User contributions for As12713
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19 November 2015
- 14:1114:11, 19 November 2015 diff hist 0 N File:AS12713 Ethene LUMO.jpg No edit summary current
- 14:1114:11, 19 November 2015 diff hist 0 N File:AS12713 Ethene HOMO.jpg No edit summary current
- 14:0214:02, 19 November 2015 diff hist +406 Rep:Mod:ASb34ch3s1 No edit summary
- 13:5913:59, 19 November 2015 diff hist 0 N File:AS12713 ETHENE OPT SE AM1.LOG No edit summary current
- 13:5813:58, 19 November 2015 diff hist 0 N File:AS12713 Ethene opt.jpg No edit summary current
- 13:5013:50, 19 November 2015 diff hist +107 Rep:Mod:ASb34ch3s1 →The Diels Alder Cycloaddition
- 13:4613:46, 19 November 2015 diff hist +44 Rep:Mod:ASb34ch3s1 No edit summary
- 13:4513:45, 19 November 2015 diff hist −61 Rep:Mod:ASb34ch3s1 →Background
- 13:4313:43, 19 November 2015 diff hist +316 Rep:Mod:ASb34ch3s1 No edit summary
- 13:3513:35, 19 November 2015 diff hist 0 N File:AS12713 Diels-Alder2.jpg No edit summary current
- 13:3513:35, 19 November 2015 diff hist 0 N File:AS12713 Diels-Alder1.jpg No edit summary current
- 13:0513:05, 19 November 2015 diff hist −13 Rep:Mod:ASb34ch3s1 →HF/3-21G Optimisation
- 02:3802:38, 19 November 2015 diff hist +4 Rep:Mod:ASb34ch3s1 →Comparison of Dihedral Angle
- 02:3702:37, 19 November 2015 diff hist +116 Rep:Mod:ASb34ch3s1 No edit summary
- 02:2402:24, 19 November 2015 diff hist +34 Rep:Mod:ASb34ch3s1 →Boat Transition Structure Reoptimisation
- 02:2302:23, 19 November 2015 diff hist +34 Rep:Mod:ASb34ch3s1 →Chair Transition Structure Reoptimisation
- 02:2302:23, 19 November 2015 diff hist +34 Rep:Mod:ASb34ch3s1 →Optimising the "boat" transition structure
- 02:2202:22, 19 November 2015 diff hist −12 Rep:Mod:ASb34ch3s1 →Optimising the "chair" transition structure
- 02:2102:21, 19 November 2015 diff hist +36 Rep:Mod:ASb34ch3s1 →Optimising the allyl fragment
- 02:1902:19, 19 November 2015 diff hist +80 Rep:Mod:ASb34ch3s1 →Optimising the "chair" transition structure
- 02:1602:16, 19 November 2015 diff hist −36 Rep:Mod:ASb34ch3s1 →Boat Transition Structure Reoptimisation
- 02:1102:11, 19 November 2015 diff hist −2 Rep:Mod:ASb34ch3s1 →Comparison of Dihedral Angle
- 02:1102:11, 19 November 2015 diff hist +111 Rep:Mod:ASb34ch3s1 →Comparison of Dihedral Angle
- 02:0202:02, 19 November 2015 diff hist +39 Rep:Mod:ASb34ch3s1 No edit summary
- 01:5801:58, 19 November 2015 diff hist +1,534 Rep:Mod:ASb34ch3s1 No edit summary
- 01:2501:25, 19 November 2015 diff hist +1,852 Rep:Mod:ASb34ch3s1 No edit summary
- 00:2500:25, 19 November 2015 diff hist +1,548 Rep:Mod:ASb34ch3s1 No edit summary
18 November 2015
- 23:3223:32, 18 November 2015 diff hist +660 Rep:Mod:ASb34ch3s1 No edit summary
- 23:0723:07, 18 November 2015 diff hist +1,636 Rep:Mod:ASb34ch3s1 No edit summary
- 22:2822:28, 18 November 2015 diff hist +919 Rep:Mod:ASb34ch3s1 No edit summary
- 21:3321:33, 18 November 2015 diff hist +114 Rep:Mod:ASb34ch3s1 No edit summary
- 19:4619:46, 18 November 2015 diff hist +724 Rep:Mod:ASb34ch3s1 No edit summary
- 19:4019:40, 18 November 2015 diff hist 0 N File:AS12713 Boat optfreq B3LYP (G).out No edit summary current
- 19:3919:39, 18 November 2015 diff hist 0 N File:AS12713 Boat optfreq B3LYP G.jpg No edit summary current
- 19:3519:35, 18 November 2015 diff hist +732 Rep:Mod:ASb34ch3s1 No edit summary
- 19:2619:26, 18 November 2015 diff hist 0 N File:AS12713 Chair optfreq B3LYP (G).out No edit summary current
- 19:2619:26, 18 November 2015 diff hist 0 N File:AS12713 Chair optfreq B3LYP G.jpg No edit summary current
- 19:1019:10, 18 November 2015 diff hist +796 Rep:Mod:ASb34ch3s1 No edit summary
- 18:5118:51, 18 November 2015 diff hist +1,297 Rep:Mod:ASb34ch3s1 No edit summary
- 17:5817:58, 18 November 2015 diff hist +8 Rep:Mod:ASb34ch3s1 →IRC of Optimised "Chair" and "Boat" Transition Structures
- 17:5617:56, 18 November 2015 diff hist +298 Rep:Mod:ASb34ch3s1 No edit summary
- 17:4217:42, 18 November 2015 diff hist 0 N File:AS12713 IRC RMSGrad.jpg No edit summary current
- 17:4117:41, 18 November 2015 diff hist 0 N File:AS12713 IRC totalenergy.jpg No edit summary current
- 17:3517:35, 18 November 2015 diff hist −68 Rep:Mod:ASb34ch3s1 →IRC of Optimised "Chair" and "Boat" Transition Structures
- 17:3317:33, 18 November 2015 diff hist +69 Rep:Mod:ASb34ch3s1 →QST2 Method
- 17:3017:30, 18 November 2015 diff hist +748 Rep:Mod:ASb34ch3s1 →Optimising the "boat" transition structure
- 17:2417:24, 18 November 2015 diff hist −747 Rep:Mod:ASb34ch3s1 →QST2 Method
- 17:1817:18, 18 November 2015 diff hist +749 Rep:Mod:ASb34ch3s1 →QST2 Method
- 17:1317:13, 18 November 2015 diff hist 0 N File:AS12713 REACT NUMBERING QST2 PROPER.LOG No edit summary current
- 17:0717:07, 18 November 2015 diff hist 0 N File:AS12713 QST2 numbering proper resultssumm.jpg No edit summary current