User contributions for Shl108
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12 November 2010
- 12:5312:53, 12 November 2010 diff hist +4 Rep:Mod3:shl108 →Optimisation of Boat Transition State
- 12:5312:53, 12 November 2010 diff hist +4 Rep:Mod3:shl108 →Optimisation of Chair Transition State
- 12:5312:53, 12 November 2010 diff hist +42 Rep:Mod3:shl108 →Comparison of TS Optimisation Methods
- 12:5212:52, 12 November 2010 diff hist +36 Rep:Mod3:shl108 →Comparison of TS Optimisation Methods
- 12:5112:51, 12 November 2010 diff hist +45 Rep:Mod3:shl108 →Optimisation of Chair Transition State
- 12:5112:51, 12 November 2010 diff hist +43 Rep:Mod3:shl108 →Optimizing the "Chair" and "Boat" Transition Structures
- 12:5012:50, 12 November 2010 diff hist +44 Rep:Mod3:shl108 →Optimisation of Anti2-Conformer with DFT/B3LYP/6-31G(d)
- 12:5012:50, 12 November 2010 diff hist +62 Rep:Mod3:shl108 →Optimisation with HF/3-21G
- 12:4912:49, 12 November 2010 diff hist +32 Rep:Mod3:shl108 →Optimizing the Reactants and Products
- 12:4512:45, 12 November 2010 diff hist −1,141 Rep:Mod3:shl108 →Optimizing the "Chair" and "Boat" Transition Structures
- 12:4212:42, 12 November 2010 diff hist +339 Rep:Mod3:shl108 →Optimizing the "Chair" and "Boat" Transition Structures
- 12:3112:31, 12 November 2010 diff hist +87 Rep:Mod3:shl108 →Optimizing the "Chair" and "Boat" Transition Structures
- 12:2912:29, 12 November 2010 diff hist +27 Rep:Mod3:shl108 →The regioselectivity of the Diels Alder Reaction
- 12:2912:29, 12 November 2010 diff hist +1,634 Rep:Mod3:shl108 →Optimizing the "Chair" and "Boat" Transition Structures
- 12:2712:27, 12 November 2010 diff hist 0 N File:Coperearr.png No edit summary current
- 12:2612:26, 12 November 2010 diff hist 0 N File:Coperea.jpg No edit summary current
- 12:0712:07, 12 November 2010 diff hist +842 Rep:Mod3:shl108 →Optimizing the Reactants and Products
- 11:5211:52, 12 November 2010 diff hist +15 Rep:Mod3:shl108 →Optimizing the Reactants and Products
- 11:5111:51, 12 November 2010 diff hist +445 Rep:Mod3:shl108 →Optimizing the Reactants and Products
- 11:5011:50, 12 November 2010 diff hist 0 N File:GAUCHE3.LOG No edit summary
- 11:4711:47, 12 November 2010 diff hist 0 N File:GAUCHE3.mol2 No edit summary current
- 11:4411:44, 12 November 2010 diff hist +525 Rep:Mod3:shl108 →Optimizing the Reactants and Products
- 11:1211:12, 12 November 2010 diff hist +174 Rep:Mod3:shl108 →Optimizing the Reactants and Products
- 10:3710:37, 12 November 2010 diff hist −18 Rep:Mod3:shl108 →The regioselectivity of the Diels Alder Reaction
11 November 2010
- 20:4120:41, 11 November 2010 diff hist +1 Rep:Mod3:shl108 →The regioselectivity of the Diels Alder Reaction
- 20:3420:34, 11 November 2010 diff hist 0 N File:ExoLUMO1.png No edit summary current
- 20:2720:27, 11 November 2010 diff hist +456 Rep:Mod3:shl108 →The regioselectivity of the Diels Alder Reaction
- 20:2720:27, 11 November 2010 diff hist 0 N File:ExoLUMO.png No edit summary current
- 20:2620:26, 11 November 2010 diff hist 0 N File:ExoHOMO.png No edit summary
- 20:2220:22, 11 November 2010 diff hist 0 N File:EndoHOMO.png No edit summary
- 20:2020:20, 11 November 2010 diff hist 0 N File:ENDOLUMO.png No edit summary current
- 20:0620:06, 11 November 2010 diff hist +5 Rep:Mod3:shl108 →Computation of the Transition State geometry for the prototype reaction
- 20:0620:06, 11 November 2010 diff hist −50 Rep:Mod3:shl108 →Computation of the Transition State geometry for the prototype reaction
- 19:5919:59, 11 November 2010 diff hist 0 Rep:Mod3:shl108 →Computation of the Transition State geometry for the prototype reaction
- 19:5519:55, 11 November 2010 diff hist 0 Rep:Mod3:shl108 →Computation of the Transition State geometry for the prototype reaction
9 November 2010
- 15:4215:42, 9 November 2010 diff hist +22 Rep:Mod3:shl108 →Computation of the Transition State geometry for the prototype reaction
- 15:4115:41, 9 November 2010 diff hist +113 Rep:Mod3:shl108 →Computation of the Transition State geometry for the prototype reaction
- 15:3415:34, 9 November 2010 diff hist +95 Rep:Mod3:shl108 →Computation of the Transition State geometry for the prototype reaction
- 15:1115:11, 9 November 2010 diff hist +60 Rep:Mod3:shl108 →Optimizing the Reactants and Products
- 15:0915:09, 9 November 2010 diff hist +175 Rep:Mod3:shl108 →Diels Alder Cycloaddition
- 15:0715:07, 9 November 2010 diff hist +194 Rep:Mod3:shl108 →Diels Alder Cycloaddition
- 15:0315:03, 9 November 2010 diff hist +101 Rep:Mod3:shl108 →Diels Alder Cycloaddition
- 15:0315:03, 9 November 2010 diff hist 0 N File:DielsAlderLUMO.png No edit summary
- 15:0215:02, 9 November 2010 diff hist 0 N File:DielAlderHOMO.png No edit summary current
- 14:5914:59, 9 November 2010 diff hist +18 Rep:Mod3:shl108 →Diels Alder Cycloaddition
- 14:5814:58, 9 November 2010 diff hist +53 Rep:Mod3:shl108 →Diels Alder Cycloaddition
- 14:5814:58, 9 November 2010 diff hist 0 N File:DielsAlderVibration.png No edit summary current
- 14:5514:55, 9 November 2010 diff hist +1 Rep:Mod3:shl108 →Diels Alder Cycloaddition
- 14:5414:54, 9 November 2010 diff hist +328 Rep:Mod3:shl108 →Diels Alder Cycloaddition
- 14:5014:50, 9 November 2010 diff hist +30 Rep:Mod3:shl108 →Diels Alder Cycloaddition