User contributions for Rp2513
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24 January 2016
- 11:2911:29, 24 January 2016 diff hist 0 N File:CB TS QST2 CHANGED ANGLES(5).LOG No edit summary current
- 11:2711:27, 24 January 2016 diff hist 0 N File:RP qts2 summary.png No edit summary current
- 11:2611:26, 24 January 2016 diff hist +8 Rep:Mod:RP2513 →Using the QST2 Method
- 11:1811:18, 24 January 2016 diff hist +2,259 Rep:Mod:RP2513 →Optimisation using Frozen-Coordinate Method
- 11:1811:18, 24 January 2016 diff hist 0 N File:Qts2 final productreactant RP.png No edit summary current
- 11:1611:16, 24 January 2016 diff hist 0 N File:Qts2 fail structure.png No edit summary current
- 11:1411:14, 24 January 2016 diff hist 0 N File:Qts2 failure productreactant RP.png No edit summary current
- 10:2610:26, 24 January 2016 diff hist +1,416 Rep:Mod:RP2513 →Optimisation of Boat and Chair Transition Structures
- 10:2310:23, 24 January 2016 diff hist 0 N File:CB FREEZE DAY2 ATTEMPT3 BERNY.LOG No edit summary current
- 10:2210:22, 24 January 2016 diff hist 0 N File:RP Frozen coord.png No edit summary current
- 10:1510:15, 24 January 2016 diff hist −26 Rep:Mod:RP2513 →Optimisation of Chair Transition Structure
- 10:1510:15, 24 January 2016 diff hist +303 Rep:Mod:RP2513 →Optimisation of Chair Transition Structure
- 10:0710:07, 24 January 2016 diff hist +1,111 Rep:Mod:RP2513 →Optimisation of Boat and Chair Transition Structures
- 10:0310:03, 24 January 2016 diff hist 0 N File:CB TS BERNY(1).LOG No edit summary current
- 10:0310:03, 24 January 2016 diff hist 0 N File:RP TS(Berny)guess.png No edit summary current
- 09:4909:49, 24 January 2016 diff hist +612 Rep:Mod:RP2513 →Optimisation of Allyl fragment
- 09:4809:48, 24 January 2016 diff hist 0 N File:RP-CB ALLYL FRAGMENT 3-21G (1).LOG No edit summary current
- 09:4709:47, 24 January 2016 diff hist 0 N File:RPallyl fragment summary.png No edit summary current
- 09:4109:41, 24 January 2016 diff hist +696 Rep:Mod:RP2513 No edit summary
- 09:2809:28, 24 January 2016 diff hist +1,342 Rep:Mod:RP2513 No edit summary
22 January 2016
- 18:1418:14, 22 January 2016 diff hist +100 Rep:Mod:RP2513 →Introduction
- 18:0318:03, 22 January 2016 diff hist −1 Rep:Mod:RP2513 →Comparison of Hartree-Fock and Density Function Theory
- 18:0018:00, 22 January 2016 diff hist +1,230 Rep:Mod:RP2513 No edit summary
- 17:5417:54, 22 January 2016 diff hist +53 Rep:Mod:RP2513 →Frequency Analysis
- 17:5117:51, 22 January 2016 diff hist +163 Rep:Mod:RP2513 →Frequency Analysis
- 17:4717:47, 22 January 2016 diff hist +1,726 Rep:Mod:RP2513 →Frequency Analysis
- 17:4417:44, 22 January 2016 diff hist 0 N File:RP-anti2-IR.png No edit summary current
- 17:4217:42, 22 January 2016 diff hist 0 N File:RPanti2-freq.png No edit summary current
- 17:1117:11, 22 January 2016 diff hist +27 Rep:Mod:RP2513 →Reoptimisation of anti2 conformer of 1,5-hexadiene at B3LYP/6-31G(d) level of theory
- 17:0217:02, 22 January 2016 diff hist +871 Rep:Mod:RP2513 →Reoptimisation of anti2 conformer of 1,5-hexadiene at B3LYP/6-31G(d) level of theory
- 16:2616:26, 22 January 2016 diff hist +1,168 Rep:Mod:RP2513 →Reoptimisation of anti2 conformer of 1,5-hexadiene at B3LYP/6-31G(d) level of theory
- 16:1816:18, 22 January 2016 diff hist 0 N File:RP-numbered-anti2.png No edit summary current
- 15:4715:47, 22 January 2016 diff hist +815 Rep:Mod:RP2513 →Introduction
- 15:4715:47, 22 January 2016 diff hist 0 N File:RPanti-2-6-31g.png No edit summary current
- 15:4615:46, 22 January 2016 diff hist 0 N File:RP-REACTION ANTI (1).LOG No edit summary current
- 15:3115:31, 22 January 2016 diff hist +492 Rep:Mod:RP2513 →Background
- 15:3015:30, 22 January 2016 diff hist 0 N File:RPgauche3MO.png No edit summary current
- 15:0515:05, 22 January 2016 diff hist 0 Rep:Mod:RP2513 →Background
- 15:0115:01, 22 January 2016 diff hist +573 Rep:Mod:RP2513 →Introduction
- 15:0015:00, 22 January 2016 diff hist 0 N File:RP-REACTION GAUCHE (3).LOG No edit summary current
- 14:5914:59, 22 January 2016 diff hist 0 N File:RP-REACTION GAUCHE 3 (4).LOG No edit summary current
- 14:4614:46, 22 January 2016 diff hist 0 N File:RP-REACTION ANTI2 (5).LOG No edit summary current
- 14:4314:43, 22 January 2016 diff hist 0 N File:RP2513-Gauche6-3-21G.png No edit summary current
- 14:4114:41, 22 January 2016 diff hist 0 N File:RP2513-Gauche3-3-21G.png No edit summary current
- 14:2414:24, 22 January 2016 diff hist 0 Rep:Mod:RP2513 →Background
- 14:2414:24, 22 January 2016 diff hist +19 Rep:Mod:RP2513 →Background
- 14:2014:20, 22 January 2016 diff hist −2 Rep:Mod:RP2513 No edit summary
- 14:1914:19, 22 January 2016 diff hist +19 N File:RP2513-anti2-3-21G.png rp2513 anti 2 3-12g current
- 14:1614:16, 22 January 2016 diff hist +516 Rep:Mod:RP2513 →Background
- 13:3713:37, 22 January 2016 diff hist +1,250 N Rep:Mod:RP2513 Created page with "==Introduction== ===Background=== The Cope rearrangement is a pericyclic reaction involving the [3,3] sigmatropic rearrangement of 1,5 dienes. It was first discovered by Ar..."