User contributions for Twp07
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16 December 2009
- 10:0210:02, 16 December 2009 diff hist 0 N File:TWP Cyclohexadienerxnscheme.gif No edit summary current
- 10:0210:02, 16 December 2009 diff hist 0 N File:DA reaction scheme.gif No edit summary current
- 10:0110:01, 16 December 2009 diff hist +267 Rep:Mod:twpphysical →Reaction of Cyclohexa-1,3-diene with Maleic Anhydride
- 09:5009:50, 16 December 2009 diff hist +61 Rep:Mod:twpphysical →Calculation of Transition State Geometry
- 09:4909:49, 16 December 2009 diff hist +194 Rep:Mod:twpphysical →Calculation of Transition State Geometry
- 09:4509:45, 16 December 2009 diff hist +275 Rep:Mod:twpphysical →Calculation of Transition State Geometry
- 09:4109:41, 16 December 2009 diff hist 0 N File:TWP DA TS lowestRealFreq.jpg No edit summary current
- 09:3909:39, 16 December 2009 diff hist +182 Rep:Mod:twpphysical →Calculation of Transition State Geometry
- 09:3509:35, 16 December 2009 diff hist 0 N File:TWP DA TS VectorDisplacements.jpg No edit summary current
- 09:2909:29, 16 December 2009 diff hist +576 Rep:Mod:twpphysical →Calculation of Transition State Geometry
15 December 2009
- 20:5920:59, 15 December 2009 diff hist −8 Rep:Mod:twpphysical →Calculation of Transition State Geometry
- 20:5920:59, 15 December 2009 diff hist 0 Rep:Mod:twpphysical →Calculation of Transition State Geometry
- 20:5820:58, 15 December 2009 diff hist +451 Rep:Mod:twpphysical →Calculation of Transition State Geometry
- 20:5020:50, 15 December 2009 diff hist 0 N File:TWP TS LUMO.jpg No edit summary current
- 20:4920:49, 15 December 2009 diff hist 0 N File:TWP TS HOMO.jpg No edit summary current
- 20:4420:44, 15 December 2009 diff hist 0 N File:TWP DA TS QST2 animation.gif No edit summary current
- 20:4420:44, 15 December 2009 diff hist +28 Rep:Mod:twpphysical →Calculation of Transition State Geometry
- 20:3120:31, 15 December 2009 diff hist +269 Rep:Mod:twpphysical →Calculation of Transition State Geometry
- 20:2320:23, 15 December 2009 diff hist 0 N File:TWP TS QST2.jpg No edit summary current
- 20:2320:23, 15 December 2009 diff hist +15 Rep:Mod:twpphysical →Ethylene HOMO and Butadiene LUMO
- 20:2220:22, 15 December 2009 diff hist +119 Rep:Mod:twpphysical →Calculation of Transition State Geometry
- 20:1920:19, 15 December 2009 diff hist +718 Rep:Mod:twpphysical →Calculation of Transition Structure
- 20:1420:14, 15 December 2009 diff hist 0 N File:TWP DA TS guess.jpg No edit summary current
- 20:0820:08, 15 December 2009 diff hist +43 Rep:Mod:twpphysical →Ethylene HOMO and Butadiene LUMO
- 20:0720:07, 15 December 2009 diff hist +10 Rep:Mod:twpphysical →Ethylene and Butadiene
- 20:0720:07, 15 December 2009 diff hist +428 Rep:Mod:twpphysical →The Diels-Alder Cycloaddition
- 20:0220:02, 15 December 2009 diff hist +59 Rep:Mod:twpphysical →Introduction
- 20:0120:01, 15 December 2009 diff hist 0 N File:TWP DA reaction scheme.gif No edit summary current
- 19:5919:59, 15 December 2009 diff hist +1,279 Rep:Mod:twpphysical →The Diels-Alder Cycloaddition
- 19:5119:51, 15 December 2009 diff hist 0 N File:TWP Butadiene LUMO.jpg No edit summary current
- 19:5119:51, 15 December 2009 diff hist 0 N File:TWP Butadiene HOMO.jpg No edit summary current
- 19:5019:50, 15 December 2009 diff hist 0 N File:TWP Ethylene LUMO.jpg No edit summary current
- 19:5019:50, 15 December 2009 diff hist 0 N File:TWP Ethylene HOMO.jpg No edit summary current
- 19:3619:36, 15 December 2009 diff hist +30 Rep:Mod:twpphysical →Activation Energies
- 19:3219:32, 15 December 2009 diff hist +30 Rep:Mod:twpphysical →Activation Energies
- 19:2919:29, 15 December 2009 diff hist +629 Rep:Mod:twpphysical →Activation Energies
- 19:1119:11, 15 December 2009 diff hist +247 Rep:Mod:twpphysical →Intrinsic Reaction Coordinate Method
- 19:0919:09, 15 December 2009 diff hist +88 Rep:Mod:twpphysical →Intrinsic Reaction Coordinate Method
- 19:0619:06, 15 December 2009 diff hist +415 Rep:Mod:twpphysical →Intrinsic Reaction Coordinate Method
- 14:4314:43, 15 December 2009 diff hist +448 Rep:Mod:twpphysical →Intrinsic Reaction Coordinate Method
- 14:4014:40, 15 December 2009 diff hist +44 Rep:Mod:twpphysical →Boat Transition Structure Optimisation
- 14:3814:38, 15 December 2009 diff hist +5 Rep:Mod:twpphysical →QST2 method
- 14:3814:38, 15 December 2009 diff hist −112 Rep:Mod:twpphysical →Optimising the Boat Transition Structure
- 14:3014:30, 15 December 2009 diff hist −2 Rep:Mod:twpphysical →Optimising the Chair Transition Structure
- 14:3014:30, 15 December 2009 diff hist −3 Rep:Mod:twpphysical →Using the Force Constant Matrix
- 14:3014:30, 15 December 2009 diff hist −10 Rep:Mod:twpphysical →Optimising the boat transition structure
- 14:2914:29, 15 December 2009 diff hist 0 Rep:Mod:twpphysical →Optimising the chair transition structure
- 14:2814:28, 15 December 2009 diff hist +113 Rep:Mod:twpphysical →Frozen Coordinate Method
- 14:2714:27, 15 December 2009 diff hist 0 N File:TWP Chair ts frozencoord method.jpg No edit summary current
- 14:2114:21, 15 December 2009 diff hist −85 Rep:Mod:twpphysical →Frozen Coordinate Method