User contributions for Rv108
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14 February 2011
- 14:5814:58, 14 February 2011 diff hist +595 Rep:Mod:rvirdee3 →''Boat Transition State via QST2 Calculation:''
- 14:5514:55, 14 February 2011 diff hist +20 Rep:Mod:rvirdee3 →''Boat Transition State via QST2 Calculation:''
- 14:5414:54, 14 February 2011 diff hist +55 Rep:Mod:rvirdee3 →''Finding the Transition States:''
- 14:5314:53, 14 February 2011 diff hist +2 Rep:Mod:rvirdee3 →''Chair Transition State via Freezing Coordinates:''
- 14:5314:53, 14 February 2011 diff hist +556 Rep:Mod:rvirdee3 →''Chair Transition State via Freezing Coordinates:''
- 14:5014:50, 14 February 2011 diff hist +52 Rep:Mod:rvirdee3 →''Chair Transition State via Freezing Coordinates:''
- 14:5014:50, 14 February 2011 diff hist +24 Rep:Mod:rvirdee3 →''Chair Transition State via Freezing Coordinates:''
- 14:4914:49, 14 February 2011 diff hist +18 Rep:Mod:rvirdee3 →''Chair Transition State via Freezing Coordinates:''
- 14:4914:49, 14 February 2011 diff hist +4 Rep:Mod:rvirdee3 →''Chair Transition State via Freezing Coordinates:''
- 14:4914:49, 14 February 2011 diff hist +22 Rep:Mod:rvirdee3 →''Chair Transition State via Freezing Coordinates:''
- 14:3114:31, 14 February 2011 diff hist +157 Rep:Mod:rvirdee3 →''Chair Transition State via Freezing Coordinates:''
- 14:3114:31, 14 February 2011 diff hist +225 Rep:Mod:rvirdee3 →''Chair Transition State via Freezing Coordinates:''
- 14:1114:11, 14 February 2011 diff hist −1 Rep:Mod:rvirdee3 →''Chair Transition State via Freezing Coordinates:''
- 14:0914:09, 14 February 2011 diff hist 0 N File:Chair TS frozen coordinates after opt of distance.jpeg No edit summary current
- 14:0914:09, 14 February 2011 diff hist 0 N File:Chair TS frozen coordinates before opt of distance.jpeg No edit summary current
- 14:0914:09, 14 February 2011 diff hist +318 Rep:Mod:rvirdee3 →''Chair Transition State via Freezing Coordinates:''
- 13:5813:58, 14 February 2011 diff hist +277 Rep:Mod:rvirdee3 →''Chair Transition State via Freezing Coordinates:''
- 13:1113:11, 14 February 2011 diff hist +326 Rep:Mod:rvirdee3 →''Chair Transition State via Freezing Coordinates:''
- 13:0613:06, 14 February 2011 diff hist +2 Rep:Mod:rvirdee3 →''Chair Transition State via Freezing Coordinates:''
- 13:0613:06, 14 February 2011 diff hist −1 Rep:Mod:rvirdee3 →''Chair Transition State via Calculating Force Constant Matrix:''
- 13:0613:06, 14 February 2011 diff hist +474 Rep:Mod:rvirdee3 →''Chair Transition State via Freezing Coordinates:''
- 13:0013:00, 14 February 2011 diff hist +61 Rep:Mod:rvirdee3 →''Finding the Transition States:''
- 12:5912:59, 14 February 2011 diff hist 0 Rep:Mod:rvirdee3 →''Chair Transition State via Calculating Force Constant Matrix:''
- 12:5912:59, 14 February 2011 diff hist +17 Rep:Mod:rvirdee3 →''Chair Transition State via Calculating Force Constant Matrix:''
- 12:5912:59, 14 February 2011 diff hist +150 Rep:Mod:rvirdee3 →''Chair Transition State via Calculating Force Constant Matrix:''
- 12:5812:58, 14 February 2011 diff hist 0 N File:CHAIR TS molfile.mol No edit summary current
- 12:5412:54, 14 February 2011 diff hist +34 Rep:Mod:rvirdee3 →''Chair Transition State via Calculating Force Constant Matrix:''
- 12:5412:54, 14 February 2011 diff hist −313 Rep:Mod:rvirdee3 →''Chair Transition State via Calculating Force Constant Matrix:''
- 12:5312:53, 14 February 2011 diff hist +27 Rep:Mod:rvirdee3 →''Chair Transition State via Calculating Force Constant Matrix:''
- 12:5212:52, 14 February 2011 diff hist 0 Rep:Mod:rvirdee3 →''Chair Transition State via Calculating Force Constant Matrix:''
- 12:5212:52, 14 February 2011 diff hist 0 Rep:Mod:rvirdee3 →''Chair Transition State via Calculating Force Constant Matrix:''
- 12:5212:52, 14 February 2011 diff hist +307 Rep:Mod:rvirdee3 →''Chair Transition State via Calculating Force Constant Matrix:''
- 12:4812:48, 14 February 2011 diff hist 0 N File:Chair ts IRC progress.jpeg No edit summary current
- 12:4812:48, 14 February 2011 diff hist 0 N File:Chair ts last step of IRC.jpeg No edit summary current
- 12:4812:48, 14 February 2011 diff hist 0 N File:Chair ts 1st step of IRC.jpeg No edit summary current
- 12:4812:48, 14 February 2011 diff hist +324 Rep:Mod:rvirdee3 →''Chair Transition State via Calculating Force Constant Matrix:''
- 12:4212:42, 14 February 2011 diff hist +155 Rep:Mod:rvirdee3 →''Chair Transition State via Calculating Force Constant Matrix:''
- 12:4012:40, 14 February 2011 diff hist +1,056 Rep:Mod:rvirdee3 →''Chair Transition State via Calculating Force Constant Matrix:''
13 February 2011
- 18:1418:14, 13 February 2011 diff hist −1 Rep:Mod:rvirdee3 →''Chair Transition State via Calculating Force Constant Matrix:''
- 18:1418:14, 13 February 2011 diff hist +475 Rep:Mod:rvirdee3 →''Chair Transition State via Calculating Force Constant Matrix:''
- 18:1218:12, 13 February 2011 diff hist 0 Rep:Mod:rvirdee3 →''Chair Transition State via Calculating Force Constant Matrix:''
- 18:1118:11, 13 February 2011 diff hist +3 Rep:Mod:rvirdee3 →''Chair Transition State via Calculating Force Constant Matrix:''
- 18:1118:11, 13 February 2011 diff hist −89 Rep:Mod:rvirdee3 →''Chair Transition State via Calculating Force Constant Matrix:''
- 18:1018:10, 13 February 2011 diff hist +13 Rep:Mod:rvirdee3 →''Chair Transition State via Calculating Force Constant Matrix:''
- 18:1018:10, 13 February 2011 diff hist 0 N File:Vibration causing reaction from chair TS.jpeg No edit summary current
- 18:0918:09, 13 February 2011 diff hist +73 Rep:Mod:rvirdee3 →''Chair Transition State via Calculating Force Constant Matrix:''
- 17:4817:48, 13 February 2011 diff hist 0 N File:Vibration causing reaction from chair transition state.jpeg No edit summary current
- 17:4217:42, 13 February 2011 diff hist 0 N File:Calculated chair transition state.jpeg No edit summary current
- 17:4117:41, 13 February 2011 diff hist 0 N File:Schematic of chair transition state.jpeg No edit summary current
- 17:3717:37, 13 February 2011 diff hist +15 Rep:Mod:rvirdee3 →''Chair Transition State via Calculating Force Constant Matrix:''