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User contributions for Ps108

Results for Ps108 talk block log uploads logs

A user with 505 edits. Account created on 18 January 2011.

15:1915:19, 16 February 2011 diff hist +6 Rep:Mod:Pphys89 →The Diels Alder Transition State
14:3814:38, 16 February 2011 diff hist +204 Rep:Mod:Pphys89 →Regioselectivity in the reaction between Maleic Anhydride and cyclohexa-1,3-diene
14:3514:35, 16 February 2011 diff hist +589 Rep:Mod:Pphys89 →Study into the Diels-Alder Cycloaddition
14:3514:35, 16 February 2011 diff hist 0 N File:Maleic anhydride rn.png No edit summary current
14:1914:19, 16 February 2011 diff hist +1,282 Rep:Mod:Pphys89 →The Diels Alder Transition State
14:0314:03, 16 February 2011 diff hist +812 Rep:Mod:Pphys89 →The Diels Alder Transition State
14:0214:02, 16 February 2011 diff hist 0 N File:Diels Alder LUMO.png No edit summary current
14:0114:01, 16 February 2011 diff hist 0 N File:Diels Alder HOMO.png No edit summary current
13:0513:05, 16 February 2011 diff hist +924 Rep:Mod:Pphys89 →Extrapolation from the reactant and product's structures Using the QST2 Method
12:5012:50, 16 February 2011 diff hist 0 Rep:Mod:Pphys89 →Extrapolation from the reactant and product's structures Using the QST2 Method
12:5012:50, 16 February 2011 diff hist 0 Rep:Mod:Pphys89 →Extrapolation from the reactant and product's structures Using the QST2 Method
12:4912:49, 16 February 2011 diff hist +69 Rep:Mod:Pphys89 →Extrapolation from the reactant and product's structures Using the QST2 Method
12:4912:49, 16 February 2011 diff hist 0 N File:Boat qst bondforming vibration.png No edit summary current
12:4512:45, 16 February 2011 diff hist 0 N File:Boat qst summary.png No edit summary current
12:4112:41, 16 February 2011 diff hist +3 Rep:Mod:Pphys89 →Extrapolation from the reactant and product's structures Using the QST2 Method
12:4012:40, 16 February 2011 diff hist 0 N File:Boat TS 2.mol2 No edit summary current
12:2312:23, 16 February 2011 diff hist −1 Rep:Mod:Pphys89 →Extrapolation from the reactant and product's structures Using the QST2 Method
12:2212:22, 16 February 2011 diff hist +8 Rep:Mod:Pphys89 →Extrapolation from the reactant and product's structures Using the QST2 Method
12:2112:21, 16 February 2011 diff hist 0 Rep:Mod:Pphys89 →Extrapolation from the reactant and product's structures Using the QST2 Method
12:2012:20, 16 February 2011 diff hist +189 Rep:Mod:Pphys89 →Module 3: Computational Techniques in Physical Chemistry
12:1112:11, 16 February 2011 diff hist +705 Rep:Mod:Pphys89 →Activation energies
11:5611:56, 16 February 2011 diff hist +254 Rep:Mod:Pphys89 →Extrapolation from the reactant and product's structures Using the QST2 Method
11:4411:44, 16 February 2011 diff hist +257 Rep:Mod:Pphys89 →The IRC Analysis
11:3011:30, 16 February 2011 diff hist 0 Rep:Mod:Pphys89 →The IRC Analysis
11:2911:29, 16 February 2011 diff hist +433 Rep:Mod:Pphys89 →Optimisation of the reactants/products
11:2311:23, 16 February 2011 diff hist +487 Rep:Mod:Pphys89 →The IRC Analysis
10:5810:58, 16 February 2011 diff hist +740 Rep:Mod:Pphys89 →IRC methods
10:5810:58, 16 February 2011 diff hist 0 N File:Boat TS IRC summary.png No edit summary current
10:5810:58, 16 February 2011 diff hist 0 N File:Boat TS RMS-IRC.png No edit summary current
10:5710:57, 16 February 2011 diff hist 0 N File:Boat TS energy-IRC.png No edit summary current
10:5610:56, 16 February 2011 diff hist 0 N File:Chair TS IRC summary.png No edit summary current
10:4610:46, 16 February 2011 diff hist 0 N File:Chair TS RMS gradient-IRC.png No edit summary current
10:4510:45, 16 February 2011 diff hist 0 N File:Chair TS energy-IRC.png No edit summary current

22:4722:47, 14 February 2011 diff hist +46 Rep:Mod:Pphys89 →Investigating the Methods Used in Transition State optimisation
22:4622:46, 14 February 2011 diff hist +975 Rep:Mod:Pphys89 →Frequency Analysis
22:3422:34, 14 February 2011 diff hist −117 Rep:Mod:Pphys89 No edit summary
22:1422:14, 14 February 2011 diff hist +100 Rep:Mod:Pphys89 →Extrapolation from the reactant and product's structures Using the QST2 Method
21:5921:59, 14 February 2011 diff hist +326 Rep:Mod:Pphys89 →Extrapolation from the reactant and product's structures Using the QST2 Method
14:2114:21, 14 February 2011 diff hist +842 Rep:Mod:Pphys89 →Orbital Control in the Diels-Alder reaction
12:2212:22, 14 February 2011 diff hist +1,340 Rep:Mod:Pphys89 →Extrapolation from the reactant and product's structures

18:4018:40, 13 February 2011 diff hist +406 Rep:Mod:Pphys89 →Frequency Analysis
18:2818:28, 13 February 2011 diff hist 0 Rep:Mod:Pphys89 →Frequency Analysis
18:1718:17, 13 February 2011 diff hist +223 Rep:Mod:Pphys89 →Frequency Analysis
17:5817:58, 13 February 2011 diff hist 0 N File:Chair TS summary.png No edit summary current
17:5217:52, 13 February 2011 diff hist +535 Rep:Mod:Pphys89 →Investigating the Methods Used in Transition State optimisation
16:4416:44, 13 February 2011 diff hist +649 Rep:Mod:Pphys89 →Optimisation of the reactants/products
15:5715:57, 13 February 2011 diff hist +1 Rep:Mod:Pphys89 →Investigating the Methods Used in Transition State optimisation
15:5515:55, 13 February 2011 diff hist +755 Rep:Mod:Pphys89 →Investigating the Methods Used in Transition State optimisation
15:4815:48, 13 February 2011 diff hist 0 N File:Boat-Chair TS.png No edit summary current
15:3515:35, 13 February 2011 diff hist +72 Rep:Mod:Pphys89 →Orbital Control in the Diels-Alder reaction

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