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User contributions for Ab1810

Results for Ab1810 talk block log uploads logs

A user with 375 edits. Account created on 17 November 2012.

21:0721:07, 6 December 2012 diff hist +40 Rep:MOD:ACHUNTUN →Optimising Chair TS
21:0621:06, 6 December 2012 diff hist +26 Rep:MOD:ACHUNTUN →Optimising Chair TS
21:0621:06, 6 December 2012 diff hist 0 N File:CHAIR TS GUESS6-31GD.mol No edit summary current
21:0421:04, 6 December 2012 diff hist +73 Rep:MOD:ACHUNTUN →Optimising Chair TS
21:0121:01, 6 December 2012 diff hist +35 Rep:MOD:ACHUNTUN →Hartree=Fock
21:0021:00, 6 December 2012 diff hist +324 Rep:MOD:ACHUNTUN →Optimising Chair TS
20:5720:57, 6 December 2012 diff hist +29 Rep:MOD:ACHUNTUN →Activation Energy
20:5720:57, 6 December 2012 diff hist +282 Rep:MOD:ACHUNTUN →Intrinsic Reaction Coordinate(IRC)
19:5619:56, 6 December 2012 diff hist +35 Rep:MOD:ACHUNTUN →Intrinsic Reaction Coordinate(IRC)
19:5519:55, 6 December 2012 diff hist +56 Rep:MOD:ACHUNTUN →Intrinsic Reaction Coordinate(IRC)
19:5519:55, 6 December 2012 diff hist 0 N File:Irc path 100.PNG No edit summary current
19:5419:54, 6 December 2012 diff hist 0 N File:Irc100achuthan.gif No edit summary current
19:5319:53, 6 December 2012 diff hist +121 Rep:MOD:ACHUNTUN →Intrinsic Reaction Coordinate(IRC)
19:4319:43, 6 December 2012 diff hist +35 Rep:MOD:ACHUNTUN →Intrinsic Reaction Coordinate(IRC)
19:4119:41, 6 December 2012 diff hist +27 Rep:MOD:ACHUNTUN →Intrinsic Reaction Coordinate(IRC)
19:3919:39, 6 December 2012 diff hist 0 N File:Irc path 50.PNG No edit summary current
19:3819:38, 6 December 2012 diff hist +164 Rep:MOD:ACHUNTUN →Intrinsic Reaction Coordinate(IRC)
19:3819:38, 6 December 2012 diff hist 0 N File:Irc50achuthan.gif No edit summary current
19:3119:31, 6 December 2012 diff hist +597 Rep:MOD:ACHUNTUN →Intrinsic Reaction Coordinate
19:1519:15, 6 December 2012 diff hist +1 Rep:MOD:ACHUNTUN →Intrinsic Reaction Coordinate
19:1519:15, 6 December 2012 diff hist +36 Rep:MOD:ACHUNTUN →Boat Conformation
12:5212:52, 6 December 2012 diff hist +166 Rep:MOD:ACHUNTUN →Boat Conformation
12:5112:51, 6 December 2012 diff hist 0 File:Boat qst2.mol uploaded a new version of "File:Boat qst2.mol" current
12:5012:50, 6 December 2012 diff hist +75 Rep:MOD:ACHUNTUN →Boat Conformation
12:4912:49, 6 December 2012 diff hist +407 Rep:MOD:ACHUNTUN →Boat Conformation
12:4112:41, 6 December 2012 diff hist +25 Rep:MOD:ACHUNTUN →Chair Conformation
10:4210:42, 6 December 2012 diff hist +1,001 Rep:MOD:ACHUNTUN →Hartree=Fock
10:3910:39, 6 December 2012 diff hist 0 N File:Tsguessfrozenmethodpart2.mol No edit summary current

19:3319:33, 5 December 2012 diff hist +85 Rep:MOD:ACHUNTUN →Hartree=Fock
19:3119:31, 5 December 2012 diff hist +256 Rep:MOD:ACHUNTUN →Hartree=Fock
19:0819:08, 5 December 2012 diff hist +246 Rep:MOD:ACHUNTUN →Hartree=Fock
19:0719:07, 5 December 2012 diff hist 0 File:Chair ts guess.mol uploaded a new version of "File:Chair ts guess.mol"
19:0619:06, 5 December 2012 diff hist +427 Rep:MOD:ACHUNTUN →Chair Conformation
17:2717:27, 5 December 2012 diff hist +985 Rep:MOD:ACHUNTUN →Optimising the "Chair" and "Boat" Transition Structures

18:4218:42, 4 December 2012 diff hist +61 Rep:MOD:ACHUNTUN →Optimising Reactants and Products
17:5217:52, 4 December 2012 diff hist +316 Rep:MOD:ACHUNTUN →Frequency Analysis
17:3917:39, 4 December 2012 diff hist +285 Rep:MOD:ACHUNTUN →Frequency Analysis
17:3617:36, 4 December 2012 diff hist +117 Rep:MOD:ACHUNTUN →Anti Conformation (Ci symmetry)
17:1117:11, 4 December 2012 diff hist +76 Rep:MOD:ACHUNTUN →Optimisation by B3LYP/6-31G* (DFT) method
17:1017:10, 4 December 2012 diff hist +238 Rep:MOD:ACHUNTUN →Anti Conformation (Ci symmetry)
17:0817:08, 4 December 2012 diff hist 0 N File:Anti Ci conformer B3YLP6-31Gd.mol No edit summary current
17:0817:08, 4 December 2012 diff hist 0 N File:ANTI CI CONFORMER.mol No edit summary current
17:0717:07, 4 December 2012 diff hist −116 Rep:MOD:ACHUNTUN →References
17:0717:07, 4 December 2012 diff hist −67 Rep:MOD:ACHUNTUN →Optimisation by B3LYP/6-31G* (DFT) method
17:0217:02, 4 December 2012 diff hist +32 Rep:MOD:ACHUNTUN →Optimisation by B3LYP/6-31G* (DFT) method
17:0117:01, 4 December 2012 diff hist +87 Rep:MOD:ACHUNTUN →Optimisation by B3LYP/6-31G* (DFT) method
17:0117:01, 4 December 2012 diff hist +15 Rep:MOD:ACHUNTUN →Optimisation by B3LYP/6-31G* (DFT) method
17:0017:00, 4 December 2012 diff hist +155 Rep:MOD:ACHUNTUN →Optimisation by B3LYP/6-31G* (DFT) method
16:5616:56, 4 December 2012 diff hist +108 Rep:MOD:ACHUNTUN →Anti Conformation (Ci symmetry)
16:2216:22, 4 December 2012 diff hist +10 Rep:MOD:ACHUNTUN →Anti Conformation (Ci symmetry)

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