User contributions for Etz13
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27 January 2016
- 14:2914:29, 27 January 2016 diff hist +95 Rep:Mod:ETZ13TS →Optimization of Chair TS with Guess Method
- 14:2814:28, 27 January 2016 diff hist 0 N File:Etz13 HFALLYL.LOG No edit summary current
- 14:2714:27, 27 January 2016 diff hist 0 Rep:Mod:ETZ13TS →Optimization of 1,5-hexadiene Conformers
- 14:2614:26, 27 January 2016 diff hist +16 Rep:Mod:ETZ13TS →Background
- 14:2514:25, 27 January 2016 diff hist 0 N File:Etz13 Cope.png No edit summary current
- 14:2414:24, 27 January 2016 diff hist +262 Rep:Mod:ETZ13TS →Intrinsic Reaction Coordinate of Chair TS
- 14:2114:21, 27 January 2016 diff hist 0 N File:Etz13 Irc check data.png No edit summary current
- 14:2114:21, 27 January 2016 diff hist 0 N File:Etz13 Irc check.png No edit summary current
- 14:1814:18, 27 January 2016 diff hist −59 Rep:Mod:ETZ13TS →Intrinsic Reaction Coordinate of Chair TS
- 14:1714:17, 27 January 2016 diff hist 0 Rep:Mod:ETZ13TS →Intrinsic Reaction Coordinate of Chair TS
- 14:1714:17, 27 January 2016 diff hist −2 Rep:Mod:ETZ13TS →Intrinsic Reaction Coordinate of Chair TS
- 14:1614:16, 27 January 2016 diff hist −2 Rep:Mod:ETZ13TS →Optimization of Chair TS with the Frozen Method
- 14:1414:14, 27 January 2016 diff hist +122 Rep:Mod:ETZ13TS →Optimization to Boat TS utilizing QST2
- 14:0914:09, 27 January 2016 diff hist −95 Rep:Mod:ETZ13TS →Comparison of different levels of theory
- 14:0514:05, 27 January 2016 diff hist 0 Rep:Mod:ETZ13TS →Comparison of the activation energies of the endo and exo TS
- 14:0414:04, 27 January 2016 diff hist +4 Rep:Mod:ETZ13TS →Comparison of the activation energies of the endo and exo TS
- 14:0314:03, 27 January 2016 diff hist +764 Rep:Mod:ETZ13TS →Comparison of the activation energies of the endo and exo TS
- 13:0013:00, 27 January 2016 diff hist −8 Rep:Mod:ETZ13TS →Comparison of the activation energies of the endo and exo TS
- 12:4712:47, 27 January 2016 diff hist 0 Rep:Mod:ETZ13TS →Background
- 12:4612:46, 27 January 2016 diff hist +186 Rep:Mod:ETZ13TS →Optimization of 1,5-hexadiene Conformers
- 12:4112:41, 27 January 2016 diff hist −4 Rep:Mod:ETZ13TS →Optimization of 1,5-hexadiene Conformers
- 12:3812:38, 27 January 2016 diff hist 0 N File:Etz13 Pi system.png No edit summary current
- 12:2212:22, 27 January 2016 diff hist −11 Rep:Mod:ETZ13TS →Optimization of 1,5-hexadiene Conformers
26 January 2016
- 20:5720:57, 26 January 2016 diff hist +46 Rep:Mod:ETZ13TS →Comparison of different levels of theory
- 20:5620:56, 26 January 2016 diff hist +31 Rep:Mod:ETZ13TS →Comparison of different levels of theory
- 20:5620:56, 26 January 2016 diff hist 0 N File:ETZ13 B3 ANTI2 TRY3.LOG No edit summary current
- 20:5520:55, 26 January 2016 diff hist +287 Rep:Mod:ETZ13TS →Optimization of 1,5-hexadiene Conformers
- 20:5420:54, 26 January 2016 diff hist 0 N File:ETZ13 HFANTI2 TRY2.LOG No edit summary current
- 20:5420:54, 26 January 2016 diff hist 0 N File:ETZ13 GAUCHE3.LOG No edit summary current
- 20:5120:51, 26 January 2016 diff hist 0 N File:ETZ13 GAUCHE4.LOG No edit summary current
- 20:4920:49, 26 January 2016 diff hist 0 N File:ETZ13 ANTI4.LOG No edit summary current
- 20:4720:47, 26 January 2016 diff hist +15 Rep:Mod:ETZ13TS →Comparison of the activation energies of the endo and exo TS
- 20:4020:40, 26 January 2016 diff hist +446 Rep:Mod:ETZ13TS →Optimization of Endo Transition State
- 20:2220:22, 26 January 2016 diff hist +1,045 Rep:Mod:ETZ13TS →Optimization of Exo Transition State
- 19:5719:57, 26 January 2016 diff hist −77 Rep:Mod:ETZ13TS →Diels Alder Cycloaddition of cyclohexa-1,3-diene and maleic anhydride
- 19:5619:56, 26 January 2016 diff hist +591 Rep:Mod:ETZ13TS →Optimization of Maleic Anhydride and Cyclohexa-1,3-diene
- 19:4919:49, 26 January 2016 diff hist +197 Rep:Mod:ETZ13TS →Optimization of cis-butadiene and ethylene TS
- 19:4519:45, 26 January 2016 diff hist +1,102 Rep:Mod:ETZ13TS →Optimization of cis-butadiene and ethylene TS
- 19:1619:16, 26 January 2016 diff hist +854 Rep:Mod:ETZ13TS →Optimization of cis-butadiene and ethylene TS
- 18:0418:04, 26 January 2016 diff hist −8 Rep:Mod:ETZ13TS →Optimization of cis-butadiene and ethylene TS
- 17:1817:18, 26 January 2016 diff hist +529 Rep:Mod:ETZ13TS →Optimization of cis-butadiene and ethylene TS
- 15:3715:37, 26 January 2016 diff hist +449 Rep:Mod:ETZ13TS →Activation Energies
- 15:1615:16, 26 January 2016 diff hist +142 Rep:Mod:ETZ13TS →Activation Energies
- 14:5914:59, 26 January 2016 diff hist 0 Rep:Mod:ETZ13TS →Activation Energies
- 14:3614:36, 26 January 2016 diff hist −7 Rep:Mod:ETZ13TS →Diels Alder Cycloaddition of cyclohexa-1,3-diene and maleic anhydride
- 14:3614:36, 26 January 2016 diff hist +269 Rep:Mod:ETZ13TS →Optimization of cis-butadiene and ethylene TS
- 14:3114:31, 26 January 2016 diff hist +553 Rep:Mod:ETZ13TS →Optimization of cis-butadiene and ethylene
- 14:2214:22, 26 January 2016 diff hist −2 Rep:Mod:ETZ13TS →Cope Rearrangement of 1,5-hexadiene
- 14:2114:21, 26 January 2016 diff hist −1 Rep:Mod:ETZ13TS →Comparison of different levels of theory
- 13:5913:59, 26 January 2016 diff hist +5 Rep:Mod:ETZ13TS →Computational Background