User contributions for Msm11
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17 October 2013
- 11:1911:19, 17 October 2013 diff hist +1 Rep:Mod:msm11 →=Calculations for the dissociation energy
- 11:1811:18, 17 October 2013 diff hist +98 Rep:Mod:msm11 →Association energies of Ammonia-Borane
- 11:1811:18, 17 October 2013 diff hist +563 Rep:Mod:msm11 →=Calculations for the dissociation energy
- 11:1011:10, 17 October 2013 diff hist +389 Rep:Mod:msm11 →Optimisation of the structure of the molecule AlCl2Br
- 11:0511:05, 17 October 2013 diff hist +946 Rep:Mod:msm11 →Optimisation of the structure of the molecule AlCl2Br
- 11:0511:05, 17 October 2013 diff hist 0 N File:MSM11 - MONOMOER 2ND OPTIMISATION summary.txt No edit summary current
- 11:0511:05, 17 October 2013 diff hist 0 N File:MSM11 - MONOMOER 2ND OPTIMISATION.LOG No edit summary current
- 10:5810:58, 17 October 2013 diff hist +381 Rep:Mod:msm11 →Optimisation of the structure of the molecule AlCl2Br
- 10:5710:57, 17 October 2013 diff hist +1 Rep:Mod:msm11 →=Optimisation of the structure of the molecule AlCl2Br
- 10:5710:57, 17 October 2013 diff hist +348 Rep:Mod:msm11 →Dissociation energies of molecule 3 into 2 AlCl2Br molecules
- 10:5610:56, 17 October 2013 diff hist 0 N File:MSM11 - MONOMOER 1st OPTIMISATION summary.txt No edit summary current
- 10:5610:56, 17 October 2013 diff hist 0 N File:MSM11 - MONOMOER 1ST OPTIMISATION.LOG No edit summary current
- 10:5210:52, 17 October 2013 diff hist +1 Rep:Mod:msm11 →Association energies of Ammonia-Borane
- 10:5110:51, 17 October 2013 diff hist +81 Rep:Mod:msm11 →Analysis and discussions
- 10:2310:23, 17 October 2013 diff hist +302 Rep:Mod:msm11 →Comparison of results between BH3 and GaBr3
16 October 2013
- 14:3514:35, 16 October 2013 diff hist +176 Rep:Mod:msm11 →Natural bond order analysis
- 14:3314:33, 16 October 2013 diff hist −39 Rep:Mod:msm11 →Population analysis
- 14:3114:31, 16 October 2013 diff hist +46 Rep:Mod:msm11 →Population analysis
- 14:2914:29, 16 October 2013 diff hist +79 Rep:Mod:msm11 →Population analysis
- 14:2914:29, 16 October 2013 diff hist −85 Rep:Mod:msm11 →Population analysis
- 14:2814:28, 16 October 2013 diff hist +184 Rep:Mod:msm11 →Population analysis
- 14:2814:28, 16 October 2013 diff hist 0 N File:Msm11 - nh3 MO summary.txt No edit summary current
- 14:2714:27, 16 October 2013 diff hist 0 N File:MSM11 - NH3 MO.chk No edit summary current
- 14:2714:27, 16 October 2013 diff hist 0 N File:MSM11 - NH3 MO.LOG No edit summary current
- 14:2414:24, 16 October 2013 diff hist +236 Rep:Mod:msm11 →Population analysis
- 14:2114:21, 16 October 2013 diff hist +14 Rep:Mod:msm11 →Molecular orbitals of BH3
- 14:2014:20, 16 October 2013 diff hist +202 Rep:Mod:msm11 →Molecular orbitals of BH3
- 14:1714:17, 16 October 2013 diff hist −1 Rep:Mod:msm11 →Frequency analysis
- 14:1714:17, 16 October 2013 diff hist +72 Rep:Mod:msm11 →Creating and optimising Ammonia-Borane
- 14:1514:15, 16 October 2013 diff hist +5 Rep:Mod:msm11 →Frequency analysis
- 14:1414:14, 16 October 2013 diff hist +159 Rep:Mod:msm11 →Creating and optimising Ammonia-Borane
- 14:1214:12, 16 October 2013 diff hist +1 Rep:Mod:msm11 →Natural bond order analysis
- 14:0914:09, 16 October 2013 diff hist +4 Rep:Mod:msm11 →Second optimisation
- 14:0814:08, 16 October 2013 diff hist +1 Rep:Mod:msm11 →Week 1 - Laying the foundation
- 14:0714:07, 16 October 2013 diff hist −1 Rep:Mod:msm11 →Working with BBr3
- 14:0714:07, 16 October 2013 diff hist +470 Rep:Mod:msm11 →Working with BBr3
- 14:0314:03, 16 October 2013 diff hist +21 Rep:Mod:msm11 →2nd optimisation
- 14:0314:03, 16 October 2013 diff hist +826 Rep:Mod:msm11 →2nd optimisation
- 14:0014:00, 16 October 2013 diff hist +1 Rep:Mod:msm11 →Frequency analysis
- 14:0014:00, 16 October 2013 diff hist +216 Rep:Mod:msm11 →Frequency analysis
- 13:5813:58, 16 October 2013 diff hist +53 Rep:Mod:msm11 →Molecule 4
- 13:5813:58, 16 October 2013 diff hist +415 Rep:Mod:msm11 →Optimisation of the structure
- 13:4613:46, 16 October 2013 diff hist +195 Rep:Mod:msm11 →Frequency analysis
- 13:4413:44, 16 October 2013 diff hist +326 Rep:Mod:msm11 →Optimisation of the structure
- 13:4113:41, 16 October 2013 diff hist +1 Rep:Mod:msm11 →Frequency analysis
- 13:4113:41, 16 October 2013 diff hist +69 Rep:Mod:msm11 →Frequency analysis
- 13:4013:40, 16 October 2013 diff hist +4 Rep:Mod:msm11 →Frequency analysis
- 13:3913:39, 16 October 2013 diff hist +93 Rep:Mod:msm11 →Frequency analysis
- 13:3813:38, 16 October 2013 diff hist +111 Rep:Mod:msm11 →2nd optimisation
- 13:3713:37, 16 October 2013 diff hist +6 Rep:Mod:msm11 →1st optimisation