User contributions for Tc408
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15 March 2011
- 15:5215:52, 15 March 2011 diff hist 0 Rep:Mod:bitoku →Optimisation and frequency analysis of molecule '''3'''
- 15:5215:52, 15 March 2011 diff hist 0 N File:1502vibmolecule3.gif No edit summary current
- 15:5215:52, 15 March 2011 diff hist 0 N File:1439vibmolecule3.gif No edit summary current
- 15:5215:52, 15 March 2011 diff hist 0 N File:825vibmolecule3.gif No edit summary current
- 15:5215:52, 15 March 2011 diff hist +159 Rep:Mod:bitoku →Optimisation and frequency analysis of molecule '''3'''
- 15:5015:50, 15 March 2011 diff hist +1,477 Rep:Mod:bitoku →Optimisation and frequency analysis of molecule '''3'''
- 15:2815:28, 15 March 2011 diff hist +447 Rep:Mod:bitoku →Optimisation and frequency analysis of molecule '''3'''
- 15:2515:25, 15 March 2011 diff hist 0 N File:Molecule3vibaanalysis.txt No edit summary current
- 15:2515:25, 15 March 2011 diff hist +36 Rep:Mod:bitoku →Optimisation and frequency analysis of molecule '''3'''
- 15:2415:24, 15 March 2011 diff hist +518 Rep:Mod:bitoku →Optimisation and frequency analysis of molecule '''3'''
- 15:1615:16, 15 March 2011 diff hist 0 N File:Molecule3optchavas.gif No edit summary current
- 15:1515:15, 15 March 2011 diff hist 0 N File:Molecule3preoptTEJ.gif No edit summary current
- 15:1415:14, 15 March 2011 diff hist 0 N File:Molecule3preoptchavas.mol No edit summary current
- 15:1315:13, 15 March 2011 diff hist 0 N File:Molecule3preoptchavas.mol2 No edit summary current
- 15:1315:13, 15 March 2011 diff hist +421 Rep:Mod:bitoku →Optimisation and frequency analysis of molecule '''3'''
- 15:0215:02, 15 March 2011 diff hist 0 N File:Molecule3optTEJ.mol No edit summary current
- 15:0215:02, 15 March 2011 diff hist +219 Rep:Mod:bitoku →Optimisation and frequency analysis of molecule '''3'''
- 15:0115:01, 15 March 2011 diff hist +68 Rep:Mod:bitoku →Optimisation and frequency analysis of molecule '''3'''
- 14:5814:58, 15 March 2011 diff hist +30 Rep:Mod:bitoku →Optimisation and frequency analysis of molecule '''3'''
- 14:5614:56, 15 March 2011 diff hist 0 N File:Molecule3yyny.txt No edit summary current
- 14:5614:56, 15 March 2011 diff hist +18 Rep:Mod:bitoku →Optimisation and frequency analysis of molecule '''3'''
- 14:5114:51, 15 March 2011 diff hist +7 Rep:Mod:bitoku →Optimisation and frequency analysis of molecule '''1'''
- 14:5014:50, 15 March 2011 diff hist −741 Rep:Mod:bitoku →Optimisation and frequency analysis of molecule '''1'''
- 14:4914:49, 15 March 2011 diff hist 0 N File:1484vibTEJ.gif No edit summary current
- 14:4914:49, 15 March 2011 diff hist 0 N File:786vibTEJ.gif No edit summary current
- 14:4814:48, 15 March 2011 diff hist +100 Rep:Mod:bitoku →Optimisation and frequency analysis of molecule '''2'''
- 14:4714:47, 15 March 2011 diff hist +1,036 Rep:Mod:bitoku →Optimisation and frequency analysis of molecule '''2'''
- 14:2314:23, 15 March 2011 diff hist +87 m Rep:Mod:bitoku →Optimisation and frequency analysis of molecule '''1'''
- 14:2214:22, 15 March 2011 diff hist 0 N File:3624vibrationTEJ.gif No edit summary current
- 14:2214:22, 15 March 2011 diff hist 0 N File:1254vibrationTEJ.gif No edit summary current
- 14:2214:22, 15 March 2011 diff hist +166 Rep:Mod:bitoku →Optimisation and frequency analysis of molecule '''1'''
- 14:1814:18, 15 March 2011 diff hist +478 Rep:Mod:bitoku →Optimisation and frequency analysis of molecule '''2'''
- 14:1214:12, 15 March 2011 diff hist +131 Rep:Mod:bitoku →Optimisation and frequency analysis of molecule '''2'''
- 14:1014:10, 15 March 2011 diff hist −1,363 Rep:Mod:bitoku →Using Pseudo-potentials and Larger Basis Sets
- 14:0914:09, 15 March 2011 diff hist +739 Rep:Mod:bitoku →Optimisation and frequency analysis of molecule '''2'''
- 13:5613:56, 15 March 2011 diff hist 0 N File:Molecule2vibanalysisTEJ.txt No edit summary current
- 13:5513:55, 15 March 2011 diff hist +286 Rep:Mod:bitoku →Optimisation and frequency analysis of molecule '''2'''
- 13:4913:49, 15 March 2011 diff hist 0 N File:Molecule2straightchavas.txt No edit summary current
- 13:4813:48, 15 March 2011 diff hist +36 Rep:Mod:bitoku →Optimisation and frequency analysis of molecule '''2'''
- 13:4713:47, 15 March 2011 diff hist 0 N File:Molecule2linearTEJ.gif No edit summary current
- 13:4713:47, 15 March 2011 diff hist 0 N File:Molecule2linear.gif No edit summary current
- 13:4713:47, 15 March 2011 diff hist −10 Rep:Mod:bitoku →Optimisation and frequency analysis of molecule '''2'''
- 13:4513:45, 15 March 2011 diff hist 0 N File:Molecule1linearoptimisationfailTEJ.mol No edit summary current
- 13:4513:45, 15 March 2011 diff hist +40 Rep:Mod:bitoku →Optimisation and frequency analysis of molecules '''1''', '''2''' and '''3'''
- 13:4413:44, 15 March 2011 diff hist 0 N File:Molecule2linearoptchavas.mol No edit summary current
- 13:4413:44, 15 March 2011 diff hist +15 Rep:Mod:bitoku →Optimisation and frequency analysis of molecules '''1''', '''2''' and '''3'''
- 13:4313:43, 15 March 2011 diff hist +799 Rep:Mod:bitoku →Optimisation and frequency analysis of molecules '''1''', '''2''' and '''3'''
- 13:4313:43, 15 March 2011 diff hist 0 N File:Molecule2optfailjmol.mol2 No edit summary current
- 13:4213:42, 15 March 2011 diff hist 0 N File:Molecule2straightjmol.mol2 No edit summary current
- 13:3213:32, 15 March 2011 diff hist +96 Rep:Mod:bitoku →Optimisation and frequency analysis of molecules '''1''', '''2''' and '''3'''