User contributions for Gck12
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18 November 2014
- 16:5416:54, 18 November 2014 diff hist +77 User:Gck12 →Frequency analysis B3LYP/6-31G(d,p)
- 16:4816:48, 18 November 2014 diff hist +9 User:Gck12 →Optimisation of Boratabenzene B3LYP/6-31G(d,p)
- 16:4716:47, 18 November 2014 diff hist 0 N File:Boratabenzenegk.mol No edit summary current
- 16:4616:46, 18 November 2014 diff hist +6 User:Gck12 →Optimisation of Boratabenzene B3LYP/6-31G(d,p)
- 16:4616:46, 18 November 2014 diff hist 0 N File:Boratabenzeneoptgk.PNG No edit summary current
- 16:4416:44, 18 November 2014 diff hist +1 User:Gck12 →Optimisation of Boratabenzene B3LYP/6-31G(d,p)
- 16:4316:43, 18 November 2014 diff hist +3 User:Gck12 →Optimisation of Boratabenzene B3LYP/6-31G(d,p)
- 16:4216:42, 18 November 2014 diff hist 0 N File:BORATABENZENEGK.LOG No edit summary current
- 16:4116:41, 18 November 2014 diff hist +17 User:Gck12 →Optimisation of Boratabenzene
- 16:4116:41, 18 November 2014 diff hist +755 User:Gck12 →Optimisation of Boratabenzene
- 16:4016:40, 18 November 2014 diff hist +43 User:Gck12 →Optimisation of benzene
- 16:2916:29, 18 November 2014 diff hist −4 User:Gck12 →Optimisation of aromatic molecules 6-31G
- 16:2716:27, 18 November 2014 diff hist 0 User:Gck12 →Population analisys of benzene B3LYP/6-31G(d,p)
- 16:2716:27, 18 November 2014 diff hist 0 User:Gck12 →Population analisys of benzene B3LYP/6-31G(d,p)
- 16:2716:27, 18 November 2014 diff hist +3 User:Gck12 →Population analisys of benzene B3LYP/6-31G(d,p)
- 16:2716:27, 18 November 2014 diff hist 0 N File:Nbobenzenegk.PNG No edit summary
- 16:2616:26, 18 November 2014 diff hist +107 User:Gck12 →Population analisys of benzene B3LYP/6-31G(d,p)
- 16:2116:21, 18 November 2014 diff hist +61 User:Gck12 →Frequency analysis B3LYP/6-31G(d,p)
17 November 2014
- 20:1720:17, 17 November 2014 diff hist +48 User:Gck12 →Optimisation of benzene 6-31G
- 18:5418:54, 17 November 2014 diff hist +33 User:Gck12 →Frequency analysis B3LYP/6-31G(d,p)
- 14:3214:32, 17 November 2014 diff hist +13 User:Gck12 →Frequency analysis B3LYP/6-31G(d,p)
- 14:0614:06, 17 November 2014 diff hist 0 User:Gck12 →Optimisation of benzene 6-31G
- 14:0514:05, 17 November 2014 diff hist +11 User:Gck12 →Frequency analysis B3LYP/6-31G(d,p)
- 14:0314:03, 17 November 2014 diff hist 0 User:Gck12 →Frequency analysis B3LYP/6-31G(d,p)
- 14:0214:02, 17 November 2014 diff hist 0 N File:BenzeneIRgk.PNG No edit summary current
- 14:0114:01, 17 November 2014 diff hist −1 User:Gck12 →Frequency analysis B3LYP/6-31G(d,p)
- 14:0114:01, 17 November 2014 diff hist 0 User:Gck12 →Frequency analysis B3LYP/6-31G(d,p)
- 13:5913:59, 17 November 2014 diff hist +1 User:Gck12 →Frequency analysis B3LYP/6-31G(d,p)
- 13:5913:59, 17 November 2014 diff hist 0 N File:Benzenefrequencygk.PNG No edit summary current
- 13:5813:58, 17 November 2014 diff hist +5 User:Gck12 →Frequency analysis B3LYP/6-31G(d,p)
- 13:5813:58, 17 November 2014 diff hist 0 N File:BENZENEFREQENCYGK.LOG No edit summary current
- 13:5713:57, 17 November 2014 diff hist 0 User:Gck12 →Frequency analysis B3LYP/6-31G(d,p)
- 13:5313:53, 17 November 2014 diff hist +881 User:Gck12 →Frequency analysis B3LYP/6-31G(d,p)
- 13:5013:50, 17 November 2014 diff hist +49 User:Gck12 →Optimisation of benzene 6-31G
- 13:4913:49, 17 November 2014 diff hist −4 User:Gck12 →Optimisation of benzene 6-31G
- 13:4913:49, 17 November 2014 diff hist 0 N File:BENZENEOPTGK.mol No edit summary
- 13:4813:48, 17 November 2014 diff hist −8 User:Gck12 →Optimisation of benzene 6-31G
- 13:4813:48, 17 November 2014 diff hist 0 N File:Benzeneoptgk.PNG No edit summary current
- 13:4813:48, 17 November 2014 diff hist +1 User:Gck12 →Optimisation of benzene 6-31G
- 13:4713:47, 17 November 2014 diff hist −5 User:Gck12 →Optimisation of benzene 6-31G
- 13:4713:47, 17 November 2014 diff hist 0 N File:BENZENEOPTGK.LOG No edit summary current
- 13:4413:44, 17 November 2014 diff hist 0 User:Gck12 →Frequency analysis B3LYP/6.21G(d,p)
- 13:4413:44, 17 November 2014 diff hist 0 User:Gck12 →NH3 B3LYP/6.21G(d,p)
- 13:4313:43, 17 November 2014 diff hist 0 User:Gck12 →Population analysis B3LYP/6.21G(d,p)
- 13:4313:43, 17 November 2014 diff hist 0 User:Gck12 →Optimisation of NH3BH3 B3LYP/6.21G(d,p)
- 13:4213:42, 17 November 2014 diff hist +777 User:Gck12 →Optimisation of benzene
- 13:4113:41, 17 November 2014 diff hist +35 User:Gck12 →Association energies: Ammonia-Borane