User contributions for Etz13
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24 January 2016
- 16:3916:39, 24 January 2016 diff hist 0 N File:Etz13 BUTADIENE ETHENE DA.LOG No edit summary current
- 16:3916:39, 24 January 2016 diff hist 0 N File:Etz13 Butadiene ethene DA data.png No edit summary current
- 16:3816:38, 24 January 2016 diff hist 0 N File:Etz13 Butadiene ethene DA.png No edit summary current
- 16:2416:24, 24 January 2016 diff hist +4 Rep:Mod:ETZ13TS →Optimization of cis-butadiene and ethylene
- 16:2216:22, 24 January 2016 diff hist +55 Rep:Mod:ETZ13TS →Diels Alder Cycloaddition of cis-butadiene and ethylene
- 16:2016:20, 24 January 2016 diff hist +441 Rep:Mod:ETZ13TS →Diels Alder Cycloaddition of cis-butadiene and ethylene
- 16:1916:19, 24 January 2016 diff hist 0 N File:Etz13 Ethene LUMO.png No edit summary current
- 16:1916:19, 24 January 2016 diff hist 0 N File:Etz13 Ethene HOMO.png No edit summary current
- 16:1016:10, 24 January 2016 diff hist 0 N File:Etz13 Ethene data.png No edit summary current
- 16:0916:09, 24 January 2016 diff hist 0 N File:Etz13 Ethene.png No edit summary current
- 16:0216:02, 24 January 2016 diff hist +14 Rep:Mod:ETZ13TS →Diels Alder Cycloaddition of cis-butadiene and ethylene
- 16:0116:01, 24 January 2016 diff hist −494 Rep:Mod:ETZ13TS →Diels Alder Cycloaddition of cis-butadiene and ethylene
- 16:0016:00, 24 January 2016 diff hist 0 N File:Etz13 Cis butadiene LUMO.png No edit summary current
- 15:5915:59, 24 January 2016 diff hist 0 N File:Etz13 Cis butadiene HOMO.png No edit summary current
- 15:5415:54, 24 January 2016 diff hist +825 Rep:Mod:ETZ13TS →Diels Alder Cycloaddition of cis-butadiene and ethylene
- 15:4815:48, 24 January 2016 diff hist 0 N File:CIS BUTADIENE ORBITALS 2.LOG No edit summary current
- 15:4015:40, 24 January 2016 diff hist 0 N File:Etz13 Cis butadiene data.png No edit summary current
- 15:3915:39, 24 January 2016 diff hist 0 N File:Etz13 Cis butadiene.png No edit summary current
- 15:3115:31, 24 January 2016 diff hist +177 Rep:Mod:ETZ13TS →Activation Energies of TS with B3LYP/6-31G(d)
- 15:2815:28, 24 January 2016 diff hist +50 Rep:Mod:ETZ13TS →Activation Energies of TS with B3LYP/6-31G(d)
- 15:1915:19, 24 January 2016 diff hist +623 Rep:Mod:ETZ13TS →Activation Energies of TS with B3LYP/6-31G(d)
- 14:5114:51, 24 January 2016 diff hist +56 Rep:Mod:ETZ13TS →Activation Energies of TS with B3LYP/6-31G(d)
- 14:5014:50, 24 January 2016 diff hist +113 Rep:Mod:ETZ13TS →Activation Energies of TS with B3LYP/6-31G(d)
- 14:3714:37, 24 January 2016 diff hist −1 Rep:Mod:ETZ13TS →Intrinsic Reaction Coordinate of Chair TS
- 14:3614:36, 24 January 2016 diff hist +33 Rep:Mod:ETZ13TS →Optimization to Boat TS utilizing QST2
- 14:1614:16, 24 January 2016 diff hist +255 Rep:Mod:ETZ13TS →Optimization of Chair and Boat Transition Structures
- 14:0114:01, 24 January 2016 diff hist −1 Rep:Mod:ETZ13TS →Optimization of Chair TS utilizing Redundant Coordinates
- 14:0014:00, 24 January 2016 diff hist +191 Rep:Mod:ETZ13TS →Optimization of Chair TS utilizing Redundant Coordinates
- 13:5813:58, 24 January 2016 diff hist 0 N File:ETZ13 CHAIR TS FREEZE2.LOG No edit summary current
- 13:5513:55, 24 January 2016 diff hist +25 Rep:Mod:ETZ13TS →Optimization of Chair TS utilizing Berny
- 13:5213:52, 24 January 2016 diff hist +189 Rep:Mod:ETZ13TS →Optimization of Chair TS utilizing Berny
- 13:4713:47, 24 January 2016 diff hist −33 Rep:Mod:ETZ13TS →Optimization of Chair TS utilizing Berny
22 January 2016
- 22:0622:06, 22 January 2016 diff hist +81 Rep:Mod:ETZ13TS →Diels Alder Cycloaddition of cis-butadiene and ethylene
- 20:5920:59, 22 January 2016 diff hist +10 Rep:Mod:ETZ13TS →Optimization to Boat TS utilizing QST2
- 17:3117:31, 22 January 2016 diff hist +223 Rep:Mod:ETZ13TS →Activation Energies of TS with B3LYP/6-31G(d)
- 17:3017:30, 22 January 2016 diff hist 0 N File:B3 CHAIR TS.LOG No edit summary current
- 17:2417:24, 22 January 2016 diff hist 0 Rep:Mod:ETZ13TS →Activation Energies of TS with B3LYP/6-31G(d)
- 17:2317:23, 22 January 2016 diff hist 0 Rep:Mod:ETZ13TS →Activation Energies of TS with B3LYP/6-31G(d)
- 17:2317:23, 22 January 2016 diff hist +1 Rep:Mod:ETZ13TS →Activation Energies of TS with B3LYP/6-31G(d)
- 17:2217:22, 22 January 2016 diff hist +227 Rep:Mod:ETZ13TS →Activation Energies of TS with B3LYP/6-31G(d)
- 17:2117:21, 22 January 2016 diff hist 0 N File:ETZ13 B3 BOAT TS.LOG No edit summary current
- 17:1117:11, 22 January 2016 diff hist +276 Rep:Mod:ETZ13TS →Activation Energies of TS with B3LYP/6-31G(d)
- 17:1117:11, 22 January 2016 diff hist 0 N File:Etz13 b3 boat.png No edit summary current
- 17:0917:09, 22 January 2016 diff hist 0 N File:Etz13 b3 chair.png No edit summary current
- 17:0317:03, 22 January 2016 diff hist 0 N File:B3 chair TS data.png No edit summary current
- 17:0117:01, 22 January 2016 diff hist 0 N File:B3 boat TS data.png No edit summary current
- 16:5216:52, 22 January 2016 diff hist +47 Rep:Mod:ETZ13TS →Intrinsic Reaction Coordinate of Chair and Boat TS
- 16:4816:48, 22 January 2016 diff hist +156 Rep:Mod:ETZ13TS →Intrinsic Reaction Coordinate of Chair and Boat TS
- 16:4816:48, 22 January 2016 diff hist 0 N File:Etz13 irc 2.png No edit summary current
- 16:4416:44, 22 January 2016 diff hist 0 N File:Etz13 irc 1.png No edit summary current