User contributions for Leb09
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8 February 2013
- 15:3615:36, 8 February 2013 diff hist +59 Rep:Mod:LBinfieldModule3 →Optimisation of the hexadiene molecule
- 15:3615:36, 8 February 2013 diff hist +13 Rep:Mod:LBinfieldModule3 →Frequency Analysis and Thermochemistry
- 15:3515:35, 8 February 2013 diff hist +255 Rep:Mod:LBinfieldModule3 →Frequency Analysis and Thermochemistry
- 15:3215:32, 8 February 2013 diff hist +434 Rep:Mod:LBinfieldModule3 →Optimisation of the hexadiene molecule
- 14:5914:59, 8 February 2013 diff hist +397 Rep:Mod:LBinfieldModule3 No edit summary
- 14:4814:48, 8 February 2013 diff hist +290 Rep:Mod:LBinfieldModule3 →An investigation into the regioselectivity of the Diels- Alder Reaction
- 13:4613:46, 8 February 2013 diff hist +67 Rep:Mod:LBinfieldModule3 →Butadiene and Ethene
- 13:3813:38, 8 February 2013 diff hist +65 Rep:Mod:LBinfieldModule3 →Butadiene and Ethene
- 13:3513:35, 8 February 2013 diff hist 0 N File:DiealsaldeR irc standard lb.jpg No edit summary current
- 13:2513:25, 8 February 2013 diff hist +190 Rep:Mod:LBinfieldModule3 →HOMO and LUMO of the concerted transition state
- 13:2313:23, 8 February 2013 diff hist +94 Rep:Mod:LBinfieldModule3 →Total reaction energies
- 13:2213:22, 8 February 2013 diff hist +84 Rep:Mod:LBinfieldModule3 →Total reaction energies
- 13:1913:19, 8 February 2013 diff hist +404 Rep:Mod:LBinfieldModule3 →Total reaction energies
- 13:0513:05, 8 February 2013 diff hist +53 Rep:Mod:LBinfieldModule3 →Optimization of the 'boat' and 'chair' transition states
- 13:0413:04, 8 February 2013 diff hist 0 N File:Chair lb pic.png No edit summary current
- 13:0313:03, 8 February 2013 diff hist 0 N File:Boat pic lb.png No edit summary current
- 12:5512:55, 8 February 2013 diff hist +130 Rep:Mod:LBinfieldModule3 No edit summary
- 12:5312:53, 8 February 2013 diff hist 0 N File:Boat chair lb.png No edit summary current
- 12:5112:51, 8 February 2013 diff hist +233 Rep:Mod:LBinfieldModule3 →The Cope Rearrangement
- 12:4512:45, 8 February 2013 diff hist −49 Rep:Mod:LBinfieldModule3 →Total reaction energies
- 12:4312:43, 8 February 2013 diff hist −2 Rep:Mod:LBinfieldModule3 →An investigation into the regioselectivity of the Diels- Alder Reaction
- 12:4212:42, 8 February 2013 diff hist −2 Rep:Mod:LBinfieldModule3 →HOMO and LUMO of the concerted transition state
- 12:4212:42, 8 February 2013 diff hist +114 Rep:Mod:LBinfieldModule3 →Module 3: Physical Chemistry
- 12:3912:39, 8 February 2013 diff hist −55 Rep:Mod:LBinfieldModule3 →Optimisation of the possible lowest energy conformers of 1,5 hexadiene using a 631G* basis set
- 12:3812:38, 8 February 2013 diff hist +143 Rep:Mod:LBinfieldModule3 →Optimisation of the possible lowest energy conformers of 1,5 hexadiene using a 631G* basis set
- 12:2912:29, 8 February 2013 diff hist −17 Rep:Mod:LBinfieldModule3 →An investigation into the regioselectivity of the Diels- Alder Reaction
- 12:2812:28, 8 February 2013 diff hist +475 Rep:Mod:LBinfieldModule3 →An investigation into the regioselectivity of the Diels- Alder Reaction
- 12:2212:22, 8 February 2013 diff hist 0 N File:Dielsalder endoandexo homolumo.png No edit summary current
- 11:4211:42, 8 February 2013 diff hist 0 Rep:Mod:LBinfieldModule3 →Total reaction energies
- 11:4211:42, 8 February 2013 diff hist +3 Rep:Mod:LBinfieldModule3 →Total reaction energies
- 11:4211:42, 8 February 2013 diff hist +1 Rep:Mod:LBinfieldModule3 →Intrinsic Reaction Coordinate
- 10:4910:49, 8 February 2013 diff hist 0 Rep:Mod:LBinfieldModule3 →An investigation into the regioselectivity of the Diels- Alder Reaction
- 10:4210:42, 8 February 2013 diff hist +211 Rep:Mod:LBinfieldModule3 →Intrinsic Reaction Coordinate
- 10:3310:33, 8 February 2013 diff hist −2 Rep:Mod:LBinfieldModule3 →Intrinsic Reaction Coordinate
- 10:3310:33, 8 February 2013 diff hist −18 Rep:Mod:LBinfieldModule3 →Intrinsic Reaction Coordinate
- 10:2810:28, 8 February 2013 diff hist +337 Rep:Mod:LBinfieldModule3 No edit summary
- 10:2510:25, 8 February 2013 diff hist 0 N File:Boat irc opt lucy.jpg No edit summary current
- 10:2410:24, 8 February 2013 diff hist 0 N File:BOAT OPTANDFREQ LUCY IRC opt FRIDAY.mol No edit summary current
- 10:1810:18, 8 February 2013 diff hist −38 Rep:Mod:LBinfieldModule3 →Butadiene and Ethene
- 10:0510:05, 8 February 2013 diff hist +432 Rep:Mod:LBinfieldModule3 →Total reaction energies
- 09:5609:56, 8 February 2013 diff hist +23 Rep:Mod:LBinfieldModule3 →Intrinsic Reaction Coordinate
- 09:5009:50, 8 February 2013 diff hist +352 Rep:Mod:LBinfieldModule3 No edit summary
- 09:4509:45, 8 February 2013 diff hist +214 Rep:Mod:LBinfieldModule3 →Intrinsic Reaction Coordinate
- 09:3309:33, 8 February 2013 diff hist +513 Rep:Mod:LBinfieldModule3 No edit summary
- 09:1809:18, 8 February 2013 diff hist 0 N File:CHAIR IRC OPT LB2.LOG No edit summary current
- 09:1809:18, 8 February 2013 diff hist 0 N File:CHAIR IRC OPT LB2.mol No edit summary current
- 08:5708:57, 8 February 2013 diff hist 0 N File:Chair irc picture.png No edit summary current
- 08:3708:37, 8 February 2013 diff hist −7 Rep:Mod:LBinfieldModule3 →Optimisation of the possible lowest energy conformers of 1,5 hexadiene using a 631G basis set