User contributions for Ha508
Appearance
25 March 2011
- 16:5816:58, 25 March 2011 diff hist +1 Rep:Hoss.Module3 →Chair Transition State
- 16:4816:48, 25 March 2011 diff hist −1 Rep:Hoss.Module3 →Optimisation of the Reactants and Products
- 16:4816:48, 25 March 2011 diff hist +4 Rep:Hoss.Module3 →Optimisation of the Reactants and Products
- 16:4716:47, 25 March 2011 diff hist +39 Rep:Hoss.Module3 →Physical Module 3
- 16:4516:45, 25 March 2011 diff hist +723 Rep:Hoss.Module3 →Optimisation of the Transition State
- 16:4416:44, 25 March 2011 diff hist 0 N File:Hoss DFTTsberny endo DA2 TS.mol No edit summary current
- 16:4316:43, 25 March 2011 diff hist 0 N File:Hoss.DA2guess(b) AM1 opt+freqENDO.mol No edit summary current
- 16:4116:41, 25 March 2011 diff hist 0 N File:Hoss.DA2guess(b)TS DFT opt+freq.mol No edit summary current
- 16:4016:40, 25 March 2011 diff hist 0 N File:Hoss.DA2guess(b)TS AM1 opt+freq.mol No edit summary current
- 16:3916:39, 25 March 2011 diff hist +360 Rep:Hoss.Module3 →Optimisation of the Transition State
- 16:3816:38, 25 March 2011 diff hist 0 N File:Hoss.guess(1) DFT opt+freq TSberny.mol No edit summary current
- 16:3716:37, 25 March 2011 diff hist 0 N File:Hoss.guess(1) AM1 opt+freq TSberny.mol No edit summary current
- 16:3416:34, 25 March 2011 diff hist −10 Rep:Hoss.Module3 →Intrinsic Reaction Coordinate (IRC) Method
- 16:3416:34, 25 March 2011 diff hist +388 Rep:Hoss.Module3 →Intrinsic Reaction Coordinate (IRC) Method
- 16:3316:33, 25 March 2011 diff hist 0 N File:Hoss.chair ts opt+freq derivative IRC optlocmin.mol No edit summary current
- 16:3316:33, 25 March 2011 diff hist 0 N File:Hoss.boat ts opt+freq IRC optlocmin.mol No edit summary current
- 16:2616:26, 25 March 2011 diff hist +362 Rep:Hoss.Module3 →Optimisation using the TS (Berny) method and the Frozen Co-ordinate Method
- 16:2616:26, 25 March 2011 diff hist 0 N File:Hoss.chair ts opt+freq derivative.mol No edit summary current
- 16:2416:24, 25 March 2011 diff hist 0 N File:Hoss.chair ts opt+freq.mol No edit summary current
- 16:1916:19, 25 March 2011 diff hist +336 Rep:Hoss.Module3 →Conclusion
- 16:1016:10, 25 March 2011 diff hist −38 Rep:Hoss.Module3 →Optimisation of the Transition State
- 16:0916:09, 25 March 2011 diff hist −1 Rep:Hoss.Module3 →Optimisation of the Transition State
- 16:0516:05, 25 March 2011 diff hist +522 Rep:Hoss.Module3 →Optimisation of the Transition State
- 15:3215:32, 25 March 2011 diff hist 0 Rep:Hoss.Module3 →The Diels Alder Reaction of Cyclohexadiene and Maleic Anhydride
- 15:3215:32, 25 March 2011 diff hist −171 Rep:Hoss.Module3 →Optimisation of the Transition State
- 15:2915:29, 25 March 2011 diff hist −104 Rep:Hoss.Module3 →The Diels Alder Reaction of Cyclohexadiene and Maleic Anhydride
- 15:2415:24, 25 March 2011 diff hist +50 Rep:Hoss.Module3 →Optimisation of the Transition State
- 15:2315:23, 25 March 2011 diff hist +54 Rep:Hoss.Module3 →The Diels Alder Cycloaddition
- 14:5914:59, 25 March 2011 diff hist +498 Rep:Hoss.Module3 →Activation Energies of the Transition States
- 14:3214:32, 25 March 2011 diff hist +372 Rep:Hoss.Module3 →Activation Energies of the Transition States
- 14:2014:20, 25 March 2011 diff hist +109 Rep:Hoss.Module3 →Intrinsic Reaction Coordinate (IRC) Method
- 14:1914:19, 25 March 2011 diff hist +25 Rep:Hoss.Module3 →Intrinsic Reaction Coordinate (IRC) Method
- 14:1714:17, 25 March 2011 diff hist −17 Rep:Hoss.Module3 →Intrinsic Reaction Coordinate (IRC) Method
- 14:0914:09, 25 March 2011 diff hist +14 Rep:Hoss.Module3 →Boat Transition State
- 14:0714:07, 25 March 2011 diff hist −101 Rep:Hoss.Module3 →Boat Transition State
- 14:0314:03, 25 March 2011 diff hist +2 Rep:Hoss.Module3 →Optimisation using the TS (Berny) method and the Frozen Co-ordinate Method
- 13:5913:59, 25 March 2011 diff hist −10 Rep:Hoss.Module3 →Chair Transition State/Structure
- 13:5913:59, 25 March 2011 diff hist +71 Rep:Hoss.Module3 →Optimisation of the Chair and Boat structures
- 13:4713:47, 25 March 2011 diff hist +389 Rep:Hoss.Module3 →Frequency Analysis
- 13:4013:40, 25 March 2011 diff hist +3 Rep:Hoss.Module3 →Frequency Analysis
- 13:3313:33, 25 March 2011 diff hist +22 Rep:Hoss.Module3 →Optimisation of the Reactants and Products
- 13:3113:31, 25 March 2011 diff hist +161 Rep:Hoss.Module3 →Re-optimisation
- 13:1613:16, 25 March 2011 diff hist +1 Rep:Hoss.Module3 →Optimisation of the Reactants and Products
- 13:1313:13, 25 March 2011 diff hist 0 Rep:Hoss.Module3 →Optimisation of the Reactants and Products
- 13:1213:12, 25 March 2011 diff hist −3 Rep:Hoss.Module3 →Optimisation of the Reactants and Products
- 13:1213:12, 25 March 2011 diff hist −48 Rep:Hoss.Module3 →Optimisation of the Reactants and Products
- 13:1113:11, 25 March 2011 diff hist +176 Rep:Hoss.Module3 →Optimising the Reactants and Products
- 13:0213:02, 25 March 2011 diff hist +134 Rep:Hoss.Module3 →The Cope Rearrangement
- 12:5012:50, 25 March 2011 diff hist −23 Rep:Hoss.Module3 →Physical Module 3: Aims and Introduction
- 12:5012:50, 25 March 2011 diff hist +317 Rep:Hoss.Module3 →Physical Module 3: Aims and Introduction