User contributions for Lx812
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16 December 2014
- 13:2513:25, 16 December 2014 diff hist +5 User:Lx812 →Population Analysis
- 13:2413:24, 16 December 2014 diff hist +5 User:Lx812 →B3LYP/6-31G(d,p) level Frequency
- 13:2313:23, 16 December 2014 diff hist 0 User:Lx812 →[S(CH3)3]+
- 13:2213:22, 16 December 2014 diff hist +295 User:Lx812 →Vibrational spectrum for [P(CH3)4]+
- 13:2113:21, 16 December 2014 diff hist +5 User:Lx812 →Population Analysis
- 13:2013:20, 16 December 2014 diff hist −207 User:Lx812 →NBO Analysis
- 13:2013:20, 16 December 2014 diff hist +273 User:Lx812 →MO Analysis
- 13:1913:19, 16 December 2014 diff hist +1,095 User:Lx812 →[P(CH3)4]+
- 13:0613:06, 16 December 2014 diff hist 0 User:Lx812 →BH3 MO
- 13:0513:05, 16 December 2014 diff hist +5 User:Lx812 →Population Analysis
- 13:0413:04, 16 December 2014 diff hist +2 User:Lx812 →NBO Analysis
- 13:0313:03, 16 December 2014 diff hist +71 User:Lx812 →MO Analysis
- 13:0213:02, 16 December 2014 diff hist +5 User:Lx812 →Population Analysis
- 13:0113:01, 16 December 2014 diff hist +2 User:Lx812 →NBO Analysis
- 13:0113:01, 16 December 2014 diff hist +38 User:Lx812 →Population Analysis
- 12:5912:59, 16 December 2014 diff hist +30 User:Lx812 →MO Analysis
- 12:5712:57, 16 December 2014 diff hist +13 User:Lx812 →Vibrational spectrum for [P(CH3)4]+
- 12:5712:57, 16 December 2014 diff hist 0 N File:LX PMe IR.PNG No edit summary current
- 12:5312:53, 16 December 2014 diff hist +30 User:Lx812 →B3LYP/6-31G(d,p) level Frequency
- 12:5312:53, 16 December 2014 diff hist 0 N File:LX PMe FREQ 631gdp summary.PNG No edit summary current
- 12:5312:53, 16 December 2014 diff hist +136 User:Lx812 →B3LYP/6-31G(d,p) level Frequency
- 12:4712:47, 16 December 2014 diff hist +25 User:Lx812 →B3LYP/6-31G(d,p) level Optimisation
- 12:4712:47, 16 December 2014 diff hist 0 N File:LX812 PMe OPT 631gdp.mol2 No edit summary current
- 12:4512:45, 16 December 2014 diff hist +29 User:Lx812 →B3LYP/6-31G(d,p) level Optimisation
- 12:4412:44, 16 December 2014 diff hist 0 N File:LX PMe OPT 631gdp summary.PNG No edit summary current
- 12:4312:43, 16 December 2014 diff hist +287 User:Lx812 →[P(CH3)4]+
- 12:4112:41, 16 December 2014 diff hist +1,026 User:Lx812 →[N(CH3)4]+
- 12:3812:38, 16 December 2014 diff hist +224 User:Lx812 →Vibrational spectrum for [N(CH3)4]+
- 12:3612:36, 16 December 2014 diff hist −238 User:Lx812 →Vibrational spectrum for [N(CH3)4]+
- 12:2012:20, 16 December 2014 diff hist 0 User:Lx812 →Vibrational spectrum for [N(CH3)4]+
- 12:2012:20, 16 December 2014 diff hist 0 N File:LX NMe IR.PNG No edit summary current
- 12:1712:17, 16 December 2014 diff hist +29 User:Lx812 →[N(CH3)4]+
- 12:1412:14, 16 December 2014 diff hist +427 User:Lx812 →B3LYP/6-31G(d,p) level Frequency
- 12:1212:12, 16 December 2014 diff hist +30 User:Lx812 →B3LYP/6-31G(d,p) level Frequency
- 12:1212:12, 16 December 2014 diff hist 0 N File:LX NMe FREQ 631gdp summary.PNG No edit summary current
- 12:0912:09, 16 December 2014 diff hist −51 User:Lx812 →B3LYP/6-31G(d,p) level Frequency
- 12:0512:05, 16 December 2014 diff hist +359 User:Lx812 →B3LYP/6-31G(d,p) level Optimisation
- 12:0412:04, 16 December 2014 diff hist −44 User:Lx812 →[N(CH3)4]+
- 12:0312:03, 16 December 2014 diff hist +39 User:Lx812 →[N(CH3)4] +
- 12:0312:03, 16 December 2014 diff hist +7 User:Lx812 →B3LYP/6-31G(d,p) level Optimisation
- 12:0212:02, 16 December 2014 diff hist 0 N File:LX812 ILP NMe OPT 631gdp.mol2 No edit summary current
- 12:0112:01, 16 December 2014 diff hist 0 User:Lx812 →B3LYP/6-31G(d,p) level Optimisation
- 11:5611:56, 16 December 2014 diff hist 0 N File:LX NMe opt 631gdp summary.PNG No edit summary current
- 11:5511:55, 16 December 2014 diff hist −16 User:Lx812 →B3LYP/6-31G(d,p) level Optimisation
- 11:5211:52, 16 December 2014 diff hist +819 User:Lx812 →Association energy
15 December 2014
- 03:2103:21, 15 December 2014 diff hist −1,902 User:Lx812 →NBO Analysis
- 03:1803:18, 15 December 2014 diff hist +1,675 User:Lx812 →NBO Analysis
- 03:1103:11, 15 December 2014 diff hist +46 User:Lx812 →NBO Analysis
- 03:1003:10, 15 December 2014 diff hist 0 N File:LX NH3 Natural Population Analysis summary.PNG No edit summary current
- 03:0903:09, 15 December 2014 diff hist +181 User:Lx812 →NBO Analysis