User contributions for Aa9410
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14 March 2013
- 14:4814:48, 14 March 2013 diff hist −11 Rep:Mod:zarfa →Calculation of Optimal Transition State Structures via Frozen Coordinate Method
- 14:4514:45, 14 March 2013 diff hist +2 Rep:Mod:zarfa →MO Analysis of Envelope Transition State
- 14:3514:35, 14 March 2013 diff hist −12 Rep:Mod:zarfa →Discussion of Endo and Exo Transition State Structures (REDO TABLES)
- 14:3414:34, 14 March 2013 diff hist +9 Rep:Mod:zarfa No edit summary
- 14:3314:33, 14 March 2013 diff hist 0 Rep:Mod:zarfa →Optimisation of the molecules
- 14:3214:32, 14 March 2013 diff hist +81 Rep:Mod:zarfa No edit summary
- 14:3114:31, 14 March 2013 diff hist +93 Rep:Mod:zarfa →Reaction: Cyclohexadiene and Maleic Anhydride
- 14:3114:31, 14 March 2013 diff hist 0 File:Mechanism.png uploaded a new version of "File:Mechanism.png"
- 13:4613:46, 14 March 2013 diff hist +45 Rep:Mod:zarfa →Optimisation of the molecules (butadiene and ethene)
- 13:1413:14, 14 March 2013 diff hist 0 Rep:Mod:zarfa →Optimisation of the molecules (butadiene and ethene)
- 13:1313:13, 14 March 2013 diff hist +2 Rep:Mod:zarfa →Optimisation of the molecules (butadiene and ethene)
- 13:0913:09, 14 March 2013 diff hist +13 Rep:Mod:zarfa →Ethylene with Cis-Butadiene
- 13:0813:08, 14 March 2013 diff hist +71 Rep:Mod:zarfa →Ethylene with Cis-Butadiene
- 13:0713:07, 14 March 2013 diff hist −50 Rep:Mod:zarfa →The Diels-Alder Cycloaddition Reaction
13 March 2013
- 20:0720:07, 13 March 2013 diff hist +99 Rep:Mod:zarfa →Conclusion
- 18:1418:14, 13 March 2013 diff hist +17 Rep:Mod:zarfa →Reaction: Cyclohexadiene and Maleic Anhydride
- 18:0918:09, 13 March 2013 diff hist −2 Rep:Mod:zarfa →Intrinsic Reaction Coordinate (IRC) Analysis of Chair Transition State
- 18:0818:08, 13 March 2013 diff hist −2 Rep:Mod:zarfa →Chair Transition State
- 18:0718:07, 13 March 2013 diff hist −1 Rep:Mod:zarfa →Boat Transition State (Optimising and Frequency of the Boat Transition State Using Method 3)
- 18:0718:07, 13 March 2013 diff hist +6 Rep:Mod:zarfa →Chair Transition State
- 18:0618:06, 13 March 2013 diff hist +2 Rep:Mod:zarfa →Optimization of "Chair" and "Boat" Transition State Structures
- 17:5917:59, 13 March 2013 diff hist 0 Rep:Mod:zarfa →Boat Transition State
- 17:5817:58, 13 March 2013 diff hist +6 Rep:Mod:zarfa →Exo Transition State
- 17:5817:58, 13 March 2013 diff hist +6 Rep:Mod:zarfa →Endo Transition State
- 17:5717:57, 13 March 2013 diff hist 0 Rep:Mod:zarfa →Endo Transition State
- 17:5717:57, 13 March 2013 diff hist 0 Rep:Mod:zarfa →Endo Transition State
- 17:5717:57, 13 March 2013 diff hist 0 Rep:Mod:zarfa →Exo Transition State
- 17:5717:57, 13 March 2013 diff hist −3 Rep:Mod:zarfa →Exo Transition State
- 17:5217:52, 13 March 2013 diff hist +51 Rep:Mod:zarfa No edit summary
- 17:4917:49, 13 March 2013 diff hist −16 Rep:Mod:zarfa →Diels Alder
- 17:4617:46, 13 March 2013 diff hist 0 Rep:Mod:zarfa →Method 2: Frozen Co-ordinated Method
- 17:4617:46, 13 March 2013 diff hist 0 Rep:Mod:zarfa →Method 2: Frozen Co-ordinated Method
- 17:4517:45, 13 March 2013 diff hist 0 Rep:Mod:zarfa →Method 1: Hessian Method
- 17:4217:42, 13 March 2013 diff hist +81 Rep:Mod:zarfa →Boat Transition State
- 17:4017:40, 13 March 2013 diff hist +10 Rep:Mod:zarfa →Method 2: Frozen Co-ordinated Method
- 17:3617:36, 13 March 2013 diff hist 0 Rep:Mod:zarfa →Optimisation of the Ci anti-peri planar conformer
- 17:3617:36, 13 March 2013 diff hist +25 Rep:Mod:zarfa →Optimisation of the Ci anti-peri planar conformer
- 17:3317:33, 13 March 2013 diff hist −31 Rep:Mod:zarfa →The Energy of the different conformers
- 17:3117:31, 13 March 2013 diff hist −3 Rep:Mod:zarfa →Gauche conformer
- 17:3117:31, 13 March 2013 diff hist +3 Rep:Mod:zarfa →Gauche conformer
- 17:3017:30, 13 March 2013 diff hist +1 Rep:Mod:zarfa →Gauche conformer
- 17:2717:27, 13 March 2013 diff hist 0 Rep:Mod:zarfa →Anti-peri planar conformer
- 17:2417:24, 13 March 2013 diff hist −5 Rep:Mod:zarfa →Boat Transition State (Optimising and Frequency of the Boat Transition State Using Method 3)
- 17:2317:23, 13 March 2013 diff hist −65 Rep:Mod:zarfa →Frequency analysis
- 17:2217:22, 13 March 2013 diff hist 0 N File:IRspectrum.png No edit summary current
- 15:4515:45, 13 March 2013 diff hist +86 Rep:Mod:zarfa →Chair Transition State
- 15:4515:45, 13 March 2013 diff hist −2 Rep:Mod:zarfa →Intrinsic Reaction Coordinate (IRC) Analysis of Chair Transition State
- 15:4315:43, 13 March 2013 diff hist −11 Rep:Mod:zarfa →Intrinsic Reaction Coordinate (IRC) Analysis of Chair Transition State
- 15:4315:43, 13 March 2013 diff hist 0 N File:Irir.png No edit summary current
- 15:4215:42, 13 March 2013 diff hist −27 Rep:Mod:zarfa →Intrinsic Reaction Coordinate (IRC) Analysis of Chair Transition State (MAY REDO)?