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User contributions for Wm1415

Results for Wm1415 talk block log uploads logs

A user with 813 edits. Account created on 29 February 2016.

13:3413:34, 15 December 2017 diff hist +352 Rep:Wm1415TransitionStates →Exercise 1

18:0718:07, 14 December 2017 diff hist +126 Rep:Wm1415TransitionStates →Frequency calculation of TS and IRC path
16:3216:32, 14 December 2017 diff hist +48 Rep:Wm1415TransitionStates →Frequency calculation of TS and IRC path
16:3216:32, 14 December 2017 diff hist 0 N File:Wm1415 Diels alder irc path movie.gif No edit summary current
15:3815:38, 14 December 2017 diff hist −3 Rep:Wm1415TransitionStates →Frequency calculation of TS and IRC path
15:3715:37, 14 December 2017 diff hist +27 Rep:Wm1415TransitionStates →Frequency calculation of TS and IRC path
15:3315:33, 14 December 2017 diff hist +2 Rep:Wm1415TransitionStates →Frequency calculation of TS and IRC path
15:2115:21, 14 December 2017 diff hist 0 Rep:Wm1415TransitionStates →Frequency calculation of TS and IRC path
15:2115:21, 14 December 2017 diff hist 0 Rep:Wm1415TransitionStates →Frequency calculation of TS and IRC path
15:0415:04, 14 December 2017 diff hist +62 Rep:Wm1415TransitionStates →Frequency calculation of TS and IRC path
14:5214:52, 14 December 2017 diff hist +192 Rep:Wm1415TransitionStates No edit summary
14:4014:40, 14 December 2017 diff hist +204 Rep:Wm1415TransitionStates →Optimisation of the reactants and transition state (PM6 level)
14:2114:21, 14 December 2017 diff hist +284 Rep:Wm1415TransitionStates →Optimisation of the reactants and transition state (PM6 level)
14:2114:21, 14 December 2017 diff hist 0 N File:Wm1415 DIELS ALDER TS PM6 GFPRINT.LOG No edit summary current
14:2014:20, 14 December 2017 diff hist 0 N File:Wm1415 BUTADIENE SCIS PM6 OPT GFPRINT.LOG No edit summary current
14:1714:17, 14 December 2017 diff hist +42 Rep:Wm1415TransitionStates →Optimisation of the reactants and transition state (PM6 level)
14:1614:16, 14 December 2017 diff hist +311 Rep:Wm1415TransitionStates →Exercise 1
14:1414:14, 14 December 2017 diff hist 0 N File:Wm1415 ETHENE PM6 OPT GFPRINT.LOG No edit summary current
11:0011:00, 14 December 2017 diff hist +48 Rep:Wm1415TransitionStates No edit summary

10:3810:38, 11 December 2017 diff hist +116 N Rep:Wm1415TransitionStates Created page with "'''This is William Micou's report on the Transition States computational lab, starting Monday 11th December 2017.'''"

11:5811:58, 6 December 2017 diff hist 0 Rep:WM1415MgO →Extension to other systems
11:5711:57, 6 December 2017 diff hist 0 Rep:WM1415MgO →The Quasi-Harmonic Approximation
06:4006:40, 6 December 2017 diff hist +11 Rep:WM1415MgO No edit summary
06:4006:40, 6 December 2017 diff hist +13 Rep:WM1415MgO No edit summary
06:3906:39, 6 December 2017 diff hist −19 Rep:WM1415MgO →Comparison with reference data
06:3906:39, 6 December 2017 diff hist +19 Rep:WM1415MgO →Comparison with reference data
06:3906:39, 6 December 2017 diff hist +16 Rep:WM1415MgO →Comparison with reference data
06:3706:37, 6 December 2017 diff hist +868 Rep:WM1415MgO →Conclusion
06:2006:20, 6 December 2017 diff hist +16 Rep:WM1415MgO No edit summary
06:1906:19, 6 December 2017 diff hist −333 Rep:WM1415MgO →References
06:1806:18, 6 December 2017 diff hist −8 Rep:WM1415MgO →Molecular Dynamics
06:1706:17, 6 December 2017 diff hist −157 Rep:WM1415MgO No edit summary
06:0006:00, 6 December 2017 diff hist +77 Rep:WM1415MgO →References
05:5805:58, 6 December 2017 diff hist +778 Rep:WM1415MgO →References
05:4805:48, 6 December 2017 diff hist +1,062 Rep:WM1415MgO No edit summary
05:2205:22, 6 December 2017 diff hist −1 Rep:WM1415MgO →Comparison with reference data
05:2205:22, 6 December 2017 diff hist −14 Rep:WM1415MgO →Comparison with reference data
05:2005:20, 6 December 2017 diff hist +15 Rep:WM1415MgO →Comparison with reference data
05:1805:18, 6 December 2017 diff hist −12 Rep:WM1415MgO →Comparison with reference data
05:1705:17, 6 December 2017 diff hist +17 Rep:WM1415MgO →Comparison with reference data
05:1605:16, 6 December 2017 diff hist +294 Rep:WM1415MgO →Comparison with reference data
05:1205:12, 6 December 2017 diff hist +257 Rep:WM1415MgO →Molecular Dynamics Simulation
05:0605:06, 6 December 2017 diff hist +132 Rep:WM1415MgO →Computing the coefficient of thermal expansion, \alpha
05:0505:05, 6 December 2017 diff hist −5 Rep:WM1415MgO →Free energy and lattice constant relationship with temperature
05:0405:04, 6 December 2017 diff hist +15 Rep:WM1415MgO →Free energy and lattice constant relationship with temperature
05:0205:02, 6 December 2017 diff hist 0 Rep:WM1415MgO →Free energy and lattice constant relationship with temperature
05:0105:01, 6 December 2017 diff hist +2 Rep:WM1415MgO →Extension to other systems
05:0005:00, 6 December 2017 diff hist +83 Rep:WM1415MgO →Phonon Modes
04:5604:56, 6 December 2017 diff hist −39 Rep:WM1415MgO →MgO Experiment
04:5504:55, 6 December 2017 diff hist +1 Rep:WM1415MgO →MgO Experiment

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