User contributions for Dh08

8 November 2010

• 12:1912:19, 8 November 2010 diff hist +22 Rep:Mod:hampluscheese →'''Comparison of activation energies for the transition states'''
• 12:1712:17, 8 November 2010 diff hist +12 Rep:Mod:hampluscheese →'''Comparison of activation energies for the transition states'''
• 12:0812:08, 8 November 2010 diff hist +73 Rep:Mod:hampluscheese →'''Comparison of activation energies for the transition states'''
• 11:4111:41, 8 November 2010 diff hist +3 Rep:Mod:hampluscheese →'''Comparison of activation energies for the transition states'''
• 11:4111:41, 8 November 2010 diff hist +40 Rep:Mod:hampluscheese →'''Comparison of activation energies for the transition states'''
• 11:3911:39, 8 November 2010 diff hist +810 Rep:Mod:hampluscheese →'''Comparison of activation energies for the transition states'''
• 11:3811:38, 8 November 2010 diff hist +1,055 Rep:Mod:hampluscheese →'''Comparison of activation energies for the transition states'''

7 November 2010

• 22:5222:52, 7 November 2010 diff hist +75 Rep:Mod:hampluscheese →'''Boat transition state'''
• 22:5022:50, 7 November 2010 diff hist −20 Rep:Mod:hampluscheese →'''Optimisation of the boat transition state'''
• 22:5022:50, 7 November 2010 diff hist 0 Rep:Mod:hampluscheese →'''Intrinsic Reaction Coordinate'''
• 22:4922:49, 7 November 2010 diff hist +383 Rep:Mod:hampluscheese →'''Intrinsic Reaction Coordinate'''
• 22:4322:43, 7 November 2010 diff hist −318 Rep:Mod:hampluscheese →'''Intrinsic Reaction Coordinate'''
• 22:2122:21, 7 November 2010 diff hist +1,605 Rep:Mod:hampluscheese →'''Intrinsic Reaction Coordinate'''
• 22:1022:10, 7 November 2010 diff hist +31 Rep:Mod:hampluscheese →'''Intrinsic Reaction Coordinate'''
• 22:0822:08, 7 November 2010 diff hist 0 N File:Always gradientdh08.jpg No edit summary current
• 22:0822:08, 7 November 2010 diff hist +299 Rep:Mod:hampluscheese →'''Intrinsic Reaction Coordinate'''
• 22:0722:07, 7 November 2010 diff hist 0 N File:Always pathwaydh08.jpg No edit summary current
• 22:0322:03, 7 November 2010 diff hist 0 N File:Always chairdh08.mol No edit summary current
• 21:5621:56, 7 November 2010 diff hist +59 Rep:Mod:hampluscheese →'''QST2 optimisation'''
• 21:4921:49, 7 November 2010 diff hist 0 Rep:Mod:hampluscheese →'''Intrinsic Reaction Coordinate'''
• 21:4821:48, 7 November 2010 diff hist +81 Rep:Mod:hampluscheese →'''Intrinsic Reaction Coordinate'''
• 21:4821:48, 7 November 2010 diff hist 0 N File:One gradientdh08.jpg No edit summary current
• 21:4821:48, 7 November 2010 diff hist 0 N File:One pathwaydh08.jpg No edit summary current
• 21:4121:41, 7 November 2010 diff hist +12 Rep:Mod:hampluscheese →'''Intrinsic Reaction Coordinate'''
• 21:3821:38, 7 November 2010 diff hist +199 Rep:Mod:hampluscheese →'''Optimisation of the boat transition state'''
• 21:3721:37, 7 November 2010 diff hist 0 N File:Once chairdh08.mol No edit summary current
• 21:3621:36, 7 November 2010 diff hist +473 Rep:Mod:hampluscheese →'''Intrinsic Reaction Coordinate'''
• 21:2621:26, 7 November 2010 diff hist +484 Rep:Mod:hampluscheese →'''Intrinsic Reaction Coordinate'''
• 21:0321:03, 7 November 2010 diff hist +79 Rep:Mod:hampluscheese →'''Optimisation of the boat transition state'''
• 21:0121:01, 7 November 2010 diff hist −10 Rep:Mod:hampluscheese →'''Optimisation of the boat transition state'''
• 21:0121:01, 7 November 2010 diff hist +10 Rep:Mod:hampluscheese →'''Optimisation of the boat transition state'''
• 21:0121:01, 7 November 2010 diff hist +159 Rep:Mod:hampluscheese →'''Optimisation of the boat transition state'''
• 20:5820:58, 7 November 2010 diff hist −10 Rep:Mod:hampluscheese →'''Optimisation of the boat transition state'''
• 20:5720:57, 7 November 2010 diff hist 0 N File:-839dh08.gif No edit summary current
• 20:5720:57, 7 November 2010 diff hist −24 Rep:Mod:hampluscheese →'''Optimisation of the boat transition state'''
• 20:5620:56, 7 November 2010 diff hist +593 Rep:Mod:hampluscheese →'''Optimisation of the boat transition state'''
• 20:5420:54, 7 November 2010 diff hist 0 N File:Realone BPdh08.mol No edit summary current
• 20:5120:51, 7 November 2010 diff hist +90 Rep:Mod:hampluscheese →'''Optimisation of the boat transition state'''
• 20:4920:49, 7 November 2010 diff hist +43 Rep:Mod:hampluscheese →'''Optimisation of the boat transition state'''
• 20:4920:49, 7 November 2010 diff hist +254 Rep:Mod:hampluscheese →'''Optimisation of the boat transition state'''
• 20:4620:46, 7 November 2010 diff hist +8 Rep:Mod:hampluscheese →'''Optimisation of the boat transition state'''
• 20:4620:46, 7 November 2010 diff hist 0 N File:TS (QST2) numbering 2dh08.jpg No edit summary current
• 20:4520:45, 7 November 2010 diff hist +111 Rep:Mod:hampluscheese →'''Optimisation of the boat transition state'''
• 20:4520:45, 7 November 2010 diff hist 0 N File:Numbering2 BPdh08.gjf No edit summary current
• 20:4320:43, 7 November 2010 diff hist −1 Rep:Mod:hampluscheese →'''Optimisation of the boat transition state'''
• 20:4220:42, 7 November 2010 diff hist +183 Rep:Mod:hampluscheese →'''Optimisation of the boat transition state'''
• 20:4120:41, 7 November 2010 diff hist −6 Rep:Mod:hampluscheese →'''Optimisation of the boat transition state'''
• 20:4020:40, 7 November 2010 diff hist +63 Rep:Mod:hampluscheese →'''Optimisation of the boat transition state'''
• 20:3220:32, 7 November 2010 diff hist +158 Rep:Mod:hampluscheese →'''Optimizing the "Chair" and "Boat" Transition Structures'''
• 20:3120:31, 7 November 2010 diff hist +148 Rep:Mod:hampluscheese →'''Optimisation of the boat transition state'''