User contributions for Sb807
Appearance
16 December 2009
- 23:5223:52, 16 December 2009 diff hist 0 Rep:Phys:sb807 →2f: Intrinsic Reaction coordinate
- 23:5223:52, 16 December 2009 diff hist −2 Rep:Phys:sb807 →2f: Intrinsic Reaction coordinate
- 23:5123:51, 16 December 2009 diff hist +6 Rep:Phys:sb807 →2f: Intrinsic Reaction coordinate
- 23:5123:51, 16 December 2009 diff hist 0 N File:Second IRC always.jpg No edit summary current
- 23:5023:50, 16 December 2009 diff hist +74 Rep:Phys:sb807 →2f: Intrinsic Reaction coordinate
- 23:4723:47, 16 December 2009 diff hist +557 Rep:Phys:sb807 →2f: Intrinsic Reaction coordinate
- 23:3423:34, 16 December 2009 diff hist +88 Rep:Phys:sb807 →2f: Intrinsic Reaction coordinate
- 23:3323:33, 16 December 2009 diff hist 0 N File:IRC two.png No edit summary current
- 23:3223:32, 16 December 2009 diff hist +25 Rep:Phys:sb807 →2f: Intrinsic Reaction coordinate
- 23:3123:31, 16 December 2009 diff hist +148 m Rep:Phys:sb807 →2f: Intrinsic Reaction coordinate
- 23:3023:30, 16 December 2009 diff hist +25 Rep:Phys:sb807 →2f: Intrinsic Reaction coordinate
- 23:2923:29, 16 December 2009 diff hist 0 N File:IRC one.png No edit summary current
- 23:2423:24, 16 December 2009 diff hist +63 Rep:Phys:sb807 →2f: Intrinsic Reaction coordinate
- 23:2223:22, 16 December 2009 diff hist +207 Rep:Phys:sb807 →2f: Intrinsic Reaction coordinate
- 23:1923:19, 16 December 2009 diff hist +40 Rep:Phys:sb807 →2f/g: Intrinsic Reaction coordinate
- 21:2521:25, 16 December 2009 diff hist +136 Rep:Phys:sb807 →2e/f/g: Optimising the boat transition state
- 21:0821:08, 16 December 2009 diff hist +177 Rep:Phys:sb807 →2b/c/d: Optimising the chair transition state
- 21:0621:06, 16 December 2009 diff hist +38 Rep:Phys:sb807 →2b/c/d: Optimising the chair transition state
- 21:0221:02, 16 December 2009 diff hist +160 Rep:Phys:sb807 →2b/c/d: Optimising the chair transition state
- 20:5620:56, 16 December 2009 diff hist +11 Rep:Phys:sb807 →2b/c/d: Optimising the chair transition state
- 20:5420:54, 16 December 2009 diff hist −515 Rep:Phys:sb807 →2b/c/d: Optimising the chair transition state
- 20:5220:52, 16 December 2009 diff hist −1 Rep:Phys:sb807 →2b/c/d: Optimising the chair transition state
- 20:5220:52, 16 December 2009 diff hist +803 Rep:Phys:sb807 →2b/c/d: Optimising the chair transition state
- 20:4820:48, 16 December 2009 diff hist +528 Rep:Phys:sb807 →2b/c/d: Optimising the chair transition state
- 20:4420:44, 16 December 2009 diff hist −7 Rep:Phys:sb807 →2b/c/d: Optimising the chair transition state
- 20:4320:43, 16 December 2009 diff hist 0 N File:818cmvibration.png No edit summary current
- 20:4320:43, 16 December 2009 diff hist +260 Rep:Phys:sb807 →2b/c/d: Optimising the chair transition state
- 20:3920:39, 16 December 2009 diff hist +70 Rep:Phys:sb807 →1g: DFT/B3LYP(6-31G,d) Frequency analysis and more
- 20:3520:35, 16 December 2009 diff hist −4 Rep:Phys:sb807 →2b/c/d: Optimising the chair transition state
- 20:3420:34, 16 December 2009 diff hist +506 Rep:Phys:sb807 →2b/c: Optimising the chair transition state
- 20:2820:28, 16 December 2009 diff hist +17 Rep:Phys:sb807 →2e/f/g: Optimising the boat transition state
- 20:2720:27, 16 December 2009 diff hist +4 Rep:Phys:sb807 →2e/f/g: Optimising the boat transition state
- 20:2720:27, 16 December 2009 diff hist 0 N File:Boat transition state.png No edit summary current
- 20:2620:26, 16 December 2009 diff hist +58 Rep:Phys:sb807 →2e/f/g: Optimising the boat transition state
- 20:2620:26, 16 December 2009 diff hist +212 Rep:Phys:sb807 →2e/f/g: Optimising the boat transition state
- 18:3618:36, 16 December 2009 diff hist +64 Rep:Phys:sb807 →1g: DFT/B3LYP(6-31G,d) Frequency analysis and more
- 18:2618:26, 16 December 2009 diff hist +112 Rep:Phys:sb807 →2e/f/g: Optimising the boat transition state
- 18:0618:06, 16 December 2009 diff hist 0 Rep:Phys:sb807 →1.Building and optimising Cis-Butadiene
- 18:0618:06, 16 December 2009 diff hist 0 N File:Cisbutadiene LUMO.JPG No edit summary current
- 18:0618:06, 16 December 2009 diff hist 0 N File:Cisbutadiene HOMO.JPG No edit summary current
- 18:0418:04, 16 December 2009 diff hist +18 Rep:Phys:sb807 →1.Building and optimising Cis-Butadiene
- 18:0418:04, 16 December 2009 diff hist 0 N File:Cisbutadiene HOMO.tif No edit summary current
- 18:0318:03, 16 December 2009 diff hist +200 Rep:Phys:sb807 →1.Building and optimising Cis-Butadiene
- 18:0218:02, 16 December 2009 diff hist −131 Rep:Phys:sb807 →2.Computation of the Transition State geometry
- 17:0017:00, 16 December 2009 diff hist −28 Rep:Phys:sb807 →2.Computation of the Transition State geometry
- 16:5916:59, 16 December 2009 diff hist 0 N File:HOMO two.png No edit summary current
- 16:5916:59, 16 December 2009 diff hist 0 N File:HOMO one.png No edit summary current
- 16:5916:59, 16 December 2009 diff hist +159 Rep:Phys:sb807 →2.Computation of the Transition State geometry
- 16:5116:51, 16 December 2009 diff hist +197 Rep:Phys:sb807 →2.Computation of the Transition State geometry
- 16:5016:50, 16 December 2009 diff hist 0 N File:DIELS ALDER TRANSITION STATE GUESS FOURTH.LOG No edit summary current