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Uploads by Emw15

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Date Name Thumbnail Size Description Versions
13:28, 15 May 2018 Emw15 BH3 optimisation 1.jpg (file) 134 KB energy graph 1
16:42, 4 May 2018 Reverse rfh 3.0 high kinetic energy ineffectiveemw15.png (file) 141 KB   1
16:42, 4 May 2018 Reverse rfh 0.1 high vib effectiveemw15.png (file) 151 KB   1
16:29, 4 May 2018 Forward rhh 2.5 high vibrational energy ineffectiveemw15.png (file) 141 KB   1
16:29, 4 May 2018 Forward rhh 0.1 kinetic energy effective low vibemw15.png (file) 175 KB   1
15:44, 4 May 2018 Ea reversefhhemw15.png (file) 29 KB   1
14:51, 4 May 2018 Momentatime22emw15.png (file) 60 KB   1
14:51, 4 May 2018 Energytime22emw15.png (file) 59 KB   1
14:51, 4 May 2018 Contour22emw15.png (file) 188 KB   1
13:50, 4 May 2018 Ea forwardfhhemw15.png (file) 34 KB   1
13:13, 4 May 2018 Corrected rts rts contouremw15.png (file) 106 KB   1
13:13, 4 May 2018 Corrected rts shifted rts contouremw15.png (file) 105 KB   1
11:45, 4 May 2018 Energyfhhts emw15.png (file) 13 KB   1
11:45, 4 May 2018 Distancefhhts emw15.png (file) 19 KB AB 1.78 BC 0.74 Internuclear distance vs time MEP 1
14:03, 3 May 2018 Emw15row5surface.png (file) 97 KB   1
14:03, 3 May 2018 Row 4 surface plot dynamics.png (file) 92 KB   1
14:03, 3 May 2018 Row 3 surface plot dynamics.png (file) 85 KB   1
14:03, 3 May 2018 Row 2 surface plot dynamics.png (file) 88 KB   1
14:03, 3 May 2018 Row 1 surface plot dynamics.png (file) 85 KB   1
12:04, 3 May 2018 Ex 1 internuclear distances plot 1.png (file) 28 KB   1
11:56, 3 May 2018 Ex 1 distances plot rts 0.88825 dynamics plot 3.png (file) 34 KB   1
15:52, 1 May 2018 Emw15 surfaceplotrts deviated.png (file) 191 KB Ex_1_surface_plot_rts_0.88825_plus_delta_dynamics_plot_3 1
15:48, 1 May 2018 Emw15 contourplottofindrts.png (file) 90 KB contour plot to find rts 1
14:31, 1 May 2018 Emwex1tsenergymaximaplot1.png (file) 214 KB   1
14:31, 1 May 2018 Ex 1 ts pe well plot 1.png (file) 206 KB   1
10:16, 10 March 2017 Emw15 n2 image.png (file) 69 KB   1
10:16, 10 March 2017 Emw15 h2 image.png (file) 48 KB   1
10:00, 10 March 2017 EMW15 PHUNT N2 OPTF POP.LOG (file) 196 KB   1
09:59, 10 March 2017 EMW15 PHUNT H2 OPTF POP.LOG (file) 95 KB   1
09:50, 10 March 2017 EMW15 T CLF3 PHUNT OPTF POP.LOG (file) 724 KB   1
17:09, 9 March 2017 Emw15 ClF3 vibrations.png (file) 17 KB   1
17:05, 9 March 2017 Emw15 ClF3 2spantibondingmo LPeff.png (file) 355 KB   1
17:04, 9 March 2017 Emw15 ClF3 2spbondingmo.png (file) 324 KB   1
17:03, 9 March 2017 Emw15 ClF3 2ppibondingmo.png (file) 347 KB   1
17:01, 9 March 2017 Emw15 ClF3 2spLUMOantibondingmo.png (file) 303 KB   1
16:58, 9 March 2017 Emw15 ClF3 2pHOMOpiantibondingmo.png (file) 435 KB   1
16:33, 9 March 2017 Emw15 T ClF3 chargedist.png (file) 50 KB   1
11:22, 9 March 2017 Emw15 ClF3 chargedist.png (file) 100 KB   1
10:52, 9 March 2017 Emw15 n2 hybridisedspmo3.png (file) 182 KB   1
10:45, 9 March 2017 Emw15 n2 2pmo.png (file) 212 KB   1
10:43, 9 March 2017 Emw15 n2 hybridisedspmo.png (file) 148 KB Emw15_n2_hybridisedspmo 1
10:42, 9 March 2017 Emw15 n2 lumo.png (file) 227 KB   1
10:41, 9 March 2017 Emw15 n2 hybridisedspmo2.png (file) 208 KB HOMO 2sp hybridised interaction 1
09:30, 9 March 2017 Emw15 h2 vibrations.png (file) 15 KB h2 vibrational modes 1
11:54, 6 March 2017 Emw15 n2 vibrations.png (file) 16 KB   1
11:31, 6 March 2017 Emw15 nh3 chargedist.png (file) 108 KB charge distribution for nh3 1
11:17, 6 March 2017 Emw15 nh3 vibrations.png (file) 18 KB window screenshot 1
10:36, 6 March 2017 EMILYWIDJAJA PHUNT NH3 OPTF POP.LOG (file) 228 KB   1
10:35, 6 March 2017 Emilywidjaja phunt nh3 optf pop.gjf (file) 453 bytes Log file optimised nh3 1
10:15, 6 March 2017 Emw15 nh3 phunt optf pop.png (file) 92 KB   2
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