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User contributions for Jb3912

Results for Jb3912 talk block log uploads logs

A user with 734 edits. Account created on 10 November 2014.

19:1019:10, 17 November 2014 diff hist 0 File:JBao isomer3 NBO.GIF Jb3912 uploaded a new version of "File:JBao isomer3 NBO.GIF" current
18:5318:53, 17 November 2014 diff hist +234 Rep:Mod:bei1994 →Additional: NBO charge analysis
18:4018:40, 17 November 2014 diff hist 0 N File:JBao isomer3 NBO.GIF No edit summary
18:3418:34, 17 November 2014 diff hist 0 Rep:Mod:bei1994 →Frequency: B3LYP/Al, Cl: 6-31G(d,p)/Br: LanL2DZ
18:3418:34, 17 November 2014 diff hist +193 Rep:Mod:bei1994 →Additional: Geometry comparison
18:3218:32, 17 November 2014 diff hist −6 Rep:Mod:bei1994 →Additional: Geometry comparison
18:3218:32, 17 November 2014 diff hist +6 Rep:Mod:bei1994 →Additional: Geometry comparison
18:2918:29, 17 November 2014 diff hist +1 Rep:Mod:bei1994 →MO analysis: B3LYP/Al, Cl: 6-31G(d,p)/Br: LanL2DZ
18:2918:29, 17 November 2014 diff hist −3 Rep:Mod:bei1994 →Frequency: B3LYP/Al, Cl: 6-31G(d,p)/Br: LanL2DZ
18:2818:28, 17 November 2014 diff hist +569 Rep:Mod:bei1994 →MO analysis: B3LYP/Al, Cl: 6-31G(d,p)/Br: LanL2DZ
18:2718:27, 17 November 2014 diff hist +1 Rep:Mod:bei1994 →Additional: NBO charge analysis
18:2618:26, 17 November 2014 diff hist +1 Rep:Mod:bei1994 →Additional: NBO charge analysis
18:2518:25, 17 November 2014 diff hist +1 Rep:Mod:bei1994 →Additional: NBO charge analysis
18:2518:25, 17 November 2014 diff hist +1 Rep:Mod:bei1994 →Additional: NBO charge analysis
18:2518:25, 17 November 2014 diff hist +10 Rep:Mod:bei1994 →Additional: NBO charge analysis
18:2418:24, 17 November 2014 diff hist +253 Rep:Mod:bei1994 →3rd Year Computational Lab - Inorganic module - Mini Project: Lewis Acids and Bases
18:1818:18, 17 November 2014 diff hist +1,775 Rep:Mod:bei1994 →Additional: NBO charge analysis
17:2817:28, 17 November 2014 diff hist +742 Rep:Mod:bei1994 →Additional: NBO charge analysis
16:5616:56, 17 November 2014 diff hist +1,713 Rep:Mod:bei1994 →Additional: NBO charge analysis
16:5016:50, 17 November 2014 diff hist +3,272 Rep:Mod:bei1994 →Frequency: B3LYP/Al, Cl: 6-31G(d,p)/Br: LanL2DZ
16:0916:09, 17 November 2014 diff hist −54 Rep:Mod:bei1994 →Frequency: B3LYP/Al, Cl: 6-31G(d,p)/Br: LanL2DZ
16:0916:09, 17 November 2014 diff hist 0 N File:JBao monomer IRspectra.GIF No edit summary current
16:0716:07, 17 November 2014 diff hist 0 N File:JBao monomer FREQtable.GIF No edit summary current
16:0216:02, 17 November 2014 diff hist +905 Rep:Mod:bei1994 →Frequency: B3LYP/Al, Cl: 6-31G(d,p)/Br: LanL2DZ
15:5515:55, 17 November 2014 diff hist +758 Rep:Mod:bei1994 →Frequency: B3LYP/Al, Cl: 6-31G(d,p)/Br: LanL2DZ
15:5215:52, 17 November 2014 diff hist +477 Rep:Mod:bei1994 →Frequency: B3LYP/Al, Cl: 6-31G(d,p)/Br: LanL2DZ
15:5115:51, 17 November 2014 diff hist 0 N File:JBao isomer4 1uBr IRspectra.GIF No edit summary current
15:4915:49, 17 November 2014 diff hist 0 N File:JBao isomer4 1uBr FREQtable.GIF No edit summary current
15:4615:46, 17 November 2014 diff hist +526 Rep:Mod:bei1994 →Frequency: B3LYP/Al, Cl: 6-31G(d,p)/Br: LanL2DZ
15:4615:46, 17 November 2014 diff hist 0 N File:Jbao isomer3 transBr IRspectra.GIF No edit summary current
15:4315:43, 17 November 2014 diff hist 0 N File:Jbao isomer3 transBr FREQtable.GIF No edit summary current
15:4015:40, 17 November 2014 diff hist +519 Rep:Mod:bei1994 →Frequency: B3LYP/Al, Cl: 6-31G(d,p)/Br: LanL2DZ
15:3815:38, 17 November 2014 diff hist 0 N File:JBao isomer2 cisBr IRspectra.GIF No edit summary current
15:3615:36, 17 November 2014 diff hist 0 N File:JBao isomer2 cisBr freqTable.GIF No edit summary current
15:3215:32, 17 November 2014 diff hist +10 Rep:Mod:bei1994 →Frequency: B3LYP/Al, Cl: 6-31G(d,p)/Br: LanL2DZ
15:3115:31, 17 November 2014 diff hist 0 N File:JBao isomer1 2uBr IRspectra.GIF No edit summary current
15:2715:27, 17 November 2014 diff hist 0 N File:JBao isomer1 2uBr freqTable.GIF No edit summary current
15:1215:12, 17 November 2014 diff hist +459 Rep:Mod:bei1994 →MO analysis: B3LYP/Al, Cl: 6-31G(d,p)/Br: LanL2DZ
14:5714:57, 17 November 2014 diff hist +2 Rep:Mod:bei1994 →MO analysis: B3LYP/Al, Cl: 6-31G(d,p)/Br: LanL2DZ
14:5714:57, 17 November 2014 diff hist +35 Rep:Mod:bei1994 →MO analysis: BL
14:5614:56, 17 November 2014 diff hist +1 Rep:Mod:bei1994 →Frequency: B3LYP/Al, Cl: 6-31G(d,p)/Br: LanL2DZ
14:5614:56, 17 November 2014 diff hist +384 Rep:Mod:bei1994 →MO analysis
14:5214:52, 17 November 2014 diff hist +105 Rep:Mod:bei1994 →MO analysis
14:4614:46, 17 November 2014 diff hist +1 Rep:Mod:bei1994 →Optimisation: B3LYP/Al, Cl: 6-31G(d,p)/Br: LanL2DZ
14:4614:46, 17 November 2014 diff hist −1 Rep:Mod:bei1994 →3rd Year Computational Lab - Inorganic module - Mini Project: Lewis Acids and Bases
14:4614:46, 17 November 2014 diff hist +2 Rep:Mod:bei1994 →3rd Year Computational Lab - Inorganic module - Mini Project: Lewis Acids and Bases
14:4514:45, 17 November 2014 diff hist 0 Rep:Mod:bei1994 →NH3 - BH3: B3LYP/6-31G(d,p) level
14:4514:45, 17 November 2014 diff hist 0 Rep:Mod:bei1994 →NH3: B3LYP/6-31G(d,p) level
14:4514:45, 17 November 2014 diff hist +144 Rep:Mod:bei1994 →BH3 MO analysis : B3LYP/6-31G(d,p) level
14:2414:24, 17 November 2014 diff hist +3 Rep:Mod:bei1994 →Additional: Geometry comparison

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