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User contributions for Mm5713

Results for Mm5713 talk block log uploads logs

A user with 475 edits. Account created on 20 October 2015.

18:0318:03, 23 January 2016 diff hist −1 Rep:MM5713TSAR →Optimization of the Boat Transition Structure by the QST2 Method
18:0218:02, 23 January 2016 diff hist −39 Rep:MM5713TSAR →Optimization of the Boat Transition Structure by the QST2 Method
17:5417:54, 23 January 2016 diff hist −30 Rep:MM5713TSAR →Optimization of the Chair Transition Structure by Employing the Frozen Coordinate Method
17:5217:52, 23 January 2016 diff hist −95 Rep:MM5713TSAR →Optimization of the Chair Transition Structure by Employing the Frozen Coordinate Method
17:4117:41, 23 January 2016 diff hist +764 Rep:MM5713TSAR →Optimizing the "Chair" and "Boat" Transition Structures
17:3517:35, 23 January 2016 diff hist 0 N File:Vibrational Calculation Chair TS Part d.PNG No edit summary current
17:2317:23, 23 January 2016 diff hist +152 Rep:MM5713TSAR →Optimizing the "Chair" and "Boat" Transition Structures
17:2317:23, 23 January 2016 diff hist 0 N File:Summary Optimization Chair TS Part d MM.PNG No edit summary current
17:1817:18, 23 January 2016 diff hist −669 Rep:MM5713TSAR →Optimization of the Chair Transition Structure by Employing the Frozen Coordinate Method
17:0917:09, 23 January 2016 diff hist +24 Rep:MM5713TSAR →Optimization of the Chair Transition Structure by Employing the Frozen Coordinate Method
17:0717:07, 23 January 2016 diff hist −11 Rep:MM5713TSAR →Optimization of the Chair Transition Structure by Employing the Frozen Coordinate Method
17:0517:05, 23 January 2016 diff hist −13 Rep:MM5713TSAR →Optimization of the Chair Transition Structure by Employing the Frozen Coordinate Method
17:0317:03, 23 January 2016 diff hist −2 Rep:MM5713TSAR →Optimization of the Chair Transition Structure by Employing the Frozen Coordinate Method
17:0217:02, 23 January 2016 diff hist +45 Rep:MM5713TSAR →Optimization of the Chair Transition Structure by Employing the Frozen Coordinate Method
16:5816:58, 23 January 2016 diff hist 0 File:Chair ts guess MM.mol Mm5713 uploaded a new version of File:Chair ts guess MM.mol current
16:5616:56, 23 January 2016 diff hist +465 Rep:MM5713TSAR →Optimizing the "Chair" and "Boat" Transition Structures
16:5516:55, 23 January 2016 diff hist 0 N File:CHAIR TS PART D MM.mol No edit summary current
16:5416:54, 23 January 2016 diff hist 0 N File:Chair ts guess MM.mol No edit summary
15:5715:57, 23 January 2016 diff hist 0 N File:CHAIR TS PART C MM.mol No edit summary current
15:4515:45, 23 January 2016 diff hist +1 Rep:MM5713TSAR →Optimization of the Chair Transition Structure by Computing the Hessian
15:3815:38, 23 January 2016 diff hist +692 Rep:MM5713TSAR →Optimizing the "Chair" and "Boat" Transition Structures
15:3415:34, 23 January 2016 diff hist 0 N File:Vibrational Calculation Chair TS Part b.PNG No edit summary current
15:3015:30, 23 January 2016 diff hist 0 N File:CHAIR TS PART B.mol No edit summary current
15:2815:28, 23 January 2016 diff hist 0 N File:Summary Optimization Chair TS Part b MM.PNG No edit summary current
15:1815:18, 23 January 2016 diff hist 0 N File:ALLYL OPTIMISATION HF321G.mol No edit summary current
15:1715:17, 23 January 2016 diff hist 0 N File:Summary Optimization Allyl Fragment MM.PNG No edit summary current
15:1315:13, 23 January 2016 diff hist +76 Rep:MM5713TSAR →Optimizing the "Chair" and "Boat" Transition Structures
15:0015:00, 23 January 2016 diff hist −1,658 Rep:MM5713TSAR →Frequency Calculation of the Anti2 Conformer at the B3LYP level of theory
14:5514:55, 23 January 2016 diff hist 0 N File:IR Spectrum Anti 2 Conformer MM.PNG No edit summary current
14:5514:55, 23 January 2016 diff hist 0 N File:NoNegativeFrequency Anti2 Conformer MM.PNG No edit summary current
14:4214:42, 23 January 2016 diff hist +1,004 Rep:MM5713TSAR →Optimizing the Reactants and Products
14:3214:32, 23 January 2016 diff hist 0 N File:AtomLabellingAnti2Conformer MM.PNG No edit summary current
14:2214:22, 23 January 2016 diff hist 0 N File:Hexadiene anti B3LYP 6-31G(d) MM.mol No edit summary
14:2114:21, 23 January 2016 diff hist 0 N File:Summary Anti Conformer B3LYP MM.PNG No edit summary current
14:1714:17, 23 January 2016 diff hist +100 Rep:MM5713TSAR →Anti2 Conformer Optimization at the B3LYP/6-31G* Level of Theory
14:1214:12, 23 January 2016 diff hist +192 Rep:MM5713TSAR →Anti2 Conformer of the 1,5-Hexadiene Molecule
14:0314:03, 23 January 2016 diff hist +293 Rep:MM5713TSAR →Optimizing the Reactants and Products
14:0214:02, 23 January 2016 diff hist 0 N File:Summary Anti Conformer HF3-21G MM 2.PNG No edit summary current
13:5913:59, 23 January 2016 diff hist 0 N File:Hexadiene anti MM.mol No edit summary current
13:5513:55, 23 January 2016 diff hist −269 Rep:MM5713TSAR →Optimization of the Lowest Energy Conformer of 1,5-Hexadiene
13:5313:53, 23 January 2016 diff hist +485 Rep:MM5713TSAR →Optimization of the Lowest Energy Conformer of 1,5-Hexadiene
13:3813:38, 23 January 2016 diff hist 0 N File:MO Gauche3 Conformer MM.PNG No edit summary current
13:2113:21, 23 January 2016 diff hist −158 Rep:MM5713TSAR →Optimization of the Lowest Energy Conformer of 1,5-Hexadiene
13:1313:13, 23 January 2016 diff hist 0 N File:Summary Gaucher Conformer HF3-21G MM.PNG No edit summary current
13:1113:11, 23 January 2016 diff hist 0 N File:HEXADIENE GAUCHE MM.mol No edit summary current
12:1812:18, 23 January 2016 diff hist +324 Rep:MM5713TSAR →Optimizing the Reactants and Products
12:1712:17, 23 January 2016 diff hist +442 Rep:MM5713TSAR →Optimization of the Lowest Energy Conformer of 1,5-Hexadiene
12:1112:11, 23 January 2016 diff hist +20 Rep:MM5713TSAR →Optimization of 1,5-Hexadiene with a Gauche Conformation of the Four Central C Atoms
12:0912:09, 23 January 2016 diff hist +106 Rep:MM5713TSAR →Optimizing the Reactants and Products
11:4611:46, 23 January 2016 diff hist −46 Rep:MM5713TSAR →Optimizing the Reactants and Products

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