User contributions for Ql811
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12 March 2014
- 21:2721:27, 12 March 2014 diff hist 0 Rep:Mod:physcompquintinlo00690346 →QST2 optimisation of the "Boat" transition state
- 21:2621:26, 12 March 2014 diff hist +1,178 Rep:Mod:physcompquintinlo00690346 No edit summary
- 21:1921:19, 12 March 2014 diff hist +357 Rep:Mod:physcompquintinlo00690346 →QST2 optimisation of the "Boat" transition state
- 21:1721:17, 12 March 2014 diff hist 0 N File:Qloboatanimation.gif No edit summary
- 21:1221:12, 12 March 2014 diff hist 0 Rep:Mod:physcompquintinlo00690346 →QST2 optimisation of the "Boat" transition state
- 21:1221:12, 12 March 2014 diff hist +752 Rep:Mod:physcompquintinlo00690346 →QST2 optimisation of the "Chair" transition state
- 21:1121:11, 12 March 2014 diff hist 0 N File:Qloqst2trial2modified.chk No edit summary current
- 21:0921:09, 12 March 2014 diff hist 0 N File:Qloqst2boatstructure.PNG No edit summary current
- 21:0221:02, 12 March 2014 diff hist 0 N File:Qlomodifiedreactantproduct.PNG No edit summary current
- 20:5420:54, 12 March 2014 diff hist +492 Rep:Mod:physcompquintinlo00690346 No edit summary
- 20:5220:52, 12 March 2014 diff hist 0 N File:Qloqst2trial1.chk No edit summary current
- 20:4720:47, 12 March 2014 diff hist 0 Rep:Mod:physcompquintinlo00690346 →QST2 optimisation of the "Chair" transition state
- 20:4620:46, 12 March 2014 diff hist +4 Rep:Mod:physcompquintinlo00690346 →QST2 optimisation of the "Chair" transition state
- 20:4620:46, 12 March 2014 diff hist +280 Rep:Mod:physcompquintinlo00690346 No edit summary
- 20:4420:44, 12 March 2014 diff hist 0 N File:Qloreactantproduct.PNG No edit summary current
- 20:2720:27, 12 March 2014 diff hist +296 Rep:Mod:physcompquintinlo00690346 →Optimising the "Chair" and "Boat" Transition Structures
- 20:2020:20, 12 March 2014 diff hist +326 Rep:Mod:physcompquintinlo00690346 No edit summary
- 20:1620:16, 12 March 2014 diff hist +9 Rep:Mod:physcompquintinlo00690346 →Optimising the "Chair" and "Boat" Transition Structures
- 20:1320:13, 12 March 2014 diff hist −97 Rep:Mod:physcompquintinlo00690346 No edit summary
- 20:1220:12, 12 March 2014 diff hist +501 Rep:Mod:physcompquintinlo00690346 No edit summary
- 20:0820:08, 12 March 2014 diff hist 0 N File:Qlovibrations2.gif No edit summary
- 20:0720:07, 12 March 2014 diff hist +12 Rep:Mod:physcompquintinlo00690346 No edit summary
- 20:0720:07, 12 March 2014 diff hist +845 Rep:Mod:physcompquintinlo00690346 No edit summary
- 18:2018:20, 12 March 2014 diff hist +189 Rep:Mod:physcompquintinlo00690346 →Optimising the "Chair" and "Boat" Transition Structures
- 18:1818:18, 12 March 2014 diff hist 0 N File:QLOCHAIRPARTD.LOG No edit summary current
- 17:3017:30, 12 March 2014 diff hist +5 Rep:Mod:physcompquintinlo00690346 →Optimising the "Chair" and "Boat" Transition Structures
- 17:2817:28, 12 March 2014 diff hist +128 Rep:Mod:physcompquintinlo00690346 →Optimising the "Chair" and "Boat" Transition Structures
- 17:2717:27, 12 March 2014 diff hist +33 Rep:Mod:physcompquintinlo00690346 No edit summary
- 17:2617:26, 12 March 2014 diff hist 0 N File:QlochairtsguessOPTFREQFROZEN.chk No edit summary current
- 17:2617:26, 12 March 2014 diff hist 0 N File:Qlochairstructurefrozenstate.PNG No edit summary current
- 17:0817:08, 12 March 2014 diff hist +426 Rep:Mod:physcompquintinlo00690346 No edit summary
- 16:5716:57, 12 March 2014 diff hist +1,239 Rep:Mod:physcompquintinlo00690346 →Optimising the "Chair" and "Boat" Transition Structures
- 16:4616:46, 12 March 2014 diff hist +13 Rep:Mod:physcompquintinlo00690346 →Optimising the "Chair" and "Boat" Transition Structures
- 16:4616:46, 12 March 2014 diff hist 0 File:Qlovibrationchairtsstate.gif uploaded a new version of "File:Qlovibrationchairtsstate.gif"
- 16:4416:44, 12 March 2014 diff hist 0 File:Qlovibrationchairtsstate.gif uploaded a new version of "File:Qlovibrationchairtsstate.gif"
- 16:4316:43, 12 March 2014 diff hist −7 Rep:Mod:physcompquintinlo00690346 →Optimising the "Chair" and "Boat" Transition Structures
- 16:4116:41, 12 March 2014 diff hist +394 Rep:Mod:physcompquintinlo00690346 →Optimising the "Chair" and "Boat" Transition Structures
- 16:3816:38, 12 March 2014 diff hist 0 N File:Qlovibrationchairtsstate.gif No edit summary
- 16:3316:33, 12 March 2014 diff hist 0 N File:Qlochairstructure.PNG No edit summary current
- 16:3116:31, 12 March 2014 diff hist 0 N File:QLOCHAIRTSGUESSOPTFREQ.LOG No edit summary current
- 16:1416:14, 12 March 2014 diff hist +1,047 Rep:Mod:physcompquintinlo00690346 →Optimising the "Chair" and "Boat" Transition Structures
- 16:0316:03, 12 March 2014 diff hist −1 Rep:Mod:physcompquintinlo00690346 →Optimising the "Chair" and "Boat" Transition Structures
- 16:0216:02, 12 March 2014 diff hist +912 Rep:Mod:physcompquintinlo00690346 No edit summary
- 15:5915:59, 12 March 2014 diff hist 0 N File:Qlohalfstructure.PNG No edit summary current
- 15:5615:56, 12 March 2014 diff hist +215 Rep:Mod:physcompquintinlo00690346 No edit summary
- 15:5515:55, 12 March 2014 diff hist 0 N File:QLOHALFC2VBOATTSSTATEOPT.LOG No edit summary current
- 15:5415:54, 12 March 2014 diff hist 0 N File:QLO15HEXADIENEANTI2OPTDFT2.LOG No edit summary current
- 15:3215:32, 12 March 2014 diff hist −5 Rep:Mod:physcompquintinlo00690346 No edit summary
- 15:3115:31, 12 March 2014 diff hist +177 Rep:Mod:physcompquintinlo00690346 No edit summary
- 15:2315:23, 12 March 2014 diff hist −4 Rep:Mod:physcompquintinlo00690346 →Optimising the "Chair" and "Boat" Transition Structures