User contributions for Aa9410
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13 March 2013
- 13:4113:41, 13 March 2013 diff hist +6 Rep:Mod:zarfa →Calculation of Optimal Transition State Structures via Frozen Coordinate Method
- 13:3713:37, 13 March 2013 diff hist −6 Rep:Mod:zarfa →Optimisation of the molecules (butadiene and ethene)
- 13:3713:37, 13 March 2013 diff hist +57 Rep:Mod:zarfa →Calculation of Optimal Transition State Structures via Frozen Coordinate Method
- 13:3313:33, 13 March 2013 diff hist +884 Rep:Mod:zarfa →Calculation of Optimal Transition State Structures via Frozen Coordinate Method
- 13:3113:31, 13 March 2013 diff hist +12 Rep:Mod:zarfa →Optimisation of the molecules (butadiene and ethene)
- 13:3013:30, 13 March 2013 diff hist +213 Rep:Mod:zarfa →Optimisation of the molecules (butadiene and ethene)
- 13:2613:26, 13 March 2013 diff hist −1 Rep:Mod:zarfa →Optimisation of the molecules (butadiene and ethene)
- 13:2613:26, 13 March 2013 diff hist +1 Rep:Mod:zarfa →Optimisation of the molecules (butadiene and ethene)
- 13:2413:24, 13 March 2013 diff hist +397 Rep:Mod:zarfa →Optimisation of the molecules (butadiene and ethene)
- 13:1813:18, 13 March 2013 diff hist +816 Rep:Mod:zarfa →Optimisation of the molecules (butadiene and ethene)
- 13:1713:17, 13 March 2013 diff hist −55 Rep:Mod:zarfa →Optimisation of the molecules (butadiene and ethene)
- 13:1413:14, 13 March 2013 diff hist +897 Rep:Mod:zarfa →Optimisation of the molecules (butadiene and ethene)
- 13:1213:12, 13 March 2013 diff hist +55 Rep:Mod:zarfa →Diels Alder
- 13:0713:07, 13 March 2013 diff hist 0 N File:Chemdraw mechanism cycloaddition.png No edit summary current
- 12:2812:28, 13 March 2013 diff hist +19 Rep:Mod:zarfa →Discussion of Endo and Exo Transition State Structures
- 12:2712:27, 13 March 2013 diff hist 0 N File:ExoMOHOMO.png No edit summary current
- 12:1412:14, 13 March 2013 diff hist +413 Rep:Mod:zarfa →Analysis of Endo and Exo Transition States
- 12:1412:14, 13 March 2013 diff hist 0 N File:Vib469exotsfreq.gif No edit summary current
- 12:1312:13, 13 March 2013 diff hist 0 N File:Exotsfreqresultssummary.png No edit summary current
- 12:1112:11, 13 March 2013 diff hist 0 N File:Resultssummaryexots.png No edit summary current
- 12:1012:10, 13 March 2013 diff hist 0 N File:Exotsoptimisation.png No edit summary current
- 12:0512:05, 13 March 2013 diff hist +780 Rep:Mod:zarfa →Discussion of Endo and Exo Transition State Structures
- 11:5511:55, 13 March 2013 diff hist +552 Rep:Mod:zarfa →Discussion of Endo and Exo Transition State Structures
- 11:4511:45, 13 March 2013 diff hist +2,181 Rep:Mod:zarfa →Analysis of Endo and Exo Transition States
- 10:5510:55, 13 March 2013 diff hist +293 Rep:Mod:zarfa →Optimisations
12 March 2013
- 22:3322:33, 12 March 2013 diff hist +24 Rep:Mod:zarfa →Diels Alder
- 18:4018:40, 12 March 2013 diff hist −700 Rep:Mod:zarfa →Calculation of Optimal Transition State Structures via Frozen Coordinate Method
- 18:3018:30, 12 March 2013 diff hist +670 Rep:Mod:zarfa →Optimisations
- 18:2018:20, 12 March 2013 diff hist +38 Rep:Mod:zarfa →Optimisations
- 18:2018:20, 12 March 2013 diff hist 0 N File:CycloLUMO.png No edit summary current
- 18:2018:20, 12 March 2013 diff hist 0 N File:CycloHOMO.png No edit summary current
- 18:1718:17, 12 March 2013 diff hist +139 Rep:Mod:zarfa →Optimisations
- 18:1718:17, 12 March 2013 diff hist 0 N File:Results summarycycloopt.png No edit summary current
- 18:1718:17, 12 March 2013 diff hist 0 N File:Cyclohexadieneoptimage.png No edit summary current
- 18:0918:09, 12 March 2013 diff hist +38 Rep:Mod:zarfa →Optimisations
- 18:0818:08, 12 March 2013 diff hist 0 N File:MALUMO.png No edit summary current
- 18:0818:08, 12 March 2013 diff hist 0 N File:MAHOMO.png No edit summary current
- 17:4817:48, 12 March 2013 diff hist +183 Rep:Mod:zarfa →Cyclohexadiene + Maleic Anhydride
- 17:4817:48, 12 March 2013 diff hist 0 N File:Resultssummarymaleicanhydride.png No edit summary current
- 17:4717:47, 12 March 2013 diff hist 0 N File:Maleicanhydrideopt.png No edit summary current
- 17:3417:34, 12 March 2013 diff hist +1,296 Rep:Mod:zarfa →MO Analysis of Envelope Transition State
- 16:3216:32, 12 March 2013 diff hist +49 Rep:Mod:zarfa →Calculation of Optimal Transition State Structures via Frozen Coordinate Method
- 16:2016:20, 12 March 2013 diff hist +73 Rep:Mod:zarfa →Calculation of Optimal Transition State Structures via Frozen Coordinate Method
- 16:1016:10, 12 March 2013 diff hist +435 Rep:Mod:zarfa →Calculation of Optimal Transition State Structures via Frozen Coordinate Method
- 16:0916:09, 12 March 2013 diff hist +183 Rep:Mod:zarfa →Calculation of Optimal Transition State Structures via Frozen Coordinate Method
- 15:5115:51, 12 March 2013 diff hist +12 Rep:Mod:zarfa →Intrinsic Reaction Coordinate (IRC) Analysis of Chair Transition State
- 15:4315:43, 12 March 2013 diff hist +8 Rep:Mod:zarfa →Calculation of Optimal Transition State Structures via Frozen Coordinate Method
- 15:4215:42, 12 March 2013 diff hist +26 Rep:Mod:zarfa →Calculation of Optimal Transition State Structures via Frozen Coordinate Method
- 15:4115:41, 12 March 2013 diff hist 0 N File:Lowestfreqfrozen.gif No edit summary current
- 15:3815:38, 12 March 2013 diff hist +251 Rep:Mod:zarfa →Calculation of Optimal Transition State Structures via Frozen Coordinate Method