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10 November 2011
- 12:0212:02, 10 November 2011 diff hist +229 Rep:Mod:MRTSFN89 phys →"Boat" Transition State IRC
- 12:0012:00, 10 November 2011 diff hist +208 Rep:Mod:MRTSFN89 phys →"Boat" Transition State IRC
- 12:0012:00, 10 November 2011 diff hist 0 N File:IRC boat.PNG No edit summary
- 12:0012:00, 10 November 2011 diff hist 0 N File:IRC boat GRADIENT.PNG No edit summary
- 12:0012:00, 10 November 2011 diff hist 0 N File:BoatTS IRC 250steps fc always 48314.mol No edit summary current
- 11:5411:54, 10 November 2011 diff hist +306 Rep:Mod:MRTSFN89 phys →"Boat" Transition State optimization
- 11:5111:51, 10 November 2011 diff hist +150 Rep:Mod:MRTSFN89 phys →"Boat" Transition State optimization
- 11:4911:49, 10 November 2011 diff hist +527 Rep:Mod:MRTSFN89 phys →"Boat" Transition State optimization
- 11:4311:43, 10 November 2011 diff hist +697 Rep:Mod:MRTSFN89 phys →"Chair" Transition State optimization
- 11:4311:43, 10 November 2011 diff hist 0 N File:Qst2 step2.png No edit summary
- 11:3611:36, 10 November 2011 diff hist 0 N File:Qst2 step1.png No edit summary current
- 11:2011:20, 10 November 2011 diff hist +47 Rep:Mod:MRTSFN89 phys →"Chair" Transition State optimization
- 11:1911:19, 10 November 2011 diff hist +905 Rep:Mod:MRTSFN89 phys →"Chair" Transition State IRC
- 11:0811:08, 10 November 2011 diff hist +1 Rep:Mod:MRTSFN89 phys →"Chair" Transition State IRC
- 11:0711:07, 10 November 2011 diff hist +2,707 Rep:Mod:MRTSFN89 phys →"Chair" Transition State IRC
- 11:0711:07, 10 November 2011 diff hist 0 N File:IRC reduntantchairTS 50steps fc always 48310.mol No edit summary current
- 10:5810:58, 10 November 2011 diff hist 0 N File:IRC reduntantchairTS 50steps fc once twosteps 48312.mol No edit summary current
- 10:2210:22, 10 November 2011 diff hist +1,544 Rep:Mod:MRTSFN89 phys →IRC
9 November 2011
- 22:3622:36, 9 November 2011 diff hist +2 Rep:Mod:MRTSFN89 phys →IRC
- 22:3522:35, 9 November 2011 diff hist +596 Rep:Mod:MRTSFN89 phys →Optimization of the allyl fragment
- 22:3522:35, 9 November 2011 diff hist 0 N File:IRC reduntantchairTS 50steps fc once.PNG No edit summary current
- 22:3522:35, 9 November 2011 diff hist 0 N File:IRC reduntantchairTS 50steps fc once GRADIENT.PNG No edit summary current
- 22:3522:35, 9 November 2011 diff hist 0 N File:IRC reduntantchairTS 50steps fc always.PNG No edit summary current
- 22:3522:35, 9 November 2011 diff hist 0 N File:IRC reduntantchairTS 50steps fc always GRADIENT.PNG No edit summary current
- 22:3522:35, 9 November 2011 diff hist 0 N File:IRC reduntantchairTS 50steps fc once twosteps.PNG No edit summary current
- 22:3522:35, 9 November 2011 diff hist 0 N File:IRC reduntantchairTS 50steps fc once twosteps GRADIENT.PNG No edit summary current
- 22:3522:35, 9 November 2011 diff hist 0 N File:IRC reduntantchairTS 200steps fc always twosteps.PNG No edit summary current
- 22:3522:35, 9 November 2011 diff hist 0 N File:IRC reduntantchairTS 200steps fc always twosteps GRADIENT.PNG No edit summary current
- 22:2222:22, 9 November 2011 diff hist +602 Rep:Mod:MRTSFN89 phys →Optimization of the allyl fragment
- 22:1622:16, 9 November 2011 diff hist 0 N File:Chair ts guess.PNG No edit summary
- 22:1622:16, 9 November 2011 diff hist 0 N File:Chair ts forcematrix video.gif No edit summary current
- 22:1522:15, 9 November 2011 diff hist +13 Rep:Mod:MRTSFN89 phys →Optimization of the allyl fragment
- 22:1322:13, 9 November 2011 diff hist +78 Rep:Mod:MRTSFN89 phys →Optimization of the allyl fragment
- 22:1222:12, 9 November 2011 diff hist 0 Rep:Mod:MRTSFN89 phys →Optimization of the allyl fragment
- 22:1222:12, 9 November 2011 diff hist 0 Rep:Mod:MRTSFN89 phys →Optimization of the allyl fragment
- 22:1222:12, 9 November 2011 diff hist 0 Rep:Mod:MRTSFN89 phys →Optimization of the allyl fragment
- 22:1222:12, 9 November 2011 diff hist +3,384 Rep:Mod:MRTSFN89 phys →Thermochemistry
- 21:5421:54, 9 November 2011 diff hist 0 N File:PES.PNG No edit summary
- 21:2821:28, 9 November 2011 diff hist 0 N File:Allyl fragment.PNG No edit summary
- 21:0121:01, 9 November 2011 diff hist −6 Rep:Mod:MRTSFN89 phys →Optimizations
- 21:0021:00, 9 November 2011 diff hist +22 Rep:Mod:MRTSFN89 phys →DFT investigation of [Ci]anti-1 lowest energy conformer
- 20:5920:59, 9 November 2011 diff hist −4 Rep:Mod:MRTSFN89 phys →Thermochemistry
- 20:5820:58, 9 November 2011 diff hist +1,352 Rep:Mod:MRTSFN89 phys →Thermochemistry
- 20:4120:41, 9 November 2011 diff hist +129 Rep:Mod:MRTSFN89 phys →Thermochemistry
- 20:3920:39, 9 November 2011 diff hist −4 Rep:Mod:MRTSFN89 phys →Thermochemistry
- 20:3820:38, 9 November 2011 diff hist +681 Rep:Mod:MRTSFN89 phys →DFT investigation of anti-1 [Ci] lowest energy conformer
- 20:2320:23, 9 November 2011 diff hist +810 Rep:Mod:MRTSFN89 phys →DFT optimization of anti-1 [Ci] lowest energy conformer
- 20:0920:09, 9 November 2011 diff hist 0 Rep:Mod:MRTSFN89 phys →DFT optimization of anti-1 [Ci] lowest energy conformer
- 20:0820:08, 9 November 2011 diff hist +431 Rep:Mod:MRTSFN89 phys →DFT optimization of anti-1 [Ci] lowest energy conformer
- 20:0520:05, 9 November 2011 diff hist 0 N File:DFT Ci.png No edit summary current