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Uploads by Nm2512

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Date Name Thumbnail Size Description Versions
13:12, 8 December 2014 Bh3 optimisation summary.jpg (file) 32 KB   1
13:14, 8 December 2014 NM bh3 optimisation summary.jpg (file) 32 KB   1
13:30, 8 December 2014 NM BH3 OPT.mol (file) 441 bytes   2
13:36, 8 December 2014 NM2512 BH3 OPT.LOG (file) 92 KB   1
13:44, 8 December 2014 NM bh3 optimisation summary.PNG (file) 10 KB Incorrect screenshot 4
13:53, 8 December 2014 NM bh3 opt graphs.PNG (file) 29 KB   1
13:27, 9 December 2014 NM bh3 321G.PNG (file) 10 KB   1
13:30, 9 December 2014 NM BH3 OPT 321G.LOG (file) 91 KB   1
13:32, 9 December 2014 NM Bh3 opt 321G.mol (file) 444 bytes   1
13:41, 9 December 2014 NM bh3 321G graphs.PNG (file) 27 KB   1
14:14, 9 December 2014 NM Bh3 opt 631g(d,p).mol (file) 444 bytes   1
14:39, 9 December 2014 NM bh3 631G(d,p).PNG (file) 10 KB   2
14:42, 9 December 2014 NM BH3 OPT 631g dp.mol (file) 444 bytes   1
14:44, 9 December 2014 NM BH3 OPT 631G DP.LOG (file) 39 KB   1
14:47, 9 December 2014 NM BH3 631G(d,p) graphs.PNG (file) 35 KB   1
12:20, 10 December 2014 NM GaBr3 pp opt.PNG (file) 10 KB   1
12:21, 10 December 2014 NM GaBr3 pp optimisation.mol (file) 459 bytes   1
12:27, 10 December 2014 NM GaBr3 pseudopotential optimisation.log (file) 41 KB   1
13:12, 10 December 2014 NM BBr3 opt pp.PNG (file) 9 KB   1
13:13, 10 December 2014 NM BBr3 opt pseudopotential.log (file) 67 KB   1
13:14, 10 December 2014 NM BBr3 optimisation pp.mol (file) 445 bytes   1
11:30, 11 December 2014 NM BH3 freq Opt.PNG (file) 10 KB   1
11:34, 11 December 2014 NM BH3 FREQ OPT 631G DP.LOG (file) 27 KB   1
12:18, 11 December 2014 NM BH3 IR.PNG (file) 18 KB   1
13:14, 11 December 2014 NM GaBr3 freq.PNG (file) 10 KB   1
13:15, 11 December 2014 NM GaBr3 frequency.log (file) 28 KB   1
13:23, 11 December 2014 NM GaBr3 IR.PNG (file) 22 KB   1
14:31, 11 December 2014 NM GaBr3 A2.PNG (file) 61 KB   1
14:32, 11 December 2014 NM BH3 A2.PNG (file) 118 KB   1
16:15, 11 December 2014 NM BH3 MO.png (file) 139 KB   1
16:37, 11 December 2014 NM NH3 OPT SUM.PNG (file) 10 KB   1
16:44, 11 December 2014 NM NH3 OPT.LOG (file) 48 KB   1
16:48, 11 December 2014 NMCD NH3 OPTIMISATION 631G DP.mol (file) 444 bytes   1
17:01, 11 December 2014 NM NH3 FREQ.PNG (file) 10 KB   1
17:03, 11 December 2014 NM NH3 IR.PNG (file) 19 KB   1
17:04, 11 December 2014 NM NH3 FREQUENCY.LOG (file) 26 KB   1
17:33, 11 December 2014 NM NH3 CHARGE.PNG (file) 50 KB   1
11:14, 12 December 2014 NM NH3BH3 OPT SUM.PNG (file) 10 KB   1
11:15, 12 December 2014 NM NH3BH3 OPT.log (file) 102 KB   1
11:17, 12 December 2014 NM NH3BH3 OPTIMISATION.mol (file) 820 bytes   1
11:21, 12 December 2014 NM NH3BH3 FREQ SUM.PNG (file) 10 KB   1
11:23, 12 December 2014 NM NH3BH3 FREQ.log (file) 37 KB   1
11:24, 12 December 2014 NM NH3BH3 IR.PNG (file) 23 KB   1
14:41, 12 December 2014 NM BENZENE OPT SUMMARY.PNG (file) 10 KB   1
14:42, 12 December 2014 NM BENZENE OPT.log (file) 94 KB   1
14:43, 12 December 2014 NM BENZENE OPTIMISATION.mol (file) 1 KB   1
14:58, 12 December 2014 NM BENZENE FREQ SUM.PNG (file) 9 KB   1
15:00, 12 December 2014 NM BENZENE FREQ.log (file) 55 KB   1
15:02, 12 December 2014 NM BENZENE IR.PNG (file) 23 KB   1
15:28, 12 December 2014 NM BENZENE CHARGE.PNG (file) 66 KB   1
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