User contributions for Dv1111

21 March 2014

• 04:2204:22, 21 March 2014 diff hist 0 N File:Exo final features.PNG No edit summary current
• 04:1704:17, 21 March 2014 diff hist 0 N File:EXO structure-features.PNG No edit summary current
• 04:1104:11, 21 March 2014 diff hist −1 Rep:Mod:VilfyComp →Two possible transition States (Maleic Anhydride + Cyclohexa-1,3-diene)
• 04:1104:11, 21 March 2014 diff hist +502 Rep:Mod:VilfyComp No edit summary
• 03:5803:58, 21 March 2014 diff hist 0 N File:EndoTS123.PNG No edit summary current
• 03:5503:55, 21 March 2014 diff hist 0 N File:ExoTS123.PNG No edit summary current
• 03:5203:52, 21 March 2014 diff hist 0 N File:ExoTS output.PNG No edit summary current
• 03:4603:46, 21 March 2014 diff hist +3 Rep:Mod:VilfyComp →Cyclohexa-1,3-diene
• 03:4603:46, 21 March 2014 diff hist −1 Rep:Mod:VilfyComp →Exo/Endo Summary
• 03:4503:45, 21 March 2014 diff hist +44 Rep:Mod:VilfyComp No edit summary
• 03:4403:44, 21 March 2014 diff hist 0 N File:IRC path endo.PNG No edit summary current
• 03:4203:42, 21 March 2014 diff hist 0 N File:IRC path exo.PNG No edit summary current
• 03:4103:41, 21 March 2014 diff hist +1,538 Rep:Mod:VilfyComp No edit summary
• 03:2203:22, 21 March 2014 diff hist 0 N File:LUMO endo (-0.06773).PNG No edit summary current
• 03:2103:21, 21 March 2014 diff hist 0 N File:HOMO endo (-0.24230).PNG No edit summary current
• 03:2103:21, 21 March 2014 diff hist 0 N File:LUMO exo(-0.07839).PNG No edit summary current
• 03:1903:19, 21 March 2014 diff hist 0 N File:HOMO exo (-0.24217).PNG No edit summary current
• 03:1503:15, 21 March 2014 diff hist +195 Rep:Mod:VilfyComp →Transition state for the cycloaddition between cis-Butadiene and ethene
• 03:1203:12, 21 March 2014 diff hist 0 N File:IRC reverse.PNG No edit summary current
• 03:1203:12, 21 March 2014 diff hist 0 N File:IRC forward.PNG No edit summary current
• 03:1103:11, 21 March 2014 diff hist −2 Rep:Mod:VilfyComp →Transition state for the cycloaddition between cis-Butadiene and ethene
• 03:1003:10, 21 March 2014 diff hist 0 N File:IRC both ways.PNG No edit summary current
• 03:0903:09, 21 March 2014 diff hist +35 Rep:Mod:VilfyComp →Exo Transition State
• 02:4502:45, 21 March 2014 diff hist −5 Rep:Mod:VilfyComp →Exo Transition State
• 02:4502:45, 21 March 2014 diff hist 0 N File:EXOEXO.gif No edit summary current
• 02:4202:42, 21 March 2014 diff hist −6 Rep:Mod:VilfyComp →Endo Transition State
• 02:4202:42, 21 March 2014 diff hist +11 Rep:Mod:VilfyComp →Endo Transition State
• 02:4102:41, 21 March 2014 diff hist +25 Rep:Mod:VilfyComp →Exo Transition State
• 02:4102:41, 21 March 2014 diff hist 0 N File:EXOircMOVIE.gif No edit summary current
• 02:4002:40, 21 March 2014 diff hist +22 Rep:Mod:VilfyComp →Endo Transition State
• 02:4002:40, 21 March 2014 diff hist 0 N File:EndoIRCMovie.gif No edit summary current
• 02:3502:35, 21 March 2014 diff hist +149 Rep:Mod:VilfyComp No edit summary
• 02:3402:34, 21 March 2014 diff hist 0 N File:Exo JmolJ.mol No edit summary current
• 02:3202:32, 21 March 2014 diff hist 0 N File:EXO JMOL.mol No edit summary current
• 02:2902:29, 21 March 2014 diff hist −2 Rep:Mod:VilfyComp →Transition State calculations for cyclohexa-1,3-diene and maleic anhydride
• 02:2702:27, 21 March 2014 diff hist +33 Rep:Mod:VilfyComp →Cyclohexa-1,3-diene
• 02:2602:26, 21 March 2014 diff hist +15 Rep:Mod:VilfyComp →Cyclohexa-1,3-diene
• 02:2502:25, 21 March 2014 diff hist +12 Rep:Mod:VilfyComp →Cyclohexa-1,3-diene
• 02:2402:24, 21 March 2014 diff hist 0 Rep:Mod:VilfyComp →Transition state for the cycloaddition between cis-Butadiene and ethene
• 02:2302:23, 21 March 2014 diff hist +6 Rep:Mod:VilfyComp →Maleic anhydride
• 02:2302:23, 21 March 2014 diff hist +10 Rep:Mod:VilfyComp →Cyclohexa-1,3-diene
• 02:2202:22, 21 March 2014 diff hist +678 Rep:Mod:VilfyComp No edit summary
• 02:2202:22, 21 March 2014 diff hist 0 N File:Input file endo.PNG No edit summary current
• 02:1502:15, 21 March 2014 diff hist 0 N File:Input file exo.PNG No edit summary current
• 02:0402:04, 21 March 2014 diff hist +855 Rep:Mod:VilfyComp No edit summary
• 01:5201:52, 21 March 2014 diff hist 0 Rep:Mod:VilfyComp →Maleic anhydride
• 01:5101:51, 21 March 2014 diff hist +201 Rep:Mod:VilfyComp →Maleic anhydride
• 01:5001:50, 21 March 2014 diff hist +5 Rep:Mod:VilfyComp →Maleic anhydride
• 01:4901:49, 21 March 2014 diff hist 0 Rep:Mod:VilfyComp →Maleic anhydride
• 01:4901:49, 21 March 2014 diff hist 0 N File:Maleic Anhydride.PNG No edit summary current