User contributions for Bw206
Appearance
20 November 2008
- 18:3518:35, 20 November 2008 diff hist +33 Rep:Mod:bwph3895 →Internal Reaction Coordinate Method
- 18:3518:35, 20 November 2008 diff hist 0 N File:CHAIR BERNY IRC 100 graphs 2.JPG No edit summary current
- 18:3318:33, 20 November 2008 diff hist +210 Rep:Mod:bwph3895 →Internal Reaction Coordinate Method
- 18:3318:33, 20 November 2008 diff hist 0 N File:CHAIR BERNY IRC 100 2.mol No edit summary current
- 18:3118:31, 20 November 2008 diff hist 0 Rep:Mod:bwph3895 →Allyl
- 18:3018:30, 20 November 2008 diff hist 0 N File:ALLYL OPT B3LYP.mol No edit summary current
- 18:3018:30, 20 November 2008 diff hist +204 Rep:Mod:bwph3895 →Activation Energies
- 18:3018:30, 20 November 2008 diff hist 0 N File:ALLYL OPT b3lyp.gjf No edit summary current
- 18:2918:29, 20 November 2008 diff hist +27 Rep:Mod:bwph3895 →Allyl
- 18:2218:22, 20 November 2008 diff hist +438 Rep:Mod:bwph3895 →Internal Reaction Coordinate Method
- 18:2118:21, 20 November 2008 diff hist 0 N File:CHAIR BERNY IRC B3LYP6-31G OPT.mol No edit summary current
- 18:1218:12, 20 November 2008 diff hist +264 Rep:Mod:bwph3895 →Internal Reaction Coordinate Method
- 18:0718:07, 20 November 2008 diff hist +384 Rep:Mod:bwph3895 →Internal Reaction Coordinate Method
- 18:0718:07, 20 November 2008 diff hist 0 N File:CHAIR BERNY IRC.mol No edit summary current
- 13:3213:32, 20 November 2008 diff hist +170 Rep:Mod:bwph3895 →Boat
- 13:0613:06, 20 November 2008 diff hist +486 Rep:Mod:bwph3895 →Chair Transition Structure
- 13:0613:06, 20 November 2008 diff hist 0 N File:Chair ts guess1 redco second.mol No edit summary current
- 12:4012:40, 20 November 2008 diff hist +406 Rep:Mod:bwph3895 →Optimizing the "Chair" and "Boat" Transition Structures
- 12:4012:40, 20 November 2008 diff hist 0 N File:Chair berny ts.mol No edit summary current
19 November 2008
- 21:0521:05, 19 November 2008 diff hist −1 Rep:Mod:bwph3895 →Conformation C
- 17:4417:44, 19 November 2008 diff hist +229 Rep:Mod:bwph3895 →Activation Energies
- 17:4417:44, 19 November 2008 diff hist 0 N File:BOAT TS GUESS1 QST2 B3LYP.mol No edit summary current
- 17:3417:34, 19 November 2008 diff hist +340 Rep:Mod:bwph3895 →Internal Reaction Coordinate Method
- 17:3217:32, 19 November 2008 diff hist 0 N File:CHAIR TS B3LYP2.mol No edit summary current
- 17:0317:03, 19 November 2008 diff hist +152 Rep:Mod:bwph3895 →Internal Reaction Coordinate Method
- 17:0317:03, 19 November 2008 diff hist 0 N File:CHAIR BERNY IRC 100 graphs.JPG No edit summary current
- 16:5716:57, 19 November 2008 diff hist +77 Rep:Mod:bwph3895 →Internal Reaction Coordinate Method
- 16:4316:43, 19 November 2008 diff hist −2 Rep:Mod:bwph3895 →Internal Reaction Coordinate Method
- 16:3616:36, 19 November 2008 diff hist +67 Rep:Mod:bwph3895 →Internal Reaction Coordinate Method
- 16:3216:32, 19 November 2008 diff hist +613 Rep:Mod:bwph3895 →Internal Reaction Coordinate Method
- 16:3216:32, 19 November 2008 diff hist 0 N File:CHAIR BERNY IRC FORCECONSTANTS.mol No edit summary current
- 16:2916:29, 19 November 2008 diff hist 0 N File:CHAIR BERNY IRC 100.mol No edit summary current
- 16:2516:25, 19 November 2008 diff hist +88 Rep:Mod:bwph3895 →Optimizing the "Chair" and "Boat" Transition Structures
- 16:2016:20, 19 November 2008 diff hist +23 Rep:Mod:bwph3895 →Boat Transition Structure
- 16:1816:18, 19 November 2008 diff hist +25 Rep:Mod:bwph3895 →Chair Transition Structure
- 16:1016:10, 19 November 2008 diff hist +18 Rep:Mod:bwph3895 →Exo Transition State
- 16:0816:08, 19 November 2008 diff hist +9 Rep:Mod:bwph3895 →Exo Transition State
- 15:1215:12, 19 November 2008 diff hist +372 Rep:Mod:bwph3895 →Internal Reaction Coordinate Method
- 15:1015:10, 19 November 2008 diff hist 0 N File:CHAIR BERNY IRC HF321G OPT.mol No edit summary current
- 15:0515:05, 19 November 2008 diff hist +133 Rep:Mod:bwph3895 →Internal Reaction Coordinate Method
- 14:5914:59, 19 November 2008 diff hist 0 Rep:Mod:bwph3895 →Internal Reaction Coordinate Method
- 14:5914:59, 19 November 2008 diff hist +1 Rep:Mod:bwph3895 →Internal Reaction Coordinate Method
- 14:5914:59, 19 November 2008 diff hist +57 Rep:Mod:bwph3895 →Optimizing the "Chair" and "Boat" Transition Structures
- 14:5814:58, 19 November 2008 diff hist 0 N File:CHAIR BERNY IRC graphs.JPG No edit summary current
- 14:5714:57, 19 November 2008 diff hist +21 Rep:Mod:bwph3895 →Internal Reaction Coordinate Method
- 14:4814:48, 19 November 2008 diff hist +403 Rep:Mod:bwph3895 →Optimizing the "Chair" and "Boat" Transition Structures
- 14:4214:42, 19 November 2008 diff hist +258 Rep:Mod:bwph3895 →Optimizing the "Chair" and "Boat" Transition Structures
- 14:4214:42, 19 November 2008 diff hist 0 N File:CHAIR BERNY IRC finalstep.mol No edit summary current
- 14:4114:41, 19 November 2008 diff hist 0 N File:CHAIR BERNY IRC finalstep.jpg No edit summary current
- 14:2114:21, 19 November 2008 diff hist −2 Rep:Mod:bwph3895 →Diels Alder Cycloaddition