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User contributions for Wt1110

Results for Wt1110 talk block log uploads logs

A user with 567 edits. Account created on 15 October 2010.

14:2114:21, 19 October 2012 diff hist +254 m Rep:Mod:62367968 →NBO analysis
14:1914:19, 19 October 2012 diff hist +137 m Rep:Mod:62367968 →NBO analysis
14:1714:17, 19 October 2012 diff hist +1,936 m Rep:Mod:62367968 No edit summary
13:5913:59, 19 October 2012 diff hist +2 m Rep:Mod:62367968 →Mini Project - Aromaticity
13:5913:59, 19 October 2012 diff hist +6 m Rep:Mod:62367968 →Determination of the dissociation energy
13:5813:58, 19 October 2012 diff hist +3 m Rep:Mod:62367968 →Determination of the dissociation energy
13:5813:58, 19 October 2012 diff hist −9 m Rep:Mod:62367968 →Determination of the dissociation energy
13:5613:56, 19 October 2012 diff hist +116 m Rep:Mod:62367968 →Determination of the dissociation energy
13:5413:54, 19 October 2012 diff hist +283 m Rep:Mod:62367968 →Frequency analysis
13:5113:51, 19 October 2012 diff hist +146 m Rep:Mod:62367968 →Frequency analysis
13:5013:50, 19 October 2012 diff hist +147 m Rep:Mod:62367968 →6-31g (d,p) optimisation
13:5013:50, 19 October 2012 diff hist +139 m Rep:Mod:62367968 →3-21g optimisation
13:4813:48, 19 October 2012 diff hist +2 m Rep:Mod:62367968 →NH3BH3 Analysis
13:4813:48, 19 October 2012 diff hist +9 m Rep:Mod:62367968 →NH3BH3
13:4813:48, 19 October 2012 diff hist +5 m Rep:Mod:62367968 →NBO analysis of NH3
13:4713:47, 19 October 2012 diff hist +2 m Rep:Mod:62367968 →NBO analysis of NH3
13:4713:47, 19 October 2012 diff hist +49 m Rep:Mod:62367968 →NBO analysis of NH3
13:4613:46, 19 October 2012 diff hist +147 m Rep:Mod:62367968 →Population analysis
13:4513:45, 19 October 2012 diff hist −2 m Rep:Mod:62367968 →Frequency analysis
13:4413:44, 19 October 2012 diff hist +149 m Rep:Mod:62367968 →Frequency analysis
13:4413:44, 19 October 2012 diff hist +149 m Rep:Mod:62367968 →TlBr3 vibrational analysis
13:4313:43, 19 October 2012 diff hist +1 m Rep:Mod:62367968 →BH3 vibrational analysis
13:4213:42, 19 October 2012 diff hist +163 m Rep:Mod:62367968 →NH3 optimisation practice
13:4113:41, 19 October 2012 diff hist +201 m Rep:Mod:62367968 →Molecular orbitals of BH3
13:3713:37, 19 October 2012 diff hist +165 m Rep:Mod:62367968 →Molecular orbitals of BH3
13:3513:35, 19 October 2012 diff hist +1 m Rep:Mod:62367968 →Molecular orbitals of BH3
13:3513:35, 19 October 2012 diff hist +146 m Rep:Mod:62367968 →Molecular orbitals of BH3
13:3413:34, 19 October 2012 diff hist +36 m Rep:Mod:62367968 →TlBr3 vibrational analysis
13:3313:33, 19 October 2012 diff hist +10 m Rep:Mod:62367968 →TlBr3 vibrational analysis
13:3213:32, 19 October 2012 diff hist +109 m Rep:Mod:62367968 →TlBr3 vibrational analysis
13:3113:31, 19 October 2012 diff hist −15 m Rep:Mod:62367968 →TlBr3 vibrational analysis
13:3013:30, 19 October 2012 diff hist +21 m Rep:Mod:62367968 →TlBr3 vibrational analysis
13:3013:30, 19 October 2012 diff hist +79 m Rep:Mod:62367968 →BH3 vibrational analysis
13:2913:29, 19 October 2012 diff hist +1 m Rep:Mod:62367968 →BBr3 - optimisation using a mixture of basis sets and pseudo potentials
13:2813:28, 19 October 2012 diff hist −3 m Rep:Mod:62367968 →BBr3 - optimisation using a mixture of basis sets and pseudo potentials
13:2813:28, 19 October 2012 diff hist +187 m Rep:Mod:62367968 →BH3 - B3LYP, 6-31G d,p optimisation
13:2613:26, 19 October 2012 diff hist +112 m Rep:Mod:62367968 →BH3 vibrational analysis
13:2413:24, 19 October 2012 diff hist +2 m Rep:Mod:62367968 →Comparison of bond distances
13:2313:23, 19 October 2012 diff hist −8 m Rep:Mod:62367968 →BBr3 - optimisation using a mixture of basis sets and pseudo potentials
13:2313:23, 19 October 2012 diff hist +607 m Rep:Mod:62367968 →BBr3 - optimisation using a mixture of basis sets and pseudo potentials
13:2213:22, 19 October 2012 diff hist +1 m Rep:Mod:62367968 →TlBr3 - optimisations using pseudo-potentials (LanL2DZ)
13:2113:21, 19 October 2012 diff hist +524 m Rep:Mod:62367968 →TlBr3 - optimisations using pseudo-potentials (LanL2DZ)
13:2013:20, 19 October 2012 diff hist +2 Rep:Mod:62367968 →Total energies of BH3 optimisations
13:2013:20, 19 October 2012 diff hist +257 m Rep:Mod:62367968 →BH3 - B3LYP, 6-31G d,p optimisation
13:1813:18, 19 October 2012 diff hist −4 m Rep:Mod:62367968 →BH3 - B3LYP, 3-21G optimisation
13:1813:18, 19 October 2012 diff hist +4 m Rep:Mod:62367968 →BH3 - B3LYP, 3-21G optimisation
13:1813:18, 19 October 2012 diff hist +12 m Rep:Mod:62367968 →BH3 - B3LYP, 3-21G optimisation
13:1713:17, 19 October 2012 diff hist +3 m Rep:Mod:62367968 →BH3 - B3LYP, 3-21G optimisation
13:1713:17, 19 October 2012 diff hist +435 m Rep:Mod:62367968 →BH3 - B3LYP, 3-21G optimisation
13:1613:16, 19 October 2012 diff hist −6 m Rep:Mod:62367968 →Optimisation of a molecule

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