User contributions for So1612

17 December 2014

• 23:3323:33, 17 December 2014 diff hist +18 Rep:Mod:XYZABCDE1234 →BBr3 optimisation
• 23:3123:31, 17 December 2014 diff hist +142 Rep:Mod:XYZABCDE1234 →SO_BBr3_pp_optimisation
• 23:3023:30, 17 December 2014 diff hist +65 Rep:Mod:XYZABCDE1234 →SO_GaBr3_pp_optimisation
• 23:2123:21, 17 December 2014 diff hist +373 Rep:Mod:XYZABCDE1234 →Geometry Comparison
• 23:0923:09, 17 December 2014 diff hist +304 Rep:Mod:XYZABCDE1234 →Molecular orbitals of NH3
• 23:0023:00, 17 December 2014 diff hist +649 Rep:Mod:XYZABCDE1234 →Molecular orbitals of NH3
• 22:4622:46, 17 December 2014 diff hist +1,173 Rep:Mod:XYZABCDE1234 →Molecular orbitals of NH3

16 December 2014

• 12:5812:58, 16 December 2014 diff hist +10 Rep:Mod:XYZABCDE1234 →IR stretches of isomer 1

15 December 2014

• 17:2617:26, 15 December 2014 diff hist +514 Rep:Mod:XYZABCDE1234 →IR stretches table for isomer 4
• 17:1317:13, 15 December 2014 diff hist +41 Rep:Mod:XYZABCDE1234 →IR spectrum of Isomer 4
• 17:1217:12, 15 December 2014 diff hist −14 Rep:Mod:XYZABCDE1234 →IR stretches table of isomer 3
• 16:5816:58, 15 December 2014 diff hist +38 Rep:Mod:XYZABCDE1234 →IR stretches table of isomer 3
• 16:5616:56, 15 December 2014 diff hist +36 Rep:Mod:XYZABCDE1234 →IR stretches of isomer 2
• 16:5416:54, 15 December 2014 diff hist +528 Rep:Mod:XYZABCDE1234 →IR spectrum of isomer 3
• 16:5216:52, 15 December 2014 diff hist −31 Rep:Mod:XYZABCDE1234 →IR stretches of isomer 2
• 16:3016:30, 15 December 2014 diff hist +525 Rep:Mod:XYZABCDE1234 →IR spectrum of isomer 2
• 16:1916:19, 15 December 2014 diff hist −21 Rep:Mod:XYZABCDE1234 →IR stretches of isomer 1
• 16:1116:11, 15 December 2014 diff hist +490 Rep:Mod:XYZABCDE1234 →IR stretches of isomer 1
• 16:1016:10, 15 December 2014 diff hist +34 Rep:Mod:XYZABCDE1234 →IR spectrum of isomer 1
• 14:3814:38, 15 December 2014 diff hist +73 Rep:Mod:XYZABCDE1234 →IR spectrum of Isomer 4
• 14:3614:36, 15 December 2014 diff hist 0 N File:SO Al2Br2Cl4 ISOMER 4 OPTI 2 freq calc IR spec.jpg No edit summary current
• 14:3514:35, 15 December 2014 diff hist 0 File:SO AL2BR2CL4 OPTI 2 ISOMER 3 freq calc IR spec.jpg So1612 uploaded a new version of "File:SO AL2BR2CL4 OPTI 2 ISOMER 3 freq calc IR spec.jpg" current
• 14:3314:33, 15 December 2014 diff hist +33 Rep:Mod:XYZABCDE1234 →frequency calculation isomer 4
• 14:2114:21, 15 December 2014 diff hist +105 Rep:Mod:XYZABCDE1234 →frequency calculation on isomer 3
• 14:1414:14, 15 December 2014 diff hist 0 N File:SO AL2BR2CL4 OPTI 2 ISOMER 3 freq calc IR spec.jpg No edit summary
• 14:0814:08, 15 December 2014 diff hist +14 Rep:Mod:XYZABCDE1234 →IR spectrum
• 14:0714:07, 15 December 2014 diff hist 0 N File:SO AL2BR2CL4 ISOMER2 OPT 2 FREQ CALC IR.jpg No edit summary current
• 10:2410:24, 15 December 2014 diff hist +4 Rep:Mod:XYZABCDE1234 →AlBrCl2 monomer

14 December 2014

• 22:5222:52, 14 December 2014 diff hist +63 Rep:Mod:XYZABCDE1234 →IR spectrum
• 22:5122:51, 14 December 2014 diff hist +21 Rep:Mod:XYZABCDE1234 →frequency calculation
• 21:2221:22, 14 December 2014 diff hist 0 Rep:Mod:XYZABCDE1234 →optimisation of isomer 1
• 01:0101:01, 14 December 2014 diff hist +37 Rep:Mod:XYZABCDE1234 →AlBrCl2 monomer
• 01:0001:00, 14 December 2014 diff hist −9 Rep:Mod:XYZABCDE1234 →AlBrCl2 monomer
• 00:5900:59, 14 December 2014 diff hist 0 N File:SO ALBR2CL MONOMER OPT 2.mol No edit summary current
• 00:5800:58, 14 December 2014 diff hist 0 N File:SO AlBr2Cl MONOMER OPT 2 summ table.jpg No edit summary current
• 00:5600:56, 14 December 2014 diff hist +789 Rep:Mod:XYZABCDE1234 →AlBrCl2 monomer
• 00:5500:55, 14 December 2014 diff hist 0 N File:SO ALBR2CL MONOMER OPT 2.LOG No edit summary current
• 00:5400:54, 14 December 2014 diff hist +2 Rep:Mod:XYZABCDE1234 →AlBrCl2 monomer
• 00:5300:53, 14 December 2014 diff hist +21 Rep:Mod:XYZABCDE1234 →INORGANIC COMPUTATIONAL WEEK 2
• 00:4600:46, 14 December 2014 diff hist −13 Rep:Mod:XYZABCDE1234 →optimisation of isomer 3
• 00:4600:46, 14 December 2014 diff hist 0 N File:So Al2Br2Cl4 isomer 3 OPT 2.jpg No edit summary current
• 00:4100:41, 14 December 2014 diff hist +3 Rep:Mod:XYZABCDE1234 →IR spectrum of NH3BH3
• 00:3900:39, 14 December 2014 diff hist +60 Rep:Mod:XYZABCDE1234 →IR spectrum of isomer 1
• 00:3700:37, 14 December 2014 diff hist −3 Rep:Mod:XYZABCDE1234 →IR spectrum of NH3BH3
• 00:3700:37, 14 December 2014 diff hist 0 N File:SO AL2BR2CL4 OPT 3 P2 freq IR spec.jpg No edit summary current
• 00:3300:33, 14 December 2014 diff hist +33 Rep:Mod:XYZABCDE1234 →frequency calculation of isomer 1
• 00:3200:32, 14 December 2014 diff hist +309 Rep:Mod:XYZABCDE1234 →NBO analysis
• 00:2900:29, 14 December 2014 diff hist −6 Rep:Mod:XYZABCDE1234 →Geometry Comparison
• 00:2600:26, 14 December 2014 diff hist +10 Rep:Mod:XYZABCDE1234 →B3LYP/6-31G level
• 00:2600:26, 14 December 2014 diff hist +10 Rep:Mod:XYZABCDE1234 →B3LYP/3-21G level