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User contributions for Jrc10

Results for Jrc10 talk block log uploads logs

A user with 812 edits. Account created on 7 October 2010.

17:5417:54, 3 February 2013 diff hist +5 Rep:Mod:theoreticalreality →Table of comparison
17:5417:54, 3 February 2013 diff hist +2 Rep:Mod:theoreticalreality →Table of comparison
17:5317:53, 3 February 2013 diff hist −8 Rep:Mod:theoreticalreality →Table of comparison
17:5217:52, 3 February 2013 diff hist +4 Rep:Mod:theoreticalreality →Table of comparison
17:4817:48, 3 February 2013 diff hist 0 Rep:Mod:theoreticalreality →Table of comparison
17:4317:43, 3 February 2013 diff hist +3 Rep:Mod:theoreticalreality →Chair Optimization
17:2817:28, 3 February 2013 diff hist 0 Rep:Mod:theoreticalreality →Table of comparison
17:2717:27, 3 February 2013 diff hist 0 Rep:Mod:theoreticalreality →Table of comparison
17:1917:19, 3 February 2013 diff hist 0 Rep:Mod:theoreticalreality →Table of comparison
17:1617:16, 3 February 2013 diff hist 0 Rep:Mod:theoreticalreality →Table of comparison
17:0717:07, 3 February 2013 diff hist +96 Rep:Mod:theoreticalreality →Table of comparison
17:0417:04, 3 February 2013 diff hist +1,549 Rep:Mod:theoreticalreality →Boat Optimization
16:5616:56, 3 February 2013 diff hist +6 Rep:Mod:theoreticalreality →Boat Optimization
16:5516:55, 3 February 2013 diff hist −5 Rep:Mod:theoreticalreality →Boat Optimization
16:5416:54, 3 February 2013 diff hist +20 Rep:Mod:theoreticalreality →Boat Optimization
16:5416:54, 3 February 2013 diff hist +51 N File:CRON BOAT TS 631G D.LOG .log file of boat optimization with 6-31G basis set current
16:4116:41, 3 February 2013 diff hist +379 Rep:Mod:theoreticalreality →Boat Optimization
15:3115:31, 3 February 2013 diff hist +1,946 Rep:Mod:theoreticalreality →Optimization of the molecule

16:4916:49, 1 February 2013 diff hist +228 Rep:Mod:theoreticalreality →Optimization of the molecule
16:4416:44, 1 February 2013 diff hist +860 Rep:Mod:theoreticalreality →Optimization of the molecule
16:3216:32, 1 February 2013 diff hist +619 Rep:Mod:theoreticalreality →Chair IRC
16:1916:19, 1 February 2013 diff hist +510 Rep:Mod:theoreticalreality →Chair IRC
16:1016:10, 1 February 2013 diff hist 0 Rep:Mod:theoreticalreality →Chair IRC
16:1016:10, 1 February 2013 diff hist +29 N File:CRON Chair IRC grad.jpg IRC of chair to 1,5-hexadiene current
16:1016:10, 1 February 2013 diff hist +29 N File:CRON Chair IRC energy.jpg IRC of chair to 1,5-hexadiene current
16:0116:01, 1 February 2013 diff hist 0 File:CRON Chair IRC grad.svg uploaded a new version of "File:CRON Chair IRC grad.svg" current
16:0016:00, 1 February 2013 diff hist 0 File:CRON Chair IRC energy.svg uploaded a new version of "File:CRON Chair IRC energy.svg" current
15:5915:59, 1 February 2013 diff hist −2 Rep:Mod:theoreticalreality →Chair IRC
15:5715:57, 1 February 2013 diff hist +86 Rep:Mod:theoreticalreality →Chair IRC
15:5615:56, 1 February 2013 diff hist +18 N File:CRON Chair IRC grad.svg IRC graph of Chair
15:5615:56, 1 February 2013 diff hist +18 N File:CRON Chair IRC energy.svg IRC graph of Chair
15:5315:53, 1 February 2013 diff hist +1,015 Rep:Mod:theoreticalreality →Chair IRC
15:4415:44, 1 February 2013 diff hist +466 Rep:Mod:theoreticalreality →Comparison of Boat and Chair conformers

16:3816:38, 31 January 2013 diff hist −2 Rep:Mod:theoreticalreality →Comparison of Boat and Chair conformers
16:3616:36, 31 January 2013 diff hist +199 Rep:Mod:theoreticalreality →Comparison of Boat and Chair conformers
16:2316:23, 31 January 2013 diff hist +492 Rep:Mod:theoreticalreality →Comparison of Boat and Chair conformers
15:1315:13, 31 January 2013 diff hist +165 Mod:phys3 →Optimizing the "Chair" and "Boat" Transition Structures
15:1015:10, 31 January 2013 diff hist +42 Rep:Mod:theoreticalreality →Comparison of Boat and Chair conformers
15:0115:01, 31 January 2013 diff hist +738 Rep:Mod:theoreticalreality →A second QST2 calculation
14:5014:50, 31 January 2013 diff hist 0 Rep:Mod:theoreticalreality →A second QST2 calculation
14:4914:49, 31 January 2013 diff hist +51 N File:CRON Boat QST2 2.gif GIF of boat transition state in cope rearrangement. current
14:4614:46, 31 January 2013 diff hist +267 Rep:Mod:theoreticalreality →A second QST2 calculation
14:4114:41, 31 January 2013 diff hist +1,329 Rep:Mod:theoreticalreality →Optimization of a Boat
14:2914:29, 31 January 2013 diff hist −1 Rep:Mod:theoreticalreality →The QST2 method
14:2814:28, 31 January 2013 diff hist −1 Rep:Mod:theoreticalreality →A second QST2 calculation
14:2814:28, 31 January 2013 diff hist 0 File:CRON Boat QST2 2.mol uploaded a new version of "File:CRON Boat QST2 2.mol" current
14:2714:27, 31 January 2013 diff hist 0 File:CRON Boat QST2 1.mol uploaded a new version of "File:CRON Boat QST2 1.mol" current
14:2414:24, 31 January 2013 diff hist 0 File:CRON Boat QST2 1.mol uploaded a new version of "File:CRON Boat QST2 1.mol"
14:2214:22, 31 January 2013 diff hist +38 N File:CRON Boat QST2 2.mol Jmol of QST2 transition method results
14:2214:22, 31 January 2013 diff hist +38 N File:CRON Boat QST2 1.mol Jmol of QST2 transition method results

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