User contributions for Aa9410
15 March 2013
- 14:3614:36, 15 March 2013 diff hist +44 Rep:Mod:zarfa No edit summary
- 14:3614:36, 15 March 2013 diff hist −31 Rep:Mod:zarfa →Calculation of Optimal Transition State Structures via Frozen Coordinate Method
- 14:2314:23, 15 March 2013 diff hist +35 Rep:Mod:zarfa No edit summary
- 14:2214:22, 15 March 2013 diff hist −45 Rep:Mod:zarfa →Calculation of Optimal Transition State Structures via Frozen Coordinate Method
- 14:2114:21, 15 March 2013 diff hist −25 Rep:Mod:zarfa →Discussion of Endo and Exo Transition State Structures
- 14:1614:16, 15 March 2013 diff hist +60 Rep:Mod:zarfa →Optimisation of the molecules
- 14:1614:16, 15 March 2013 diff hist +60 Rep:Mod:zarfa →Optimisation of the molecules
- 14:1014:10, 15 March 2013 diff hist +32 Rep:Mod:zarfa No edit summary
- 14:0914:09, 15 March 2013 diff hist −22 Rep:Mod:zarfa →Method 3: Boat Transition State (QST2)
- 14:0614:06, 15 March 2013 diff hist +27 Rep:Mod:zarfa →Introduction
- 14:0414:04, 15 March 2013 diff hist +1 Rep:Mod:zarfa →MO Analysis of Envelope Transition State
- 14:0214:02, 15 March 2013 diff hist −4 Rep:Mod:zarfa →MO Analysis of Envelope Transition State
- 14:0114:01, 15 March 2013 diff hist +43 Rep:Mod:zarfa →Endo Transition State
- 14:0114:01, 15 March 2013 diff hist +42 Rep:Mod:zarfa →Exo Transition State
- 13:4913:49, 15 March 2013 diff hist −5 Rep:Mod:zarfa →Discussion of Endo and Exo Transition State Structures
- 13:4313:43, 15 March 2013 diff hist −92 Rep:Mod:zarfa →Activation Energies Summary
- 13:4213:42, 15 March 2013 diff hist +296 Rep:Mod:zarfa →Activation Energies Summary
- 13:3013:30, 15 March 2013 diff hist −4 Rep:Mod:zarfa →Activation Energies Summary
- 13:0513:05, 15 March 2013 diff hist +35 Rep:Mod:zarfa →Calculation of Boat and Chair Activation Energies
- 13:0413:04, 15 March 2013 diff hist +14 Rep:Mod:zarfa →Calculation of Boat and Chair Activation Energies
- 13:0413:04, 15 March 2013 diff hist −31 Rep:Mod:zarfa →Boat Transition State
- 13:0313:03, 15 March 2013 diff hist −22 Rep:Mod:zarfa →Chair Transition State
- 13:0213:02, 15 March 2013 diff hist +65 Rep:Mod:zarfa →Intrinsic Reaction Coordinate (IRC) Analysis of Chair Transition State
- 13:0013:00, 15 March 2013 diff hist −68 Rep:Mod:zarfa →Intrinsic Reaction Coordinate (IRC) Analysis of Chair Transition State
- 12:5912:59, 15 March 2013 diff hist +23 Rep:Mod:zarfa No edit summary
- 12:5612:56, 15 March 2013 diff hist +2 Rep:Mod:zarfa →Discussion of Endo and Exo Transition State Structures
- 12:5612:56, 15 March 2013 diff hist +2 Rep:Mod:zarfa →Optimisation of the molecules (butadiene and ethene)
- 12:5512:55, 15 March 2013 diff hist −2 Rep:Mod:zarfa →The Diels-Alder Cycloaddition Reaction
- 12:5512:55, 15 March 2013 diff hist −2 Rep:Mod:zarfa →Reaction: Cyclohexadiene and Maleic Anhydride
- 12:5412:54, 15 March 2013 diff hist −4 Rep:Mod:zarfa →Ethylene with Cis-Butadiene
- 12:5412:54, 15 March 2013 diff hist −2 Rep:Mod:zarfa →Optimisation of the molecules (butadiene and ethene)
- 12:5312:53, 15 March 2013 diff hist −2 Rep:Mod:zarfa →Calculation of Optimal Transition State Structures via Frozen Coordinate Method
- 12:5312:53, 15 March 2013 diff hist −49 Rep:Mod:zarfa →Method 3: Boat Transition State (Optimising and Frequency of the Boat Transition State)
- 12:5212:52, 15 March 2013 diff hist −42 Rep:Mod:zarfa →Chair and Boat Transition State
- 12:5112:51, 15 March 2013 diff hist +2 Rep:Mod:zarfa →Chair and Boat Transition State
- 12:5012:50, 15 March 2013 diff hist +4 Rep:Mod:zarfa →Optimisation of the Ci anti-peri planar conformer
- 12:5012:50, 15 March 2013 diff hist +40 Rep:Mod:zarfa →Frequency analysis
- 12:4912:49, 15 March 2013 diff hist −24 Rep:Mod:zarfa →Chair and Boat Transition State
- 12:4812:48, 15 March 2013 diff hist +55 Rep:Mod:zarfa No edit summary
- 12:4712:47, 15 March 2013 diff hist −118 Rep:Mod:zarfa →Intrinsic Reaction Coordinate (IRC) Analysis of Chair Transition State
- 12:4612:46, 15 March 2013 diff hist +26 Rep:Mod:zarfa No edit summary
- 12:4312:43, 15 March 2013 diff hist +2 Rep:Mod:zarfa →Method 2: Frozen Co-ordinated Method
- 12:4212:42, 15 March 2013 diff hist +2 Rep:Mod:zarfa →Method 1: Hessian Method
- 12:4012:40, 15 March 2013 diff hist +33 Rep:Mod:zarfa →Method 1: Hessian Method
- 12:3612:36, 15 March 2013 diff hist +6 Rep:Mod:zarfa →Anti-peri planar conformer
- 12:3612:36, 15 March 2013 diff hist +6 Rep:Mod:zarfa →Gauche conformer
- 12:3512:35, 15 March 2013 diff hist 0 Rep:Mod:zarfa →Anti-peri planar conformer
- 12:3312:33, 15 March 2013 diff hist +2 Rep:Mod:zarfa →1,5-Hexadiene: Optimisation and Frequency Analysis
- 12:3212:32, 15 March 2013 diff hist +7 Rep:Mod:zarfa →Discussion of Endo and Exo Transition State Structures