User contributions for Lx812
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16 December 2014
- 16:4916:49, 16 December 2014 diff hist −13 User:Lx812 →Population Analysis
- 16:4916:49, 16 December 2014 diff hist −13 User:Lx812 →Population Analysis
- 16:4816:48, 16 December 2014 diff hist −48 User:Lx812 →Vibrational spectrum for [N(CH3)4]+
- 16:4716:47, 16 December 2014 diff hist −3 User:Lx812 →B3LYP/6-31G(d,p) level Frequency
- 16:4716:47, 16 December 2014 diff hist +1 User:Lx812 →Population Analysis
- 16:4616:46, 16 December 2014 diff hist −557 User:Lx812 →[N(CH3)4]+
- 16:4116:41, 16 December 2014 diff hist +1,624 User:Lx812 →NBO Analysis
- 15:1915:19, 16 December 2014 diff hist +28 User:Lx812 →Association energy
- 15:1215:12, 16 December 2014 diff hist −798 User:Lx812 →GaBr3
- 15:1115:11, 16 December 2014 diff hist +777 User:Lx812 →B3LYP/LANL2DZ level Optimisation
- 15:0815:08, 16 December 2014 diff hist −901 User:Lx812 →BH3
- 15:0715:07, 16 December 2014 diff hist +883 User:Lx812 →B3LYP/6-31G(d,p) level Optimisation
- 15:0315:03, 16 December 2014 diff hist +28 User:Lx812 →B3LYP/6-31G(d,p) level Frequency
- 15:0215:02, 16 December 2014 diff hist 0 N File:LX812 BH3 FREQ Summary n.PNG No edit summary current
- 15:0215:02, 16 December 2014 diff hist −22 User:Lx812 →B3LYP/6-31G(d,p) level Frequency
- 15:0015:00, 16 December 2014 diff hist 0 N File:LX BH3 FREQ 631G DP N.LOG No edit summary current
- 14:4314:43, 16 December 2014 diff hist −1 User:Lx812 →NBO Analysis
- 14:3714:37, 16 December 2014 diff hist −30 User:Lx812 →B3LYP/6-31G(d,p)LANL2DZ level Optimisation
- 14:3414:34, 16 December 2014 diff hist 0 N File:LX812 BBr3 opt gen DH3 summary.PNG No edit summary current
- 14:3314:33, 16 December 2014 diff hist 0 N File:LX812 BBr3 OPT GEN DH3.mol2 No edit summary current
- 14:3114:31, 16 December 2014 diff hist +365 User:Lx812 →B3LYP/6-31G(d,p) level Optimisation
- 14:2814:28, 16 December 2014 diff hist 0 N File:LX812 BH3 OPT 631gdp Summary n.PNG No edit summary current
- 14:2814:28, 16 December 2014 diff hist 0 N File:LX812 BH3 OPT 631gdp n.mol2 No edit summary current
- 14:2714:27, 16 December 2014 diff hist 0 File:LX BH3 OPT 631G DP.LOG Lx812 uploaded a new version of "File:LX BH3 OPT 631G DP.LOG" current
- 14:2314:23, 16 December 2014 diff hist −403 User:Lx812 →B3LYP/6-31G(d,p) level Optimisation
- 14:0214:02, 16 December 2014 diff hist +53 User:Lx812 →NBO Analysis
- 14:0014:00, 16 December 2014 diff hist 0 N File:LX SMe charge value.PNG No edit summary current
- 14:0014:00, 16 December 2014 diff hist 0 N File:LX SMe charge distribution.PNG No edit summary current
- 14:0014:00, 16 December 2014 diff hist −60 User:Lx812 →NBO Analysis
- 13:5913:59, 16 December 2014 diff hist 0 User:Lx812 →NBO Analysis
- 13:5813:58, 16 December 2014 diff hist +53 User:Lx812 →NBO Analysis
- 13:5713:57, 16 December 2014 diff hist 0 N File:LX PMe charge value.PNG No edit summary current
- 13:5713:57, 16 December 2014 diff hist 0 N File:LX PMe charge distribution.PNG No edit summary current
- 13:5613:56, 16 December 2014 diff hist −60 User:Lx812 →NBO Analysis
- 13:5613:56, 16 December 2014 diff hist −184 User:Lx812 →NBO Analysis
- 13:5513:55, 16 December 2014 diff hist +177 User:Lx812 →NBO Analysis
- 13:5213:52, 16 December 2014 diff hist 0 N File:LX NMe charge value.PNG No edit summary current
- 13:5113:51, 16 December 2014 diff hist 0 N File:LX NMe charge distribution.PNG No edit summary current
- 13:3713:37, 16 December 2014 diff hist +3 User:Lx812 →NBO Analysis
- 13:3713:37, 16 December 2014 diff hist +3 User:Lx812 →NBO Analysis
- 13:3713:37, 16 December 2014 diff hist +3 User:Lx812 →NBO Analysis
- 13:3613:36, 16 December 2014 diff hist +13 User:Lx812 →Vibrational spectrum for [S(CH3)3]+
- 13:3613:36, 16 December 2014 diff hist 0 N File:LX SMe IR.PNG No edit summary current
- 13:3413:34, 16 December 2014 diff hist 0 User:Lx812 →[S(CH3)3]+
- 13:3313:33, 16 December 2014 diff hist +161 User:Lx812 →B3LYP/6-31G(d,p) level Frequency
- 13:3213:32, 16 December 2014 diff hist 0 N File:LX SMe FREQ 631gdp summary.PNG No edit summary current
- 13:2813:28, 16 December 2014 diff hist +22 User:Lx812 →B3LYP/6-31G(d,p) level Optimisation
- 13:2713:27, 16 December 2014 diff hist 0 N File:LX SMe OPT 631gdp.mol2 No edit summary current
- 13:2713:27, 16 December 2014 diff hist +29 User:Lx812 →B3LYP/6-31G(d,p) level Optimisation
- 13:2713:27, 16 December 2014 diff hist 0 N File:LX SMe OPT 631gdp summary.PNG No edit summary current