596.18 720.27 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.87 401.82 402.83 466.97 593.09 738.21 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.22 391.18 401.27 458.35 589.51 753.95 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.76 381.60 400.41 451.16 584.82 767.32 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.22 376.32 396.74 448.40 578.58 778.23 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.21 376.96 390.19 450.90 570.62 786.70 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.71 377.57 388.39 456.70 560.98 792.86 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.69 371.44 397.71 463.61 549.99 796.89 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.98 366.64 408.88 470.15 538.39 799.03 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.64 365.08 418.29 475.32 527.56 799.56 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.09 367.23 423.40 478.08 519.85 798.70 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.20 372.94 422.49 477.37 517.84 796.60 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.33 381.51 416.12 473.64 521.33 793.30 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.33 391.62 407.30 468.64 527.63 788.75 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.33 397.05 404.40 464.07 534.58 782.81 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.22 394.82 411.78 461.91 541.13 775.31 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.48 398.01 415.91 463.93 546.89 766.13 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.46 405.88 416.61 469.27 551.90 755.18 -------------------------------------------------------------------------------- K point *** = 0.453125 0.703125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.05 416.02 416.52 474.99 556.45 742.49 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.60 407.85 415.90 474.98 583.65 727.51 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.35 411.54 427.44 479.18 587.60 709.22 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.28 418.13 438.09 479.79 592.07 689.49 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.43 427.42 447.33 476.80 597.12 668.94 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.50 438.41 454.72 471.11 602.53 648.53 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 372.84 449.11 458.68 465.63 608.11 629.71 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 382.14 454.03 457.81 466.71 611.63 616.76 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 385.23 451.63 460.53 467.73 602.35 622.86 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 380.47 452.08 460.50 465.40 595.89 633.39 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 370.05 447.05 460.69 464.71 591.63 647.45 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.18 437.28 454.84 471.26 587.71 664.30 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.21 427.43 447.21 476.80 583.43 682.57 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.81 419.54 437.98 479.67 578.90 701.01 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.26 414.40 427.49 479.11 574.45 718.72 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.31 411.99 416.29 475.18 570.21 735.07 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.95 405.21 411.54 468.88 565.94 749.69 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.10 395.72 411.24 462.32 561.19 762.34 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.39 389.96 408.52 458.52 555.53 772.96 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.03 389.87 402.12 459.35 548.73 781.56 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.31 389.61 399.26 463.64 540.89 788.27 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.98 380.85 407.91 469.24 532.49 793.24 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.12 372.70 417.32 474.53 524.73 796.67 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.09 367.23 423.40 478.08 519.85 798.70 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.66 365.27 423.70 478.33 520.53 799.42 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.05 367.04 418.05 475.11 526.84 798.82 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.95 372.21 408.48 469.78 536.14 796.78 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.45 379.72 398.08 463.55 546.10 793.11 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.93 384.76 393.29 457.68 555.45 787.59 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.27 382.80 399.64 454.08 563.56 780.02 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.47 385.56 404.71 454.92 570.23 770.26 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.28 393.45 406.32 460.47 575.53 758.22 -------------------------------------------------------------------------------- K point *** = 0.453125 0.734375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.42 404.16 406.60 468.11 579.82 743.92 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.27 397.38 401.17 465.46 605.12 733.01 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.76 400.90 413.64 473.38 606.97 714.13 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.16 407.43 425.48 478.24 608.81 693.73 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.61 416.94 436.06 479.29 610.81 672.82 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.07 428.69 444.77 476.71 611.60 653.80 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.39 441.22 450.63 472.08 606.11 642.77 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.07 450.01 453.87 469.03 592.29 643.12 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 382.74 446.89 461.25 468.86 577.72 649.30 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 382.44 444.55 465.33 467.24 567.46 658.25 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.74 444.74 461.75 467.51 562.28 669.24 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 362.75 442.54 455.41 469.91 559.95 681.89 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.80 435.86 449.82 473.67 558.00 695.69 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.20 428.85 443.01 477.29 555.25 709.96 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.56 423.92 434.56 479.07 551.57 724.02 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.77 421.58 424.96 478.13 547.32 737.31 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.88 415.02 421.33 474.49 542.82 749.44 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.80 406.10 421.73 469.37 538.12 760.17 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.11 400.32 420.21 465.39 533.05 769.43 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.65 400.01 414.43 465.08 527.52 777.25 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.11 402.63 407.59 468.17 521.79 783.74 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.00 392.61 414.47 472.58 516.80 789.05 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.51 381.83 420.96 476.30 514.60 793.32 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.20 372.94 422.49 477.37 517.84 796.60 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.05 367.04 418.05 475.11 526.84 798.82 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.59 364.72 409.01 470.28 539.15 799.81 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.86 366.05 397.61 463.69 552.39 799.28 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.33 370.26 386.37 456.16 565.08 796.94 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.77 372.21 381.75 448.82 576.39 792.47 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.18 368.83 387.74 443.47 585.88 785.63 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.07 370.56 393.36 442.52 593.36 776.26 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.52 378.00 395.72 447.32 598.86 764.32 -------------------------------------------------------------------------------- K point *** = 0.453125 0.765625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.02 388.85 396.22 456.00 602.63 749.85 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.22 383.24 387.36 450.82 623.81 744.07 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.26 389.58 397.40 461.62 622.14 727.16 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.87 396.15 410.03 470.42 618.49 709.70 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.29 405.78 421.80 475.98 612.59 693.37 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.70 417.92 431.95 477.69 603.43 680.68 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.29 431.31 439.69 476.04 590.07 673.88 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 367.13 441.63 446.22 473.11 573.50 673.13 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 375.79 440.53 456.74 471.71 556.56 676.97 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 379.76 436.10 464.00 471.48 542.77 683.83 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.41 433.89 464.42 471.75 534.94 692.61 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.67 434.56 457.49 473.60 532.46 702.59 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.42 435.19 448.63 475.48 532.08 713.20 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.98 433.82 440.71 477.31 531.36 723.94 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.45 431.08 433.93 478.62 529.35 734.39 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.97 425.81 430.32 478.61 526.06 744.20 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.68 417.94 430.46 476.66 521.90 753.15 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.51 410.34 431.67 473.01 517.38 761.12 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.97 405.13 431.53 469.41 512.84 768.12 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.53 404.79 427.03 468.56 508.60 774.26 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.38 409.51 417.75 470.79 505.43 779.71 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.90 405.58 415.84 473.75 505.16 784.66 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.34 393.05 418.76 475.01 510.30 789.20 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.33 381.51 416.12 473.64 521.33 793.30 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.95 372.21 408.48 469.78 536.14 796.78 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.86 366.05 397.61 463.69 552.39 799.28 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.39 363.50 385.26 455.82 568.45 800.39 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.43 364.11 373.48 446.91 583.29 799.67 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.25 360.56 370.84 438.06 596.24 796.73 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.22 354.61 376.58 430.88 606.89 791.31 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.53 354.61 382.28 427.78 615.00 783.26 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.43 360.93 385.16 431.05 620.46 772.57 -------------------------------------------------------------------------------- K point *** = 0.453125 0.796875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.10 371.33 385.82 439.77 623.34 759.40 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.59 364.17 377.19 432.93 638.79 759.11 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.94 375.05 382.67 445.53 633.24 745.80 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.49 383.82 393.71 457.25 624.19 732.47 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.56 394.12 405.93 466.71 611.79 720.34 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.55 406.73 417.18 472.88 596.39 710.74 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.94 420.77 426.41 475.34 578.65 704.70 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.17 432.02 435.21 474.91 559.62 702.71 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.40 432.71 448.23 473.89 540.76 704.48 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 372.14 428.07 458.63 474.18 524.05 709.24 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.77 422.16 464.03 475.14 512.46 716.01 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.15 419.61 461.40 476.82 508.18 723.88 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.69 420.13 453.65 478.80 508.47 732.12 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.86 420.86 445.84 480.17 509.41 740.16 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.67 419.99 440.32 480.73 509.19 747.61 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.63 416.82 438.00 480.28 507.39 754.24 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.04 411.82 438.55 478.53 504.21 759.97 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.87 406.35 440.66 475.47 500.24 764.83 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.47 402.52 441.96 472.22 496.25 769.00 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.89 402.94 438.91 471.23 493.34 772.75 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.00 407.59 430.33 472.42 493.53 776.39 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.37 412.10 418.38 472.79 499.47 780.21 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.30 404.85 412.48 471.55 511.40 784.35 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.33 391.62 407.30 468.64 527.63 788.75 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.45 379.72 398.08 463.55 546.10 793.11 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.33 370.26 386.37 456.16 565.08 796.94 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.43 364.11 373.48 446.91 583.29 799.67 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.95 360.58 361.78 436.59 599.85 800.74 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.65 349.23 363.03 426.26 614.13 799.72 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.57 341.23 367.14 417.34 625.65 796.31 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.95 338.99 372.14 412.06 634.08 790.37 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.13 343.44 375.18 413.28 639.17 781.99 -------------------------------------------------------------------------------- K point *** = 0.453125 0.828125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.80 352.68 375.87 421.26 640.76 771.41 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.37 344.32 368.09 413.86 649.62 776.30 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.76 355.87 372.51 427.26 640.83 766.98 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.93 367.76 380.83 440.79 627.98 757.38 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.36 380.37 391.70 453.09 611.66 748.19 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.68 394.11 403.12 462.98 592.65 740.22 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.61 408.29 413.79 469.60 571.97 734.33 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.80 419.20 425.08 472.78 550.81 731.20 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.73 422.83 438.19 473.71 530.52 731.13 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.59 419.77 450.04 474.66 512.36 733.85 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.88 411.81 459.04 476.67 497.72 738.64 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.87 404.27 462.45 478.82 489.44 744.59 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.06 401.53 458.10 481.03 488.87 750.85 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.57 401.75 451.41 483.00 490.67 756.74 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.97 401.91 446.46 483.84 491.81 761.78 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.50 400.74 444.45 483.32 491.51 765.74 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.68 398.13 445.38 481.36 489.75 768.57 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.50 394.94 448.33 478.18 486.90 770.40 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.96 393.24 450.91 475.09 483.68 771.55 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.42 395.96 448.75 474.34 482.22 772.47 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.15 402.19 440.65 472.92 487.67 773.69 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.45 406.57 429.20 470.59 499.27 775.68 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.43 405.15 416.43 468.05 515.31 778.72 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.33 397.05 404.40 464.07 534.58 782.81 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.93 384.76 393.29 457.68 555.45 787.59 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.77 372.21 381.75 448.82 576.39 792.47 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.25 360.56 370.84 438.06 596.24 796.73 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.65 349.23 363.03 426.26 614.13 799.72 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.12 338.28 359.80 414.47 629.37 800.93 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.37 329.38 360.64 403.99 641.39 800.04 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.27 324.93 363.86 396.70 649.75 796.94 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.59 326.77 366.45 395.68 654.06 791.75 -------------------------------------------------------------------------------- K point *** = 0.453125 0.859375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.12 334.02 366.93 402.37 654.06 784.73 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.42 325.04 360.67 395.44 656.21 793.98 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.54 335.98 364.92 408.69 645.13 788.43 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.03 348.77 372.55 422.98 630.04 781.94 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.64 362.95 382.59 437.05 611.62 774.95 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.24 377.77 393.88 449.70 590.73 768.11 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.69 392.02 405.56 459.81 568.37 762.24 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.72 403.74 417.41 466.66 545.81 758.16 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.95 410.45 429.42 470.44 524.56 756.45 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.86 410.18 440.86 472.71 506.07 757.21 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.72 402.86 450.82 475.31 491.04 760.00 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 358.19 391.96 458.27 477.99 480.23 764.06 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.38 383.84 460.12 473.95 482.18 768.48 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.76 381.92 455.53 475.49 484.72 772.50 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.13 382.30 451.21 477.54 486.20 775.55 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.34 382.28 449.54 478.03 486.49 777.29 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.33 381.28 450.85 476.69 485.57 777.63 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.99 380.06 454.49 473.97 483.47 776.73 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 354.24 381.52 457.60 472.30 480.41 774.97 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.72 389.00 454.37 475.62 478.40 772.92 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.38 398.54 446.20 472.82 488.01 771.31 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.91 404.06 435.72 469.94 502.11 770.88 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.61 402.63 423.97 466.86 520.11 772.16 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.22 394.82 411.78 461.91 541.13 775.31 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.27 382.80 399.64 454.08 563.56 780.02 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.18 368.83 387.74 443.47 585.88 785.63 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.22 354.61 376.58 430.88 606.89 791.31 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.57 341.23 367.14 417.34 625.65 796.31 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.37 329.38 360.64 403.99 641.39 800.04 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.73 319.74 357.86 391.99 653.45 802.16 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.45 313.44 358.39 382.95 661.28 802.54 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.60 312.26 359.77 379.77 664.45 801.21 -------------------------------------------------------------------------------- K point *** = 0.453125 0.890625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.91 316.66 359.68 384.85 662.75 798.30 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.50 307.80 355.61 379.20 658.60 810.80 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.07 317.46 360.03 391.33 646.15 808.65 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.76 330.08 367.70 405.35 629.90 804.84 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.63 344.63 377.64 420.19 610.54 799.70 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.71 359.97 388.80 434.62 588.86 793.83 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.89 374.78 400.42 447.41 565.81 788.04 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.90 387.57 411.97 457.46 542.62 783.20 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.38 396.43 423.11 464.26 520.87 780.06 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.92 399.06 433.56 468.45 502.37 778.98 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.07 394.09 442.95 471.61 488.23 779.80 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.25 383.34 450.90 473.00 479.74 781.93 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.45 371.43 456.86 467.21 481.33 784.53 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.74 364.61 457.75 464.59 484.63 786.78 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.97 364.34 454.46 466.60 487.08 788.04 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.98 365.06 453.17 467.69 488.23 787.86 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.79 365.23 454.83 467.16 487.94 786.09 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.57 366.24 458.86 465.52 486.26 782.81 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 353.37 373.82 458.89 468.68 483.49 778.38 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 350.00 387.02 453.43 476.23 481.66 773.44 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.50 399.58 445.96 475.14 491.20 768.84 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.91 406.69 436.94 472.40 506.15 765.58 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.76 405.85 426.77 469.34 524.98 764.52 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.48 398.01 415.91 463.93 546.89 766.13 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.47 385.56 404.71 454.92 570.23 770.26 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.07 370.56 393.36 442.52 593.36 776.26 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.53 354.61 382.28 427.78 615.00 783.26 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.95 338.99 372.14 412.06 634.08 790.37 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.27 324.93 363.86 396.70 649.75 796.94 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.45 313.44 358.39 382.95 661.28 802.54 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.62 305.30 356.23 372.15 668.10 806.89 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.92 301.19 355.96 366.84 669.91 809.82 -------------------------------------------------------------------------------- K point *** = 0.453125 0.921875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.91 302.04 354.82 370.19 666.66 811.17 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.47 294.12 353.40 366.45 656.87 825.78 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.38 301.91 358.17 376.44 643.78 826.69 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.50 313.43 366.17 389.09 627.14 825.28 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.03 327.44 376.13 403.67 607.58 821.86 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.99 342.69 387.00 419.03 585.81 816.98 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.24 357.84 398.08 433.73 562.72 811.41 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.50 371.48 408.94 446.35 539.47 806.05 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.42 381.92 419.26 455.90 517.63 801.72 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.60 386.97 428.83 462.29 499.19 798.96 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.66 384.78 437.43 466.53 485.71 797.86 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.20 376.07 444.87 468.72 478.14 798.03 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.86 364.48 450.96 465.17 479.01 798.76 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.06 354.20 455.47 460.22 482.85 799.24 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.27 350.31 456.11 459.14 486.25 798.78 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.31 351.52 455.29 460.43 488.44 796.87 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.77 352.78 457.25 460.32 489.11 793.23 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.26 359.12 458.14 462.76 488.23 787.87 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.45 372.67 454.77 470.66 486.01 781.08 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.96 388.69 449.77 479.71 484.22 773.45 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.32 403.49 443.28 478.50 494.90 765.89 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.81 412.63 435.43 475.99 510.51 759.57 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.74 413.14 426.42 473.77 529.69 755.70 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.46 405.88 416.61 469.27 551.90 755.18 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.28 393.45 406.32 460.47 575.53 758.22 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.52 378.00 395.72 447.32 598.86 764.32 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.43 360.93 385.16 431.05 620.46 772.57 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.13 343.44 375.18 413.28 639.17 781.99 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.59 326.77 366.45 395.68 654.06 791.75 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.60 312.26 359.77 379.77 664.45 801.21 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.92 301.19 355.96 366.84 669.91 809.82 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.72 294.34 355.16 358.37 670.34 817.07 -------------------------------------------------------------------------------- K point *** = 0.453125 0.953125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.90 291.54 352.88 359.67 665.88 822.51 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.42 285.32 354.09 358.37 651.19 838.22 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.10 290.43 359.22 365.26 638.00 841.91 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.17 299.87 367.79 375.23 621.49 842.76 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.81 312.52 377.59 388.64 602.22 841.03 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.04 327.06 387.65 404.31 580.82 837.23 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.69 342.12 397.75 420.27 558.14 832.09 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.51 356.25 407.70 434.76 535.24 826.47 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.15 367.79 417.24 446.47 513.66 821.23 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.20 374.69 426.15 454.87 495.38 817.03 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.29 374.99 434.22 460.48 482.25 814.12 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.05 368.70 441.27 463.85 475.09 812.35 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.14 358.87 447.12 462.70 475.30 811.15 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.30 349.41 451.66 459.10 479.47 809.81 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.29 343.33 454.77 456.42 483.74 807.62 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.26 343.18 455.85 456.41 486.97 804.01 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.37 347.44 456.45 458.20 488.71 798.65 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.34 358.08 454.96 463.70 488.82 791.43 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.94 373.23 451.92 472.28 487.36 782.55 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.28 390.81 447.39 482.74 485.55 772.50 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.53 407.67 441.44 480.98 498.00 762.14 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.90 419.39 434.21 478.53 514.62 752.71 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.65 422.06 425.83 477.40 534.24 745.68 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.05 416.02 416.52 474.99 556.45 742.49 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.42 404.16 406.60 468.11 579.82 743.92 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.02 388.85 396.22 456.00 602.63 749.85 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.10 371.33 385.82 439.77 623.34 759.40 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.80 352.68 375.87 421.26 640.76 771.41 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.12 334.02 366.93 402.37 654.06 784.73 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.91 316.66 359.68 384.85 662.75 798.30 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.91 302.04 354.82 370.19 666.66 811.17 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.90 291.54 352.88 359.67 665.88 822.51 -------------------------------------------------------------------------------- K point *** = 0.453125 0.984375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.07 286.04 353.54 354.73 660.62 831.68 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.04 287.31 352.27 354.23 667.78 825.47 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.84 290.40 355.00 359.28 658.70 828.75 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.53 298.25 361.61 368.09 645.50 829.66 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.44 309.90 370.15 380.94 628.72 828.23 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.76 324.13 379.63 396.74 608.99 824.76 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.48 339.63 389.61 413.70 587.04 819.82 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.43 355.07 399.75 429.99 563.76 814.18 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.36 369.03 409.74 443.99 540.30 808.75 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.91 379.84 419.29 454.63 518.27 804.40 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.71 385.34 428.16 461.75 499.69 801.69 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.39 383.61 436.14 466.36 486.22 800.69 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.62 375.19 443.03 468.80 478.71 801.01 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.08 363.63 448.68 465.73 479.37 801.92 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.52 352.87 452.96 460.89 483.23 802.58 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.74 345.80 455.77 457.48 486.73 802.26 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.88 344.81 456.51 457.08 488.99 800.44 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.18 348.26 456.80 458.57 489.70 796.83 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.34 358.08 454.96 463.70 488.82 791.43 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.15 372.27 451.59 471.59 486.57 784.55 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.76 388.53 446.74 480.32 484.93 776.77 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.34 403.40 440.51 478.92 495.57 769.04 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.14 412.36 433.04 476.42 511.01 762.55 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.42 412.48 424.47 474.08 530.14 758.55 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.51 404.89 415.05 469.15 552.45 757.95 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.70 392.30 405.03 459.64 576.28 760.97 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.31 376.69 394.68 445.62 599.84 767.09 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.58 359.39 384.37 428.40 621.67 775.37 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.67 341.53 374.55 409.76 640.60 784.82 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.59 324.32 365.79 391.53 655.69 794.60 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.18 309.11 358.75 375.37 666.22 804.08 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.16 297.26 354.13 362.75 671.79 812.72 -------------------------------------------------------------------------------- K point *** = 0.484375 0.015625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.23 289.97 352.51 354.85 672.25 820.00 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.84 290.40 355.00 359.28 658.70 828.75 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.99 289.24 353.06 364.99 649.34 835.26 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.95 294.35 355.92 373.52 636.25 838.93 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.10 303.86 362.78 384.47 619.88 839.79 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.86 316.41 372.32 397.37 600.76 838.11 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.27 330.74 383.23 411.45 579.54 834.38 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.18 345.52 394.53 425.56 557.03 829.32 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.31 359.31 405.63 438.33 534.34 823.78 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.31 370.44 416.19 448.64 512.97 818.59 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.75 376.85 425.98 456.02 494.87 814.38 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.22 376.62 434.81 461.04 481.82 811.41 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.32 369.94 442.51 464.07 474.62 809.50 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.65 359.97 448.90 462.39 475.04 808.13 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.60 350.91 453.72 458.63 479.22 806.61 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.77 347.84 454.99 457.99 483.38 804.25 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.71 349.83 454.63 459.61 486.50 800.52 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.94 351.96 456.86 459.92 488.16 795.09 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.26 359.12 458.14 462.76 488.23 787.87 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.29 373.58 455.21 471.31 486.78 779.05 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.59 390.85 450.62 482.03 484.85 769.11 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.64 407.53 444.53 480.49 497.28 758.91 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.74 419.26 437.05 478.01 514.09 749.64 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.16 422.24 428.30 476.86 533.82 742.78 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.21 416.64 418.54 474.70 555.98 739.69 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.20 404.71 408.66 468.35 579.18 741.18 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.43 389.49 398.17 456.98 601.75 747.12 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.12 372.24 387.58 441.56 622.20 756.66 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.40 354.00 377.50 423.80 639.37 768.67 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.23 335.94 368.61 405.49 652.45 781.97 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.40 319.38 361.69 388.20 660.97 795.52 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.67 305.74 357.52 373.31 664.78 808.35 -------------------------------------------------------------------------------- K point *** = 0.484375 0.046875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.13 296.07 356.64 361.98 663.95 819.64 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.53 298.25 361.61 368.09 645.50 829.66 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.95 294.35 355.92 373.52 636.25 838.93 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.60 296.54 354.32 381.94 623.64 845.06 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.97 303.96 357.25 392.29 608.01 848.06 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.04 314.82 364.10 403.88 589.82 848.17 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.05 327.75 373.80 416.00 569.63 845.81 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.90 341.49 385.18 427.80 548.22 841.61 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.32 354.62 397.22 438.39 526.62 836.34 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.90 365.50 409.19 446.97 506.29 830.75 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.17 372.10 420.56 453.26 489.12 825.47 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.61 372.58 430.97 457.78 476.77 820.87 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.57 367.19 440.09 461.17 469.76 816.94 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.08 359.39 447.42 460.70 470.10 813.35 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.83 354.84 451.38 459.53 474.62 809.57 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.62 356.32 451.19 461.86 479.24 805.04 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.25 359.58 451.25 464.34 482.96 799.26 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.34 362.55 453.72 465.51 485.35 791.90 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.57 366.24 458.86 465.52 486.26 782.81 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.31 376.21 460.97 470.22 485.62 772.10 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.65 392.63 457.32 482.18 483.70 760.12 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.52 410.06 451.63 480.58 497.93 747.60 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.92 423.98 444.37 477.82 516.47 735.64 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.33 429.71 435.94 476.94 537.42 725.77 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.12 424.54 427.91 477.09 559.82 719.82 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.62 413.69 418.11 474.46 582.19 719.36 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.14 400.51 406.21 466.76 602.91 725.04 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.87 384.66 394.52 454.26 620.69 736.22 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.89 367.16 383.81 438.44 634.77 751.35 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.11 349.38 374.62 421.02 644.85 768.54 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.37 332.65 367.76 403.54 650.90 786.10 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.71 318.11 363.95 387.33 652.97 802.72 -------------------------------------------------------------------------------- K point *** = 0.484375 0.078125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.78 306.51 363.38 373.73 651.13 817.46 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.44 309.90 370.15 380.94 628.72 828.23 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.10 303.86 362.78 384.47 619.88 839.79 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.97 303.96 357.25 392.29 608.01 848.06 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.14 309.90 355.82 401.97 593.38 853.05 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.90 319.65 358.72 412.59 576.34 854.94 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.89 331.54 365.46 423.35 557.43 854.09 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.14 344.30 375.10 433.48 537.39 851.04 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.41 356.65 386.53 442.24 517.22 846.42 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.26 366.94 398.79 449.07 498.41 840.91 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.10 373.17 411.14 453.90 482.83 835.08 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.18 373.67 422.92 457.55 471.95 829.31 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.43 369.28 433.39 461.46 465.38 823.69 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.01 364.29 441.46 461.93 466.33 818.06 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.13 363.64 445.42 462.30 471.47 812.06 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.22 367.20 445.93 465.87 476.16 805.27 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.65 371.90 446.45 469.79 479.86 797.29 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.37 376.20 449.05 472.60 482.31 787.82 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.99 380.06 454.49 473.97 483.47 776.73 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.50 385.39 461.83 475.09 483.34 764.07 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.09 396.37 464.52 481.89 482.69 750.09 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 364.73 411.91 460.76 479.38 498.44 735.37 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.15 426.58 454.31 476.39 518.49 720.82 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.76 435.02 446.44 474.80 541.07 707.92 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.24 432.55 438.68 476.03 564.39 698.76 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.07 422.66 429.59 476.87 586.18 695.91 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.58 410.42 417.79 473.49 604.17 701.44 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.99 396.43 405.07 464.92 617.46 715.11 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.37 380.75 393.26 452.10 626.76 734.10 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.65 364.26 383.43 436.62 632.99 755.27 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.89 348.11 376.36 420.02 636.42 776.38 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.54 333.19 372.58 403.66 636.95 796.09 -------------------------------------------------------------------------------- K point *** = 0.484375 0.109375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.47 320.18 371.81 389.08 634.41 813.56 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.76 324.13 379.63 396.74 608.99 824.76 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.86 316.41 372.32 397.37 600.76 838.11 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.04 314.82 364.10 403.88 589.82 848.17 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.90 319.65 358.72 412.59 576.34 854.94 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.87 328.87 357.30 422.14 560.65 858.57 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.04 340.37 360.11 431.63 543.23 859.34 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.79 352.55 366.76 440.28 524.83 857.67 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.03 364.17 376.26 447.41 506.52 854.09 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.33 373.79 387.40 452.59 489.91 849.14 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.03 379.07 399.52 455.90 477.05 843.30 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.19 378.55 411.89 458.18 469.32 836.90 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.38 374.10 423.38 459.52 467.11 830.08 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.63 370.54 432.56 459.26 470.20 822.75 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.94 371.69 437.74 460.90 475.02 814.72 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.92 376.84 439.33 465.38 479.62 805.70 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.12 383.36 440.32 470.58 483.29 795.42 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.33 389.61 442.96 475.03 485.70 783.68 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.50 394.94 448.33 478.18 486.90 770.40 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.02 399.65 456.47 479.79 487.57 755.62 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.41 405.63 465.00 479.41 490.76 739.56 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.23 415.56 468.01 477.20 502.23 722.66 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.87 428.19 464.58 474.17 521.74 705.67 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.64 438.57 457.87 471.49 545.33 689.80 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.19 440.58 449.71 472.06 569.95 677.15 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.41 433.30 440.44 475.31 591.78 671.39 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.82 421.99 429.23 476.19 606.00 677.46 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.74 409.03 416.71 472.22 612.28 695.24 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.30 394.96 404.38 463.39 615.25 718.66 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.63 380.01 393.95 450.91 617.23 743.27 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.06 364.68 386.55 436.27 618.17 767.02 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.34 349.68 382.55 420.89 617.45 788.89 -------------------------------------------------------------------------------- K point *** = 0.484375 0.140625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.39 335.81 381.32 406.43 614.50 808.27 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.48 339.63 389.61 413.70 587.04 819.82 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.27 330.74 383.23 411.45 579.54 834.38 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.05 327.75 373.80 416.00 569.63 845.81 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.89 331.54 365.46 423.35 557.43 854.09 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.04 340.37 360.11 431.63 543.23 859.34 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.02 351.88 358.57 439.75 527.53 861.76 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.61 360.74 364.41 446.88 511.12 861.66 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.99 366.93 375.51 452.37 495.30 859.45 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.89 376.06 383.45 455.86 482.07 855.51 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.70 385.65 387.56 457.44 473.80 850.20 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.39 382.47 399.61 457.55 471.62 843.76 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.48 376.53 411.65 456.44 474.36 836.30 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.99 372.95 421.98 455.42 479.49 827.77 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.11 374.81 428.74 456.78 485.04 818.08 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.04 381.28 431.57 461.38 490.07 807.05 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.93 389.81 433.01 467.18 494.24 794.54 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.49 398.54 435.58 472.17 497.56 780.47 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.87 406.35 440.66 475.47 500.24 764.83 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.97 412.67 448.73 476.90 502.74 747.72 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.69 417.80 458.87 476.58 506.35 729.38 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.90 423.29 467.62 474.76 514.18 710.20 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 382.36 431.15 470.67 471.70 529.72 690.79 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 381.55 440.63 467.70 468.13 551.90 672.11 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.35 446.60 460.92 466.44 576.97 655.86 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.49 443.32 451.31 470.38 599.22 646.67 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.03 434.25 439.90 474.72 606.89 655.99 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.56 422.62 427.63 475.32 603.59 680.01 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.43 409.68 415.49 471.10 600.12 707.07 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.02 395.80 405.01 462.52 598.25 733.72 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.95 381.14 397.47 450.83 597.07 758.84 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.14 366.30 393.17 437.43 595.37 781.80 -------------------------------------------------------------------------------- K point *** = 0.484375 0.171875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.52 352.09 391.39 424.02 592.22 802.23 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.43 355.07 399.75 429.99 563.76 814.18 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.18 345.52 394.53 425.56 557.03 829.32 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.90 341.49 385.18 427.80 548.22 841.61 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.14 344.30 375.10 433.48 537.39 851.04 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.79 352.55 366.76 440.28 524.83 857.67 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.61 360.74 364.41 446.88 511.12 861.66 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.76 359.45 375.72 452.39 497.29 863.23 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.76 361.69 385.41 456.19 485.09 862.61 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.62 367.56 390.27 457.91 477.20 860.06 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.86 376.38 388.40 457.63 475.71 855.77 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.58 381.09 387.62 455.77 479.71 849.86 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.32 373.46 399.26 453.02 486.43 842.36 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.18 369.29 410.34 450.73 493.72 833.23 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.15 371.24 418.64 450.99 500.42 822.41 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.93 378.54 422.80 455.34 506.04 809.81 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.37 388.68 424.69 462.06 510.53 795.38 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.16 399.69 427.10 468.48 514.14 779.12 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.51 410.34 431.67 473.01 517.38 761.12 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.59 419.58 439.24 475.04 520.89 741.55 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.87 426.73 449.65 474.70 525.52 720.71 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.36 432.12 460.79 472.64 532.74 699.02 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 383.62 437.06 467.73 470.92 544.85 677.07 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 388.25 443.20 464.81 472.82 563.22 655.66 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 386.55 450.21 460.98 469.97 586.51 635.97 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 380.02 450.42 460.83 464.85 607.65 623.84 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 370.44 443.54 451.03 470.28 599.94 645.03 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.03 434.60 438.24 474.39 589.18 673.10 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.56 424.28 425.13 474.53 581.63 700.99 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.74 410.48 415.73 470.30 577.05 727.73 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.47 396.22 408.48 462.29 574.23 752.77 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.81 381.79 403.90 451.69 571.77 775.71 -------------------------------------------------------------------------------- K point *** = 0.484375 0.203125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.69 367.74 401.62 440.08 568.53 796.25 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.36 369.03 409.74 443.99 540.30 808.75 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.31 359.31 405.63 438.33 534.34 823.78 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.32 354.62 397.22 438.39 526.62 836.34 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.41 356.65 386.53 442.24 517.22 846.42 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.03 364.17 376.26 447.41 506.52 854.09 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.99 366.93 375.51 452.37 495.30 859.45 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.76 361.69 385.41 456.19 485.09 862.61 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.20 359.84 391.77 458.23 478.46 863.69 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.59 361.83 391.39 458.15 478.14 862.77 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.74 367.38 384.63 456.04 483.92 859.87 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.95 373.31 377.46 452.41 492.95 854.97 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.95 365.27 387.03 448.03 502.79 848.01 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.89 360.48 398.12 444.13 512.03 838.91 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.52 362.14 407.65 442.77 519.98 827.60 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.97 369.71 413.22 446.27 526.38 814.03 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.81 380.77 415.55 453.88 531.26 798.21 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.67 393.31 417.74 462.36 534.95 780.21 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.80 406.10 421.73 469.37 538.12 760.17 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.49 418.26 428.39 473.63 541.68 738.31 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.49 428.50 438.31 474.58 546.65 714.96 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.36 436.41 450.41 472.49 554.04 690.57 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 378.62 442.65 461.43 468.69 564.87 665.78 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 387.48 447.78 462.06 470.99 580.11 641.44 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 390.95 452.86 457.22 473.63 599.87 618.64 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 388.10 452.25 458.70 470.92 598.54 623.19 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 380.02 446.62 461.12 467.03 582.11 648.62 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.61 439.78 450.63 471.54 569.64 674.85 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.38 431.52 437.98 474.43 560.80 700.89 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.57 421.03 426.94 473.92 554.90 726.01 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.39 408.22 419.32 469.70 551.02 749.70 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.09 394.76 414.38 462.36 547.99 771.55 -------------------------------------------------------------------------------- K point *** = 0.484375 0.234375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.65 381.39 411.65 453.11 544.69 791.30 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.91 379.84 419.29 454.63 518.27 804.40 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.31 370.44 416.19 448.64 512.97 818.59 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.90 365.50 409.19 446.97 506.29 830.75 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.26 366.94 398.79 449.07 498.41 840.91 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.33 373.79 387.40 452.59 489.91 849.14 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.89 376.06 383.45 455.86 482.07 855.51 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.62 367.56 390.27 457.91 477.20 860.06 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.59 361.83 391.39 458.15 478.14 862.77 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 274.39 359.71 385.68 456.24 485.50 863.55 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.11 361.40 375.64 452.38 496.79 862.27 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.34 363.24 367.88 447.05 509.36 858.74 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.10 354.05 375.68 441.02 521.57 852.80 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.72 348.59 385.91 435.41 532.52 844.30 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.68 349.62 396.06 432.09 541.74 833.15 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.55 356.98 403.03 433.97 549.03 819.30 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.59 368.38 405.83 441.90 554.45 802.81 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.36 381.72 407.72 452.36 558.29 783.76 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.10 395.72 411.24 462.32 561.19 762.34 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.13 409.71 417.23 470.00 564.12 738.79 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.34 423.22 425.62 474.21 568.39 713.44 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.62 433.62 437.85 474.36 575.22 686.72 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.99 442.18 450.80 470.77 585.41 659.23 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 380.50 449.45 460.66 465.75 599.18 631.85 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 387.79 453.91 457.48 470.59 604.53 617.51 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 390.04 448.27 461.14 473.36 581.33 637.29 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 385.97 442.73 465.21 470.87 562.09 659.48 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.36 437.81 461.31 470.61 548.27 682.67 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.40 432.08 450.08 473.57 539.20 705.94 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.15 424.55 438.74 474.80 533.24 728.59 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.38 414.74 429.97 473.34 529.07 750.08 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.65 403.30 424.34 468.97 525.73 770.03 -------------------------------------------------------------------------------- K point *** = 0.484375 0.265625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.05 391.31 421.19 462.27 522.37 788.19 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.71 385.34 428.16 461.75 499.69 801.69 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.75 376.85 425.98 456.02 494.87 814.38 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.17 372.10 420.56 453.26 489.12 825.47 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.10 373.17 411.14 453.90 482.83 835.08 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.03 379.07 399.52 455.90 477.05 843.30 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.70 385.65 387.56 457.44 473.80 850.20 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.86 376.38 388.40 457.63 475.71 855.77 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 279.74 367.38 384.63 456.04 483.92 859.87 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.11 361.40 375.64 452.38 496.79 862.27 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 275.31 359.06 364.03 446.82 511.72 862.66 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.26 351.95 360.76 439.88 526.85 860.72 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.32 341.67 366.11 432.29 541.00 856.15 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.12 335.44 374.47 425.05 553.52 848.72 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.04 335.53 384.30 419.69 563.98 838.31 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.05 342.24 392.46 419.25 572.22 824.87 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.08 353.47 395.82 426.63 578.24 808.45 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.60 367.06 397.31 438.58 582.27 789.20 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.76 381.60 400.41 451.16 584.82 767.32 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.88 396.23 406.34 462.35 586.74 743.10 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.92 410.35 415.21 470.66 589.30 716.93 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.01 423.37 426.47 474.90 593.85 689.38 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.51 434.63 439.08 474.51 601.04 661.56 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.94 443.85 451.28 470.13 607.21 638.18 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 378.62 449.23 461.46 464.78 593.57 638.51 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 384.44 445.71 464.59 469.05 568.82 654.27 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 385.65 437.54 468.23 472.02 545.90 673.56 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 380.56 430.63 468.36 472.37 528.75 694.03 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.75 425.48 459.94 474.66 518.67 714.64 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.99 420.26 449.17 475.84 513.31 734.69 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.08 413.50 439.86 475.29 509.84 753.68 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.14 404.94 433.54 472.63 506.82 771.29 -------------------------------------------------------------------------------- K point *** = 0.484375 0.296875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.54 395.21 429.99 467.88 503.59 787.32 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.39 383.61 436.14 466.36 486.22 800.69 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.22 376.62 434.81 461.04 481.82 811.41 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.61 372.58 430.97 457.78 476.77 820.87 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.18 373.67 422.92 457.55 471.95 829.31 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.19 378.55 411.89 458.18 469.32 836.90 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.39 382.47 399.61 457.55 471.62 843.76 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.58 381.09 387.62 455.77 479.71 849.86 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.95 373.31 377.46 452.41 492.95 854.97 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.34 363.24 367.88 447.05 509.36 858.74 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 277.26 351.95 360.76 439.88 526.85 860.72 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 276.88 340.01 357.97 431.43 543.98 860.42 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.93 329.48 359.43 422.43 559.84 857.43 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.47 322.51 364.79 413.78 573.79 851.44 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.93 321.41 373.08 406.65 585.46 842.27 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.79 327.01 381.80 403.56 594.62 829.84 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.58 337.54 385.82 409.39 601.23 814.24 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.67 350.83 386.83 422.13 605.40 795.63 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.07 365.48 389.49 436.66 607.48 774.30 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.02 380.53 395.30 450.73 608.08 750.64 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.57 395.23 404.43 462.87 608.07 725.27 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.06 409.13 416.07 471.62 608.33 699.31 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.14 422.15 428.55 475.76 608.34 675.35 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.63 433.77 440.40 474.99 602.73 660.35 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.20 442.20 450.82 471.03 585.06 661.39 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.31 443.02 459.56 468.90 560.71 673.09 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 377.97 434.84 466.31 471.21 536.08 689.30 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 378.50 423.85 469.53 474.48 515.05 707.21 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 372.79 414.94 466.43 477.17 501.46 725.42 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.39 409.11 457.67 478.35 495.95 743.08 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.06 404.13 448.42 477.79 493.89 759.66 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.21 398.29 441.67 475.49 492.14 774.87 -------------------------------------------------------------------------------- K point *** = 0.484375 0.328125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.77 391.26 437.84 471.55 489.67 788.54 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.62 375.19 443.03 468.80 478.71 801.01 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.32 369.94 442.51 464.07 474.62 809.50 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.57 367.19 440.09 461.17 469.76 816.94 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.43 369.28 433.39 461.46 465.38 823.69 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.38 374.10 423.38 459.52 467.11 830.08 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.48 376.53 411.65 456.44 474.36 836.30 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.32 373.46 399.26 453.02 486.43 842.36 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.95 365.27 387.03 448.03 502.79 848.01 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.10 354.05 375.68 441.02 521.57 852.80 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.32 341.67 366.11 432.29 541.00 856.15 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.93 329.48 359.43 422.43 559.84 857.43 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 278.96 318.76 356.58 412.21 577.20 856.13 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.93 311.09 357.98 402.42 592.48 851.82 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.57 308.59 363.42 393.99 605.26 844.26 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.98 312.65 371.44 388.57 615.27 833.39 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.32 321.91 376.24 391.84 622.36 819.27 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.79 334.35 376.68 404.62 626.54 802.12 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.21 348.70 378.96 420.20 627.96 782.33 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.71 364.16 384.52 436.25 626.90 760.47 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.46 379.98 393.32 451.37 623.75 737.48 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.09 395.32 404.64 464.09 618.65 715.01 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.52 409.46 417.31 472.86 610.75 696.10 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.73 422.16 429.61 476.58 597.72 685.21 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.54 432.91 439.89 475.65 578.39 684.80 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.64 438.32 448.12 473.35 555.12 692.81 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.52 433.14 456.06 474.01 531.17 705.77 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.39 420.55 462.69 476.89 509.14 721.07 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.70 406.31 466.31 479.68 491.44 737.00 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.92 395.63 463.44 481.19 482.32 752.48 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.82 389.81 455.37 478.92 482.92 766.87 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.52 385.49 448.52 476.66 482.92 779.82 -------------------------------------------------------------------------------- K point *** = 0.484375 0.359375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.43 380.68 444.54 473.27 481.53 791.18 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.08 363.63 448.68 465.73 479.37 801.92 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.65 359.97 448.90 462.39 475.04 808.13 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.08 359.39 447.42 460.70 470.10 813.35 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.01 364.29 441.46 461.93 466.33 818.06 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.63 370.54 432.56 459.26 470.20 822.75 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.99 372.95 421.98 455.42 479.49 827.77 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.18 369.29 410.34 450.73 493.72 833.23 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.89 360.48 398.12 444.13 512.03 838.91 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.72 348.59 385.91 435.41 532.52 844.30 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.12 335.44 374.47 425.05 553.52 848.72 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.47 322.51 364.79 413.78 573.79 851.44 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 280.93 311.09 357.98 402.42 592.48 851.82 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 281.36 302.47 355.06 391.76 608.94 849.35 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.99 298.38 356.55 382.53 622.69 843.73 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.70 300.49 362.19 375.68 633.39 834.86 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.39 307.91 367.52 375.80 640.80 822.83 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.05 318.87 367.40 387.77 644.77 807.91 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.22 332.52 369.50 403.33 645.25 790.59 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.94 348.26 374.90 420.30 642.24 771.60 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.69 365.27 383.21 437.36 635.76 752.08 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.41 382.37 393.66 453.08 625.71 733.71 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.24 398.22 405.60 465.83 611.87 718.78 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.18 411.86 418.10 474.04 594.16 709.68 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.11 423.47 429.06 477.05 573.22 707.75 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.75 431.86 437.03 476.46 550.59 712.54 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.77 430.28 445.12 476.32 528.12 722.26 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.74 418.83 452.80 478.59 507.41 734.81 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.08 402.48 458.93 481.61 489.57 748.42 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.57 386.16 462.70 475.68 483.91 761.83 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.33 375.42 460.27 469.70 484.92 774.21 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.76 370.84 453.91 469.38 484.48 785.10 -------------------------------------------------------------------------------- K point *** = 0.484375 0.390625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.22 367.46 449.95 468.27 482.59 794.32 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.52 352.87 452.96 460.89 483.23 802.58 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.60 350.91 453.72 458.63 479.22 806.61 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.83 354.84 451.38 459.53 474.62 809.57 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.13 363.64 445.42 462.30 471.47 812.06 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.94 371.69 437.74 460.90 475.02 814.72 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.11 374.81 428.74 456.78 485.04 818.08 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.15 371.24 418.64 450.99 500.42 822.41 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.52 362.14 407.65 442.77 519.98 827.60 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.68 349.62 396.06 432.09 541.74 833.15 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.04 335.53 384.30 419.69 563.98 838.31 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.93 321.41 373.08 406.65 585.46 842.27 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.57 308.59 363.42 393.99 605.26 844.26 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 282.99 298.38 356.55 382.53 622.69 843.73 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 283.83 292.14 353.64 372.89 637.21 840.30 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.88 291.77 355.39 365.64 648.38 833.85 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.69 296.83 360.20 362.95 655.83 824.47 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.36 305.70 359.67 373.17 659.29 812.49 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.95 318.20 361.97 387.49 658.53 798.44 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.68 333.82 367.47 404.25 653.41 783.12 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.48 351.41 375.50 422.19 643.88 767.57 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.56 369.64 385.25 439.86 630.07 753.04 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.08 387.21 395.95 455.59 612.41 740.97 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.02 402.94 407.02 467.63 591.72 732.78 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.20 415.85 417.75 474.68 569.25 729.55 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.38 424.98 426.87 477.02 546.56 731.59 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.25 425.35 436.10 477.46 525.19 738.20 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.47 416.28 444.18 479.24 506.20 747.89 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.72 400.59 450.89 482.26 489.96 759.07 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.65 382.85 456.06 476.27 485.34 770.36 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.49 367.05 459.41 466.00 487.07 780.80 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.39 358.30 457.69 462.32 487.34 789.79 -------------------------------------------------------------------------------- K point *** = 0.484375 0.421875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.93 355.48 453.95 462.27 486.03 797.06 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.74 345.80 455.77 457.48 486.73 802.26 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.77 347.84 454.99 457.99 483.38 804.25 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.62 356.32 451.19 461.86 479.24 805.04 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.22 367.20 445.93 465.87 476.16 805.27 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.92 376.84 439.33 465.38 479.62 805.70 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.04 381.28 431.57 461.38 490.07 807.05 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.93 378.54 422.80 455.34 506.04 809.81 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.97 369.71 413.22 446.27 526.38 814.03 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.55 356.98 403.03 433.97 549.03 819.30 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.05 342.24 392.46 419.25 572.22 824.87 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.79 327.01 381.80 403.56 594.62 829.84 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 285.98 312.65 371.44 388.57 615.27 833.39 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.70 300.49 362.19 375.68 633.39 834.86 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 284.88 291.77 355.39 365.64 648.38 833.85 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.08 287.70 352.59 358.64 659.67 830.20 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.98 289.86 354.73 354.87 666.81 824.00 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.47 296.10 354.37 362.09 669.41 815.59 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.25 306.92 357.25 373.99 667.18 805.46 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.14 321.55 363.05 389.49 660.01 794.24 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.41 338.62 371.06 407.29 648.06 782.65 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.31 356.74 380.53 425.87 631.76 771.45 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.94 374.63 390.78 443.50 611.89 761.55 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.22 391.18 401.27 458.35 589.51 753.95 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.95 405.21 411.54 468.88 565.94 749.69 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.88 415.02 421.33 474.49 542.82 749.44 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.68 417.94 430.46 476.66 521.90 753.15 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.04 411.82 438.55 478.53 504.21 759.97 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.68 398.13 445.38 481.36 489.75 768.57 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.33 381.28 450.85 476.69 485.57 777.63 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.79 365.23 454.83 467.16 487.94 786.09 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.77 352.78 457.25 460.32 489.11 793.23 -------------------------------------------------------------------------------- K point *** = 0.484375 0.453125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.37 347.44 456.45 458.20 488.71 798.65 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.88 344.81 456.51 457.08 488.99 800.44 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.71 349.83 454.63 459.61 486.50 800.52 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.25 359.58 451.25 464.34 482.96 799.26 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.65 371.90 446.45 469.79 479.86 797.29 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.12 383.36 440.32 470.58 483.29 795.42 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.93 389.81 433.01 467.18 494.24 794.54 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.37 388.68 424.69 462.06 510.53 795.38 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.81 380.77 415.55 453.88 531.26 798.21 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.59 368.38 405.83 441.90 554.45 802.81 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.08 353.47 395.82 426.63 578.24 808.45 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.58 337.54 385.82 409.39 601.23 814.24 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.32 321.91 376.24 391.84 622.36 819.27 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.39 307.91 367.52 375.80 640.80 822.83 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.69 296.83 360.20 362.95 655.83 824.47 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.98 289.86 354.73 354.87 666.81 824.00 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.86 287.86 352.12 352.12 673.21 821.49 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.98 291.14 352.36 355.42 674.62 817.14 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.27 299.45 355.62 364.29 670.83 811.28 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.90 311.94 361.51 377.78 661.94 804.23 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.19 327.40 369.40 394.56 648.32 796.33 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.36 344.49 378.65 413.02 630.63 788.01 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.47 361.92 388.66 431.39 609.72 779.90 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.44 378.50 398.96 447.85 586.60 772.84 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.05 393.01 409.15 460.76 562.53 767.83 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.01 403.90 418.89 469.16 539.11 765.72 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.00 408.91 427.91 473.52 518.22 766.84 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.69 405.59 435.99 476.16 501.27 770.84 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.79 394.36 442.93 478.89 488.33 776.76 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.03 379.14 448.59 475.44 484.56 783.44 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.19 364.15 452.85 467.12 487.36 789.79 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.11 352.36 455.62 460.84 489.41 795.02 -------------------------------------------------------------------------------- K point *** = 0.484375 0.484375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.69 345.62 456.84 457.43 490.00 798.64 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.18 348.26 456.80 458.57 489.70 796.83 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.94 351.96 456.86 459.92 488.16 795.09 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.34 362.55 453.72 465.51 485.35 791.90 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.37 376.20 449.05 472.60 482.31 787.82 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.33 389.61 442.96 475.03 485.70 783.68 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.49 398.54 435.58 472.17 497.56 780.47 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.16 399.69 427.10 468.48 514.14 779.12 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.67 393.31 417.74 462.36 534.95 780.21 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.36 381.72 407.72 452.36 558.29 783.76 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.60 367.06 397.31 438.58 582.27 789.20 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.67 350.83 386.83 422.13 605.40 795.63 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.79 334.35 376.68 404.62 626.54 802.12 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.05 318.87 367.40 387.77 644.77 807.91 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.36 305.70 359.67 373.17 659.29 812.49 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.47 296.10 354.37 362.09 669.41 815.59 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.98 291.14 352.36 355.42 674.62 817.14 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.98 291.14 352.36 355.42 674.62 817.14 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.47 296.10 354.37 362.09 669.41 815.59 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.36 305.70 359.67 373.17 659.29 812.49 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.05 318.87 367.40 387.77 644.77 807.91 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.79 334.35 376.68 404.62 626.54 802.12 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.67 350.83 386.83 422.13 605.40 795.63 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.60 367.06 397.31 438.58 582.27 789.20 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.36 381.72 407.72 452.36 558.29 783.76 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.67 393.31 417.74 462.36 534.95 780.21 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.16 399.69 427.10 468.48 514.14 779.12 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.49 398.54 435.58 472.17 497.56 780.47 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.33 389.61 442.96 475.03 485.70 783.68 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.37 376.20 449.05 472.60 482.31 787.82 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.34 362.55 453.72 465.51 485.35 791.90 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.94 351.96 456.86 459.92 488.16 795.09 -------------------------------------------------------------------------------- K point *** = 0.484375 0.515625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.18 348.26 456.80 458.57 489.70 796.83 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.34 358.08 454.96 463.70 488.82 791.43 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.26 359.12 458.14 462.76 488.23 787.87 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.57 366.24 458.86 465.52 486.26 782.81 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.99 380.06 454.49 473.97 483.47 776.73 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.50 394.94 448.33 478.18 486.90 770.40 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.87 406.35 440.66 475.47 500.24 764.83 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.51 410.34 431.67 473.01 517.38 761.12 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.80 406.10 421.73 469.37 538.12 760.17 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.10 395.72 411.24 462.32 561.19 762.34 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.76 381.60 400.41 451.16 584.82 767.32 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.07 365.48 389.49 436.66 607.48 774.30 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.21 348.70 378.96 420.20 627.96 782.33 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.22 332.52 369.50 403.33 645.25 790.59 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.95 318.20 361.97 387.49 658.53 798.44 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.25 306.92 357.25 373.99 667.18 805.46 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.27 299.45 355.62 364.29 670.83 811.28 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.47 296.10 354.37 362.09 669.41 815.59 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.42 297.66 353.31 367.85 663.11 818.08 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.74 304.33 355.95 377.57 652.31 818.54 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.00 314.97 362.28 390.01 637.55 816.93 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.48 328.42 371.30 404.30 619.43 813.45 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.29 343.46 381.92 419.38 598.67 808.53 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.38 358.83 393.22 433.97 576.07 802.88 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.55 373.16 404.59 446.73 552.69 797.36 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.49 384.90 415.61 456.59 529.90 792.82 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.79 392.00 426.00 463.23 509.51 789.94 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.07 392.25 435.52 467.51 493.30 788.93 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.90 385.16 443.90 470.60 482.11 789.51 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.81 373.61 450.89 469.04 478.94 791.03 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.00 362.17 456.12 463.24 482.16 792.65 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.66 356.66 456.80 461.46 485.55 793.61 -------------------------------------------------------------------------------- K point *** = 0.484375 0.546875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.54 357.22 454.62 463.22 487.89 793.32 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.15 372.27 451.59 471.59 486.57 784.55 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.29 373.58 455.21 471.31 486.78 779.05 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.31 376.21 460.97 470.22 485.62 772.10 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.50 385.39 461.83 475.09 483.34 764.07 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.02 399.65 456.47 479.79 487.57 755.62 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.97 412.67 448.73 476.90 502.74 747.72 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.59 419.58 439.24 475.04 520.89 741.55 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.49 418.26 428.39 473.63 541.68 738.31 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.13 409.71 417.23 470.00 564.12 738.79 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.88 396.23 406.34 462.35 586.74 743.10 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.02 380.53 395.30 450.73 608.08 750.64 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.71 364.16 384.52 436.25 626.90 760.47 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.94 348.26 374.90 420.30 642.24 771.60 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.68 333.82 367.47 404.25 653.41 783.12 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.14 321.55 363.05 389.49 660.01 794.24 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.90 311.94 361.51 377.78 661.94 804.23 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.36 305.70 359.67 373.17 659.29 812.49 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.74 304.33 355.95 377.57 652.31 818.54 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.25 308.65 354.81 386.44 641.37 822.11 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.67 317.31 357.75 397.68 626.88 823.15 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.63 328.83 364.51 410.24 609.37 821.81 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.26 342.17 374.14 423.17 589.43 818.49 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.50 356.23 385.50 435.50 567.81 813.83 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.13 369.74 397.64 446.25 545.46 808.57 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.80 381.10 409.87 454.65 523.69 803.53 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.07 388.26 421.75 460.50 504.22 799.35 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.38 389.16 432.86 464.53 488.77 796.38 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.07 383.49 442.70 467.89 478.08 794.56 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.97 374.52 450.52 467.78 474.83 793.47 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.58 368.23 454.22 465.35 478.39 792.51 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.23 368.11 452.64 467.52 482.15 791.03 -------------------------------------------------------------------------------- K point *** = 0.484375 0.578125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.58 370.34 450.93 470.24 484.99 788.50 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.76 388.53 446.74 480.32 484.93 776.77 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.59 390.85 450.62 482.03 484.85 769.11 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.65 392.63 457.32 482.18 483.70 760.12 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.09 396.37 464.52 481.89 482.69 750.09 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.41 405.63 465.00 479.41 490.76 739.56 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.69 417.80 458.87 476.58 506.35 729.38 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.87 426.73 449.65 474.70 525.52 720.71 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.49 428.50 438.31 474.58 546.65 714.96 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.34 423.22 425.62 474.21 568.39 713.44 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.92 410.35 415.21 470.66 589.30 716.93 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.57 395.23 404.43 462.87 608.07 725.27 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.46 379.98 393.32 451.37 623.75 737.48 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.69 365.27 383.21 437.36 635.76 752.08 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.48 351.41 375.50 422.19 643.88 767.57 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.41 338.62 371.06 407.29 648.06 782.65 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.19 327.40 369.40 394.56 648.32 796.33 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.05 318.87 367.40 387.77 644.77 807.91 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.00 314.97 362.28 390.01 637.55 816.93 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.67 317.31 357.75 397.68 626.88 823.15 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.67 324.81 356.61 407.85 613.08 826.51 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.25 335.36 359.67 419.11 596.54 827.19 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.90 347.45 366.69 430.47 577.78 825.53 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.63 360.19 376.64 441.02 557.48 822.06 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.21 372.73 388.21 449.97 536.57 817.46 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.21 383.56 400.50 456.77 516.34 812.40 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.09 390.38 413.12 461.45 498.49 807.47 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.06 391.27 425.45 464.87 484.65 803.05 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.97 386.68 436.47 468.33 475.31 799.20 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.83 380.76 444.64 469.54 472.94 795.70 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.59 378.80 447.80 469.35 477.13 792.15 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.27 381.27 446.88 472.96 480.90 788.07 -------------------------------------------------------------------------------- K point *** = 0.484375 0.609375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.47 385.14 445.79 477.14 483.60 783.05 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.34 403.40 440.51 478.92 495.57 769.04 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.64 407.53 444.53 480.49 497.28 758.91 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.52 410.06 451.63 480.58 497.93 747.60 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 364.73 411.91 460.76 479.38 498.44 735.37 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 374.23 415.56 468.01 477.20 502.23 722.66 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.90 423.29 467.62 474.76 514.18 710.20 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.36 432.12 460.79 472.64 532.74 699.02 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.36 436.41 450.41 472.49 554.04 690.57 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.62 433.62 437.85 474.36 575.22 686.72 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.01 423.37 426.47 474.90 593.85 689.38 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.06 409.13 416.07 471.62 608.33 699.31 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.09 395.32 404.64 464.09 618.65 715.01 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.41 382.37 393.66 453.08 625.71 733.71 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.56 369.64 385.25 439.86 630.07 753.04 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.31 356.74 380.53 425.87 631.76 771.45 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.36 344.49 378.65 413.02 630.63 788.01 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.79 334.35 376.68 404.62 626.54 802.12 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.48 328.42 371.30 404.30 619.43 813.45 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.63 328.83 364.51 410.24 609.37 821.81 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.25 335.36 359.67 419.11 596.54 827.19 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.92 345.69 358.41 429.11 581.25 829.74 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.69 357.10 361.96 439.08 563.96 829.77 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.91 365.95 372.26 448.12 545.32 827.71 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.46 375.76 383.81 455.55 526.30 824.11 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.92 387.37 393.32 460.96 508.29 819.52 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.63 396.75 401.98 464.48 493.16 814.43 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.64 396.80 414.43 466.68 482.85 809.15 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.45 392.07 426.22 467.12 478.95 803.80 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.92 387.65 435.20 466.07 480.90 798.26 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.76 387.73 439.44 467.37 484.92 792.29 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.32 392.02 439.72 471.44 489.10 785.60 -------------------------------------------------------------------------------- K point *** = 0.484375 0.640625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.42 397.89 439.31 475.79 492.77 777.92 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.14 412.36 433.04 476.42 511.01 762.55 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.74 419.26 437.05 478.01 514.09 749.64 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.92 423.98 444.37 477.82 516.47 735.64 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.15 426.58 454.31 476.39 518.49 720.82 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.87 428.19 464.58 474.17 521.74 705.67 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 382.36 431.15 470.67 471.70 529.72 690.79 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 383.62 437.06 467.73 470.92 544.85 677.07 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 378.62 442.65 461.43 468.69 564.87 665.78 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.99 442.18 450.80 470.77 585.41 659.23 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.51 434.63 439.08 474.51 601.04 661.56 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.14 422.15 428.55 475.76 608.34 675.35 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.52 409.46 417.31 472.86 610.75 696.10 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.24 398.22 405.60 465.83 611.87 718.78 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.08 387.21 395.95 455.59 612.41 740.97 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.94 374.63 390.78 443.50 611.89 761.55 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.47 361.92 388.66 431.39 609.72 779.90 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.67 350.83 386.83 422.13 605.40 795.63 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.29 343.46 381.92 419.38 598.67 808.53 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.26 342.17 374.14 423.17 589.43 818.49 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.90 347.45 366.69 430.47 577.78 825.53 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.69 357.10 361.96 439.08 563.96 829.77 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.19 359.96 369.83 447.66 548.40 831.46 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.18 362.48 382.32 455.29 531.82 830.96 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.83 368.66 393.53 461.34 515.31 828.67 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.85 377.94 401.46 465.48 500.63 825.01 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.63 389.39 404.07 467.51 490.30 820.32 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.12 400.59 402.04 466.89 486.72 814.83 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.77 394.39 414.01 464.39 488.87 808.59 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.48 389.90 423.94 462.55 493.41 801.57 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.13 390.72 429.70 463.70 498.40 793.60 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.74 396.35 431.34 467.96 503.09 784.52 -------------------------------------------------------------------------------- K point *** = 0.484375 0.671875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.68 404.24 431.63 472.86 507.31 774.19 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.42 412.48 424.47 474.08 530.14 758.55 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.16 422.24 428.30 476.86 533.82 742.78 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.33 429.71 435.94 476.94 537.42 725.77 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.76 435.02 446.44 474.80 541.07 707.92 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.64 438.57 457.87 471.49 545.33 689.80 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 381.55 440.63 467.70 468.13 551.90 672.11 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 388.25 443.20 464.81 472.82 563.22 655.66 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 387.48 447.78 462.06 470.99 580.11 641.44 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 380.50 449.45 460.66 465.75 599.18 631.85 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.94 443.85 451.28 470.13 607.21 638.18 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 357.63 433.77 440.40 474.99 602.73 660.35 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.73 422.16 429.61 476.58 597.72 685.21 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.18 411.86 418.10 474.04 594.16 709.68 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.02 402.94 407.02 467.63 591.72 732.78 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.22 391.18 401.27 458.35 589.51 753.95 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.44 378.50 398.96 447.85 586.60 772.84 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.60 367.06 397.31 438.58 582.27 789.20 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.38 358.83 393.22 433.97 576.07 802.88 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.50 356.23 385.50 435.50 567.81 813.83 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.63 360.19 376.64 441.02 557.48 822.06 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.91 365.95 372.26 448.12 545.32 827.71 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.18 362.48 382.32 455.29 531.82 830.96 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.65 361.04 394.00 461.57 517.83 832.07 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.85 363.35 403.54 466.35 504.91 831.31 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.77 369.28 408.29 468.97 495.70 828.95 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.93 378.20 406.54 468.27 493.36 825.17 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.39 388.94 399.76 464.92 497.18 820.06 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.66 390.66 401.42 461.00 503.58 813.63 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.70 385.72 411.75 458.21 510.35 805.79 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.26 386.56 418.95 458.56 516.53 796.43 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.87 392.87 421.97 462.85 521.80 785.46 -------------------------------------------------------------------------------- K point *** = 0.484375 0.703125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.56 402.20 422.93 468.91 526.24 772.82 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.51 404.89 415.05 469.15 552.45 757.95 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.21 416.64 418.54 474.70 555.98 739.69 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.12 424.54 427.91 477.09 559.82 719.82 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.24 432.55 438.68 476.03 564.39 698.76 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.19 440.58 449.71 472.06 569.95 677.15 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.35 446.60 460.92 466.44 576.97 655.86 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 386.55 450.21 460.98 469.97 586.51 635.97 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 390.95 452.86 457.22 473.63 599.87 618.64 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 387.79 453.91 457.48 470.59 604.53 617.51 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 378.62 449.23 461.46 464.78 593.57 638.51 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 366.20 442.20 450.82 471.03 585.06 661.39 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.54 432.91 439.89 475.65 578.39 684.80 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.11 423.47 429.06 477.05 573.22 707.75 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.20 415.85 417.75 474.68 569.25 729.55 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.95 405.21 411.54 468.88 565.94 749.69 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.05 393.01 409.15 460.76 562.53 767.83 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.36 381.72 407.72 452.36 558.29 783.76 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.55 373.16 404.59 446.73 552.69 797.36 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.13 369.74 397.64 446.25 545.46 808.57 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.21 372.73 388.21 449.97 536.57 817.46 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.46 375.76 383.81 455.55 526.30 824.11 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.83 368.66 393.53 461.34 515.31 828.67 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.85 363.35 403.54 466.35 504.91 831.31 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.40 361.53 409.67 469.62 497.67 832.18 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.78 363.52 409.33 469.45 497.17 831.35 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.79 369.08 402.75 465.99 503.26 828.87 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.70 377.32 393.08 461.12 512.28 824.67 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.19 381.41 389.65 455.96 521.77 818.67 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.34 376.40 399.25 451.83 530.50 810.72 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.66 376.88 407.49 450.79 537.95 800.72 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.10 383.30 411.84 454.53 543.94 788.58 -------------------------------------------------------------------------------- K point *** = 0.484375 0.734375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.37 393.34 413.43 461.67 548.64 774.30 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.70 392.30 405.03 459.64 576.28 760.97 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.20 404.71 408.66 468.35 579.18 741.18 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.62 413.69 418.11 474.46 582.19 719.36 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.07 422.66 429.59 476.87 586.18 695.91 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.41 433.30 440.44 475.31 591.78 671.39 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.49 443.32 451.31 470.38 599.22 646.67 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 380.02 450.42 460.83 464.85 607.65 623.84 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 388.10 452.25 458.70 470.92 598.54 623.19 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 390.04 448.27 461.14 473.36 581.33 637.29 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 384.44 445.71 464.59 469.05 568.82 654.27 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 373.31 443.02 459.56 468.90 560.71 673.09 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.64 438.32 448.12 473.35 555.12 692.81 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.75 431.86 437.03 476.46 550.59 712.54 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.38 424.98 426.87 477.02 546.56 731.59 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.88 415.02 421.33 474.49 542.82 749.44 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.01 403.90 418.89 469.16 539.11 765.72 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.67 393.31 417.74 462.36 534.95 780.21 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.49 384.90 415.61 456.59 529.90 792.82 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.80 381.10 409.87 454.65 523.69 803.53 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.21 383.56 400.50 456.77 516.34 812.40 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.92 387.37 393.32 460.96 508.29 819.52 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.85 377.94 401.46 465.48 500.63 825.01 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.77 369.28 408.29 468.97 495.70 828.95 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.78 363.52 409.33 469.45 497.17 831.35 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.49 361.37 403.80 466.48 505.47 832.15 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.99 363.00 393.87 461.51 517.19 831.20 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.87 367.91 382.64 455.36 529.71 828.31 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.11 369.76 378.37 448.80 541.59 823.26 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.97 364.11 386.92 443.08 552.07 815.85 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.74 363.87 395.65 440.21 560.77 805.96 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.79 369.92 401.18 442.60 567.58 793.49 -------------------------------------------------------------------------------- K point *** = 0.484375 0.765625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.45 380.15 403.38 450.12 572.62 778.47 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 306.31 376.69 394.68 445.62 599.84 767.09 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.43 389.49 398.17 456.98 601.75 747.12 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.14 400.51 406.21 466.76 602.91 725.04 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.58 410.42 417.79 473.49 604.17 701.44 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.82 421.99 429.23 476.19 606.00 677.46 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.03 434.25 439.90 474.72 606.89 655.99 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 370.44 443.54 451.03 470.28 599.94 645.03 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 380.02 446.62 461.12 467.03 582.11 648.62 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 385.97 442.73 465.21 470.87 562.09 659.48 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 385.65 437.54 468.23 472.02 545.90 673.56 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 377.97 434.84 466.31 471.21 536.08 689.30 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 365.52 433.14 456.06 474.01 531.17 705.77 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.77 430.28 445.12 476.32 528.12 722.26 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.25 425.35 436.10 477.46 525.19 738.20 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.68 417.94 430.46 476.66 521.90 753.15 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 324.00 408.91 427.91 473.52 518.22 766.84 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.16 399.69 427.10 468.48 514.14 779.12 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.79 392.00 426.00 463.23 509.51 789.94 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.07 388.26 421.75 460.50 504.22 799.35 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 320.09 390.38 413.12 461.45 498.49 807.47 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.63 396.75 401.98 464.48 493.16 814.43 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.63 389.39 404.07 467.51 490.30 820.32 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.93 378.20 406.54 468.27 493.36 825.17 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.79 369.08 402.75 465.99 503.26 828.87 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.99 363.00 393.87 461.51 517.19 831.20 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 286.89 360.57 382.25 455.28 532.53 831.87 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.42 361.66 370.28 447.77 547.63 830.51 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.93 357.89 368.03 439.76 561.49 826.80 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.02 350.74 375.39 432.38 573.54 820.48 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.90 349.33 383.86 427.48 583.44 811.37 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.29 354.53 390.29 427.83 591.06 799.41 -------------------------------------------------------------------------------- K point *** = 0.484375 0.796875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.14 364.43 393.07 434.80 596.44 784.60 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.58 359.39 384.37 428.40 621.67 775.37 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.12 372.24 387.58 441.56 622.20 756.66 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 316.87 384.66 394.52 454.26 620.69 736.22 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.99 396.43 405.07 464.92 617.46 715.11 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.74 409.03 416.71 472.22 612.28 695.24 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.56 422.62 427.63 475.32 603.59 680.01 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 359.03 434.60 438.24 474.39 589.18 673.10 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 368.61 439.78 450.63 471.54 569.64 674.85 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 376.36 437.81 461.31 470.61 548.27 682.67 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 380.56 430.63 468.36 472.37 528.75 694.03 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 378.50 423.85 469.53 474.48 515.05 707.21 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.39 420.55 462.69 476.89 509.14 721.07 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 356.74 418.83 452.80 478.59 507.41 734.81 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.47 416.28 444.18 479.24 506.20 747.89 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.04 411.82 438.55 478.53 504.21 759.97 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.69 405.59 435.99 476.16 501.27 770.84 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.49 398.54 435.58 472.17 497.56 780.47 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.07 392.25 435.52 467.51 493.30 788.93 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.38 389.16 432.86 464.53 488.77 796.38 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 329.06 391.27 425.45 464.87 484.65 803.05 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 322.64 396.80 414.43 466.68 482.85 809.15 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.12 400.59 402.04 466.89 486.72 814.83 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.39 388.94 399.76 464.92 497.18 820.06 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.70 377.32 393.08 461.12 512.28 824.67 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.87 367.91 382.64 455.36 529.71 828.31 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.42 361.66 370.28 447.77 547.63 830.51 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 287.54 357.50 359.23 438.87 564.79 830.77 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.98 346.00 360.65 429.43 580.37 828.67 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.81 337.61 365.60 420.53 593.84 823.86 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.39 334.71 372.80 413.68 604.83 816.12 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.86 338.53 379.57 411.60 613.15 805.39 -------------------------------------------------------------------------------- K point *** = 0.484375 0.828125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.67 347.55 382.87 417.14 618.73 791.74 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.67 341.53 374.55 409.76 640.60 784.82 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.40 354.00 377.50 423.80 639.37 768.67 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.89 367.16 383.81 438.44 634.77 751.35 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.37 380.75 393.26 452.10 626.76 734.10 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.30 394.96 404.38 463.39 615.25 718.66 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 337.43 409.68 415.49 471.10 600.12 707.07 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.56 424.28 425.13 474.53 581.63 700.99 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.38 431.52 437.98 474.43 560.80 700.89 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.40 432.08 450.08 473.57 539.20 705.94 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.75 425.48 459.94 474.66 518.67 714.64 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 372.79 414.94 466.43 477.17 501.46 725.42 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 369.70 406.31 466.31 479.68 491.44 737.00 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.08 402.48 458.93 481.61 489.57 748.42 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.72 400.59 450.89 482.26 489.96 759.07 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.68 398.13 445.38 481.36 489.75 768.57 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.79 394.36 442.93 478.89 488.33 776.76 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.33 389.61 442.96 475.03 485.70 783.68 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.90 385.16 443.90 470.60 482.11 789.51 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.07 383.49 442.70 467.89 478.08 794.56 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.97 386.68 436.47 468.33 475.31 799.20 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.45 392.07 426.22 467.12 478.95 803.80 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.77 394.39 414.01 464.39 488.87 808.59 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.66 390.66 401.42 461.00 503.58 813.63 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.19 381.41 389.65 455.96 521.77 818.67 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.11 369.76 378.37 448.80 541.59 823.26 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.93 357.89 368.03 439.76 561.49 826.80 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.98 346.00 360.65 429.43 580.37 828.67 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.30 334.73 357.53 418.67 597.45 828.32 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.49 325.73 358.71 408.42 612.15 825.32 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.35 321.27 363.41 399.94 624.06 819.45 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.65 323.20 369.56 395.47 632.88 810.63 -------------------------------------------------------------------------------- K point *** = 0.484375 0.859375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.22 330.70 373.22 398.88 638.43 798.98 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.59 324.32 365.79 391.53 655.69 794.60 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.23 335.94 368.61 405.49 652.45 781.97 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.11 349.38 374.62 421.02 644.85 768.54 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.65 364.26 383.43 436.62 632.99 755.27 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.63 380.01 393.95 450.91 617.23 743.27 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.02 395.80 405.01 462.52 598.25 733.72 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.74 410.48 415.73 470.30 577.05 727.73 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.57 421.03 426.94 473.92 554.90 726.01 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 349.15 424.55 438.74 474.80 533.24 728.59 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.99 420.26 449.17 475.84 513.31 734.69 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 361.39 409.11 457.67 478.35 495.95 743.08 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 363.92 395.63 463.44 481.19 482.32 752.48 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 360.57 386.16 462.70 475.68 483.91 761.83 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 351.65 382.85 456.06 476.27 485.34 770.36 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.33 381.28 450.85 476.69 485.57 777.63 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.03 379.14 448.59 475.44 484.56 783.44 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 339.37 376.20 449.05 472.60 482.31 787.82 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.81 373.61 450.89 469.04 478.94 791.03 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.97 374.52 450.52 467.78 474.83 793.47 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.83 380.76 444.64 469.54 472.94 795.70 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.92 387.65 435.20 466.07 480.90 798.26 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 326.48 389.90 423.94 462.55 493.41 801.57 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.70 385.72 411.75 458.21 510.35 805.79 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.34 376.40 399.25 451.83 530.50 810.72 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 301.97 364.11 386.92 443.08 552.07 815.85 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.02 350.74 375.39 432.38 573.54 820.48 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.81 337.61 365.60 420.53 593.84 823.86 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.49 325.73 358.71 408.42 612.15 825.32 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.99 316.09 355.69 396.99 627.84 824.40 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.76 310.17 356.82 387.27 640.41 820.81 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.64 309.84 361.07 380.90 649.45 814.50 -------------------------------------------------------------------------------- K point *** = 0.484375 0.890625 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.80 315.18 364.65 381.79 654.63 805.64 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.18 309.11 358.75 375.37 666.22 804.08 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.40 319.38 361.69 388.20 660.97 795.52 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 299.37 332.65 367.76 403.54 650.90 786.10 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 303.89 348.11 376.36 420.02 636.42 776.38 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 309.06 364.68 386.55 436.27 618.17 767.02 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 314.95 381.14 397.47 450.83 597.07 758.84 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.47 396.22 408.48 462.29 574.23 752.77 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 328.39 408.22 419.32 469.70 551.02 749.70 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 335.39 414.74 429.97 473.34 529.07 750.08 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.08 413.50 439.86 475.29 509.84 753.68 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.06 404.13 448.42 477.79 493.89 759.66 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.82 389.81 455.37 478.92 482.92 766.87 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 355.33 375.42 460.27 469.70 484.92 774.21 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 352.49 367.05 459.41 466.00 487.07 780.80 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.79 365.23 454.83 467.16 487.94 786.09 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 342.19 364.15 452.85 467.12 487.36 789.79 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.34 362.55 453.72 465.51 485.35 791.90 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 347.00 362.17 456.12 463.24 482.16 792.65 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.58 368.23 454.22 465.35 478.39 792.51 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.59 378.80 447.80 469.35 477.13 792.15 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 334.76 387.73 439.44 467.37 484.92 792.29 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.13 390.72 429.70 463.70 498.40 793.60 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.26 386.56 418.95 458.56 516.53 796.43 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 311.66 376.88 407.49 450.79 537.95 800.72 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 304.74 363.87 395.65 440.21 560.77 805.96 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 298.90 349.33 383.86 427.48 583.44 811.37 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.39 334.71 372.80 413.68 604.83 816.12 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.35 321.27 363.41 399.94 624.06 819.45 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.76 310.17 356.82 387.27 640.41 820.81 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.39 302.53 354.01 376.59 653.28 819.90 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.64 299.70 355.15 369.01 662.14 816.67 -------------------------------------------------------------------------------- K point *** = 0.484375 0.921875 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.25 302.29 357.82 367.52 666.57 811.29 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.16 297.26 354.13 362.75 671.79 812.72 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.67 305.74 357.52 373.31 664.78 808.35 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.71 318.11 363.95 387.33 652.97 802.72 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 296.54 333.19 372.58 403.66 636.95 796.09 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.34 349.68 382.55 420.89 617.45 788.89 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.14 366.30 393.17 437.43 595.37 781.80 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 310.81 381.79 403.90 451.69 571.77 775.71 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 317.09 394.76 414.38 462.36 547.99 771.55 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 323.65 403.30 424.34 468.97 525.73 770.03 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 330.14 404.94 433.54 472.63 506.82 771.29 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.21 398.29 441.67 475.49 492.14 774.87 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.52 385.49 448.52 476.66 482.92 779.82 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.76 370.84 453.91 469.38 484.48 785.10 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 348.39 358.30 457.69 462.32 487.34 789.79 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.77 352.78 457.25 460.32 489.11 793.23 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.11 352.36 455.62 460.84 489.41 795.02 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.94 351.96 456.86 459.92 488.16 795.09 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 346.66 356.66 456.80 461.46 485.55 793.61 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.23 368.11 452.64 467.52 482.15 791.03 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.27 381.27 446.88 472.96 480.90 788.07 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 332.32 392.02 439.72 471.44 489.10 785.60 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.74 396.35 431.34 467.96 503.09 784.52 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 318.87 392.87 421.97 462.85 521.80 785.46 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 312.10 383.30 411.84 454.53 543.94 788.58 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 305.79 369.92 401.18 442.60 567.58 793.49 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 300.29 354.53 390.29 427.83 591.06 799.41 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 295.86 338.53 379.57 411.60 613.15 805.39 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 292.65 323.20 369.56 395.47 632.88 810.63 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.64 309.84 361.07 380.90 649.45 814.50 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.64 299.70 355.15 369.01 662.14 816.67 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.28 293.92 352.75 360.65 670.37 817.04 -------------------------------------------------------------------------------- K point *** = 0.484375 0.953125 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.26 293.29 353.44 357.44 673.66 815.67 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.015625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.23 289.97 352.51 354.85 672.25 820.00 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.046875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.13 296.07 356.64 361.98 663.95 819.64 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.078125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.78 306.51 363.38 373.73 651.13 817.46 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.109375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.47 320.18 371.81 389.08 634.41 813.56 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.140625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 293.39 335.81 381.32 406.43 614.50 808.27 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.171875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.52 352.09 391.39 424.02 592.22 802.23 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.203125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.69 367.74 401.62 440.08 568.53 796.25 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.234375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 308.65 381.39 411.65 453.11 544.69 791.30 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.265625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 315.05 391.31 421.19 462.27 522.37 788.19 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.296875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 321.54 395.21 429.99 467.88 503.59 787.32 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.328125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 327.77 391.26 437.84 471.55 489.67 788.54 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.359375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 333.43 380.68 444.54 473.27 481.53 791.18 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.390625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 338.22 367.46 449.95 468.27 482.59 794.32 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.421875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 341.93 355.48 453.95 462.27 486.03 797.06 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.453125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.37 347.44 456.45 458.20 488.71 798.65 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.484375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 344.69 345.62 456.84 457.43 490.00 798.64 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.515625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 345.18 348.26 456.80 458.57 489.70 796.83 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.546875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 343.54 357.22 454.62 463.22 487.89 793.32 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.578125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 340.58 370.34 450.93 470.24 484.99 788.50 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.609375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 336.47 385.14 445.79 477.14 483.60 783.05 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.640625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 331.42 397.89 439.31 475.79 492.77 777.92 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.671875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 325.68 404.24 431.63 472.86 507.31 774.19 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.703125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 319.56 402.20 422.93 468.91 526.24 772.82 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.734375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 313.37 393.34 413.43 461.67 548.64 774.30 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.765625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 307.45 380.15 403.38 450.12 572.62 778.47 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.796875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 302.14 364.43 393.07 434.80 596.44 784.60 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.828125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 297.67 347.55 382.87 417.14 618.73 791.74 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.859375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 294.22 330.70 373.22 398.88 638.43 798.98 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.890625 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 291.80 315.18 364.65 381.79 654.63 805.64 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.921875 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 290.25 302.29 357.82 367.52 666.57 811.29 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.953125 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 289.26 293.29 353.44 357.44 673.66 815.67 -------------------------------------------------------------------------------- K point *** = 0.484375 0.984375 0.984375 Weight = 0.000 -------------------------------------------------------------------------------- Frequencies (cm-1) : 288.51 289.15 352.14 352.51 675.57 818.63 -------------------------------------------------------------------------------- Phonon properties (per mole of unit cells): Temperature = 0.000 K -------------------------------------------------------------------------------- Zero point energy = 0.174340 eV -------------------------------------------------------------------------------- Phonon density of states : -------------------------------------------------------------------------------- Frequency Density of States -------------------------------------------------------------------------------- 0.00000 | 0.000 18.00000 | 0.000 36.00000 | 0.000 54.00000 | 0.001 72.00000 |* 0.001 90.00000 |* 0.002 108.00000 |** 0.003 126.00000 |** 0.003 144.00000 |*** 0.004 162.00000 |**** 0.006 180.00000 |****** 0.008 198.00000 |******* 0.009 216.00000 |********* 0.011 234.00000 |************ 0.015 252.00000 |************** 0.018 270.00000 |********************* 0.027 288.00000 |******************************* 0.039 306.00000 |******************************** 0.040 324.00000 |******************************* 0.039 342.00000 |******************************** 0.041 360.00000 |*************************************************** 0.063 378.00000 |***************************************************** 0.066 396.00000 |************************************************************ 0.074 414.00000 |********************************************************** 0.072 432.00000 |****************************************************** 0.067 450.00000 |********************************************* 0.056 468.00000 |**************************************************** 0.065 486.00000 |*********** 0.014 504.00000 |********* 0.012 522.00000 |******** 0.010 540.00000 |******** 0.011 558.00000 |********* 0.011 576.00000 |********* 0.012 594.00000 |********** 0.013 612.00000 |********* 0.012 630.00000 |***** 0.007 648.00000 |***** 0.007 666.00000 |**** 0.006 684.00000 |***** 0.007 702.00000 |****** 0.008 720.00000 |******* 0.009 738.00000 |******* 0.010 756.00000 |******** 0.011 774.00000 |********* 0.012 792.00000 |********* 0.012 810.00000 |******** 0.010 828.00000 |******* 0.009 846.00000 |****** 0.008 864.00000 |***** 0.007 882.00000 |***** 0.007 900.00000 |***** 0.006 918.00000 |**** 0.006 936.00000 |**** 0.005 954.00000 |**** 0.005 972.00000 |*** 0.004 990.00000 |*** 0.004 1008.00000 |** 0.004 1026.00000 |** 0.003 1044.00000 |** 0.003 1062.00000 |* 0.002 1080.00000 |* 0.002 1098.00000 | 0.001 1116.00000 | 0.000 1134.00000 | 0.000 -------------------------------------------------------------------------------- Phonon density of states written as MgO_6.dens Time to end of properties = 10.4993 seconds Peak dynamic memory used = 41.52 MB Timing analysis for Gulp : -------------------------------------------------------------------------------- Task / Subroutine Time (Seconds) -------------------------------------------------------------------------------- Calculation of reciprocal space energy and derivatives 0.5899 Calculation of real space energy and derivatives 2.3406 Calculation of properties 0.0002 Calculation of phonons 3.1687 Matrix diagonalisation 0.0360 Disk read/write operations to scratch files 0.0001 -------------------------------------------------------------------------------- Total CPU time 10.4994 -------------------------------------------------------------------------------- Job Finished at 15:22.35 4th February 2016