User contributions for Ql811

18 March 2014

• 15:0415:04, 18 March 2014 diff hist 0 N File:QloGEOMETRY.png No edit summary current
• 14:5814:58, 18 March 2014 diff hist −50 Rep:Mod:physcompquintinlo00690346 →Geometry of the transition structure
• 14:5814:58, 18 March 2014 diff hist +858 Rep:Mod:physcompquintinlo00690346 →The Diels Alder Cycloaddition
• 14:5314:53, 18 March 2014 diff hist −1,279 Rep:Mod:physcompquintinlo00690346 →The Diels Alder Cycloaddition
• 13:4813:48, 18 March 2014 diff hist +1,158 Rep:Mod:physcompquintinlo00690346 →The Diels Alder Cycloaddition
• 13:3513:35, 18 March 2014 diff hist +530 Rep:Mod:physcompquintinlo00690346 →The Diels Alder Cycloaddition
• 13:2613:26, 18 March 2014 diff hist +101 Rep:Mod:physcompquintinlo00690346 →The Diels Alder Cycloaddition
• 12:5912:59, 18 March 2014 diff hist 0 N File:QLODATSHOMODFT.PNG No edit summary current
• 12:5512:55, 18 March 2014 diff hist 0 N File:QlodatsLUMOAM1.PNG No edit summary current
• 12:5412:54, 18 March 2014 diff hist 0 N File:QLODATSHOMOAM1.PNG No edit summary current
• 12:5012:50, 18 March 2014 diff hist 0 N File:QLODATSOPTFREQ5AM1.LOG No edit summary current
• 12:4912:49, 18 March 2014 diff hist +27 Rep:Mod:physcompquintinlo00690346 →Ethylene and cis butadiene transition structure
• 12:4012:40, 18 March 2014 diff hist +1,506 Rep:Mod:physcompquintinlo00690346 →The Diels Alder Cycloaddition
• 12:1212:12, 18 March 2014 diff hist +545 Rep:Mod:physcompquintinlo00690346 →The Diels Alder Cycloaddition
• 11:5311:53, 18 March 2014 diff hist +654 Rep:Mod:physcompquintinlo00690346 →The Diels Alder Cycloaddition
• 11:4111:41, 18 March 2014 diff hist +130 Rep:Mod:physcompquintinlo00690346 →The Diels Alder Cycloaddition
• 11:3911:39, 18 March 2014 diff hist +976 Rep:Mod:physcompquintinlo00690346 →The Diels Alder Cycloaddition
• 11:3211:32, 18 March 2014 diff hist 0 N File:QLOCISBUTADIENEOPT2AM1.LOG No edit summary current

17 March 2014

• 22:2622:26, 17 March 2014 diff hist +101 Rep:Mod:physcompquintinlo00690346 →IRC
• 22:2422:24, 17 March 2014 diff hist +1 Rep:Mod:physcompquintinlo00690346 →IRC
• 22:2322:23, 17 March 2014 diff hist −132 Rep:Mod:physcompquintinlo00690346 →Ethylene and cis butadiene transition structure
• 22:2022:20, 17 March 2014 diff hist +428 Rep:Mod:physcompquintinlo00690346 →Ethylene and cis butadiene transition structure
• 22:1122:11, 17 March 2014 diff hist +2 Rep:Mod:physcompquintinlo00690346 →Ethylene and cis butadiene transition structure
• 22:1122:11, 17 March 2014 diff hist +91 Rep:Mod:physcompquintinlo00690346 →Ethylene and cis butadiene transition structure
• 21:1321:13, 17 March 2014 diff hist +554 Rep:Mod:physcompquintinlo00690346 →The Diels Alder Cycloaddition
• 20:5220:52, 17 March 2014 diff hist +44 Rep:Mod:physcompquintinlo00690346 →Vibrational motions of the optimised structures
• 20:5120:51, 17 March 2014 diff hist +113 Rep:Mod:physcompquintinlo00690346 →The Diels Alder Cycloaddition
• 20:4720:47, 17 March 2014 diff hist +28 Rep:Mod:physcompquintinlo00690346 →Ethylene and cis butadiene transition structure
• 17:3417:34, 17 March 2014 diff hist +100 Rep:Mod:physcompquintinlo00690346 →Vibrational motions of the optimised structures
• 17:2917:29, 17 March 2014 diff hist 0 Rep:Mod:physcompquintinlo00690346 →The Diels Alder Cycloaddition
• 17:0817:08, 17 March 2014 diff hist +633 Rep:Mod:physcompquintinlo00690346 →The Diels Alder Cycloaddition
• 17:0117:01, 17 March 2014 diff hist 0 N File:QLODATSOPTFREQ5DFT.LOG No edit summary current
• 17:0017:00, 17 March 2014 diff hist −1 Rep:Mod:physcompquintinlo00690346 →B3LYP/6-31G* optimisation =
• 16:5916:59, 17 March 2014 diff hist +1,364 Rep:Mod:physcompquintinlo00690346 →Ethylene and cis butadiene transition structure
• 16:5516:55, 17 March 2014 diff hist +376 Rep:Mod:physcompquintinlo00690346 →Ethylene and cis butadiene transition structure
• 16:3216:32, 17 March 2014 diff hist +211 Rep:Mod:physcompquintinlo00690346 →The Diels Alder Cycloaddition
• 16:2616:26, 17 March 2014 diff hist 0 Rep:Mod:physcompquintinlo00690346 →The Diels Alder Cycloaddition
• 16:2416:24, 17 March 2014 diff hist +130 Rep:Mod:physcompquintinlo00690346 No edit summary
• 16:1916:19, 17 March 2014 diff hist 0 Rep:Mod:physcompquintinlo00690346 →cis butadiene
• 16:1916:19, 17 March 2014 diff hist +1,151 Rep:Mod:physcompquintinlo00690346 →cis butadiene
• 16:0116:01, 17 March 2014 diff hist +1,431 Rep:Mod:physcompquintinlo00690346 →cis butadiene
• 16:0016:00, 17 March 2014 diff hist 0 N File:QLOCISBUTADIENEOPT2DFT.LOG No edit summary current
• 15:5115:51, 17 March 2014 diff hist 0 File:Qlovibrations2.gif uploaded a new version of "File:Qlovibrations2.gif" current
• 15:4615:46, 17 March 2014 diff hist +1 Rep:Mod:physcompquintinlo00690346 →Optimisation of the "Chair" transition state
• 15:4615:46, 17 March 2014 diff hist 0 File:QlovibrationsB3LYP1.gif uploaded a new version of "File:QlovibrationsB3LYP1.gif" current
• 15:4415:44, 17 March 2014 diff hist 0 File:Qlovibrationchairtsstate.gif uploaded a new version of "File:Qlovibrationchairtsstate.gif" current
• 15:2815:28, 17 March 2014 diff hist 0 File:QlovibrationsB3LYP2.gif uploaded a new version of "File:QlovibrationsB3LYP2.gif" current
• 15:2615:26, 17 March 2014 diff hist 0 File:Qloboatanimation.gif uploaded a new version of "File:Qloboatanimation.gif" current
• 15:2415:24, 17 March 2014 diff hist 0 File:QlodatsvibrationsPOSITIVE.gif uploaded a new version of "File:QlodatsvibrationsPOSITIVE.gif" current
• 15:2315:23, 17 March 2014 diff hist 0 File:Qlodatsvibrations.gif uploaded a new version of "File:Qlodatsvibrations.gif" current