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User contributions for Pl1208

Results for Pl1208 talk block log uploads logs

A user with 1,380 edits. Account created on 15 February 2009.

18:5318:53, 18 March 2011 diff hist +1,077 Rep:Sunkiss pl1208 3 →Process for IRC calculations
18:3418:34, 18 March 2011 diff hist 0 N File:Gradient pl1208.JPG No edit summary current
18:3418:34, 18 March 2011 diff hist 0 N File:Total energy n=200 pl1208.JPG No edit summary current
18:3218:32, 18 March 2011 diff hist 0 N File:SUMMARY pl1208 dsgf.JPG No edit summary current
18:3218:32, 18 March 2011 diff hist 0 N File:100 OF 100.JPG No edit summary current
18:3218:32, 18 March 2011 diff hist 0 N File:1 OF 100.JPG No edit summary current
18:3118:31, 18 March 2011 diff hist 0 N File:Checkpoint n=200 pl1208.fchk No edit summary current
17:2017:20, 18 March 2011 diff hist +810 Rep:Sunkiss pl1208 3 →Process for IRC calculations
17:1817:18, 18 March 2011 diff hist 0 N File:Reference APPENDIX2.JPG No edit summary current
17:1817:18, 18 March 2011 diff hist 0 N File:Log 41600.out No edit summary current
17:1717:17, 18 March 2011 diff hist 0 N File:Checkpoint 41600.fchk No edit summary current
17:0717:07, 18 March 2011 diff hist +320 Rep:Sunkiss pl1208 3 →Process for IRC calculations
17:0017:00, 18 March 2011 diff hist +1,764 Rep:Sunkiss pl1208 3 →Process for IRC calculations
17:0017:00, 18 March 2011 diff hist 0 N File:Total energy pl1208 edfw.JPG No edit summary current
16:5316:53, 18 March 2011 diff hist 0 N File:SummaryLASTOPT PL1208.JPG No edit summary current
16:5316:53, 18 March 2011 diff hist 0 N File:Log 41600 pl1208.txt No edit summary current
16:4716:47, 18 March 2011 diff hist 0 N File:Checkpoint 41651.fchk No edit summary current
16:4616:46, 18 March 2011 diff hist 0 N File:Log 41651.out No edit summary current
16:1716:17, 18 March 2011 diff hist +3,017 Rep:Sunkiss pl1208 3 →Comparison of Structures attained via Both Methods
16:0416:04, 18 March 2011 diff hist 0 N File:Rms gradientN=25.JPG No edit summary current
16:0416:04, 18 March 2011 diff hist 0 N File:Total energyN=25.JPG No edit summary current
16:0316:03, 18 March 2011 diff hist 0 N File:SummaryN=25.JPG No edit summary current
16:0316:03, 18 March 2011 diff hist 0 N File:FinalN=25.JPG No edit summary current
16:0216:02, 18 March 2011 diff hist 0 N File:First n=25.JPG No edit summary current
13:4013:40, 18 March 2011 diff hist +63 Rep:Sunkiss pl1208 3 →Comparison of Structures attained via Both Methods
02:3602:36, 18 March 2011 diff hist +1 Rep:Sunkiss pl1208 3 →Analysis of Results Via the frozen coordinate Implementation
02:3602:36, 18 March 2011 diff hist 0 N File:Pre distance pl1208 2.JPG No edit summary current
02:2102:21, 18 March 2011 diff hist +739 Rep:Sunkiss pl1208 3 →Comparison of Structures attained via Both Methods
02:1602:16, 18 March 2011 diff hist +9 Rep:Sunkiss pl1208 3 →Comparison of Structures attained via Both Methods
02:1502:15, 18 March 2011 diff hist +986 Rep:Sunkiss pl1208 3 →Analysis of Results Via the frozen coordinate Implementation
02:1202:12, 18 March 2011 diff hist +805 Rep:Sunkiss pl1208 3 →Analysis of Results Via the frozen coordinate Implementation
02:1102:11, 18 March 2011 diff hist 0 Rep:Sunkiss pl1208 3 →Analysis of Results Via the frozen coordinate Implementation
02:1102:11, 18 March 2011 diff hist +20 Rep:Sunkiss pl1208 3 →Method 2 : Attaining the Chair Transition state via the Frozen coordinate Method
02:0802:08, 18 March 2011 diff hist +2,921 Rep:Sunkiss pl1208 3 →Method 1 : Attaining the Chair Transition state via the Force Constant Matrix (Hessian)
02:0702:07, 18 March 2011 diff hist 0 N File:Log 41599 pl1208.txt No edit summary current
02:0502:05, 18 March 2011 diff hist 0 N File:Log 41599 pl1208.odt No edit summary current
02:0302:03, 18 March 2011 diff hist 0 N File:Summary pl1208 frozen.JPG No edit summary current
02:0102:01, 18 March 2011 diff hist 0 N File:Pre distance pl1208.JPG No edit summary current
01:5901:59, 18 March 2011 diff hist 0 N File:Post distance pl1208.JPG No edit summary current
01:3001:30, 18 March 2011 diff hist +914 Rep:Sunkiss pl1208 3 →Analysis of Results Via the Hessian Implementation
01:2201:22, 18 March 2011 diff hist 0 Rep:Sunkiss pl1208 3 →Analysis of Results Via the Hessian Implementation
01:2201:22, 18 March 2011 diff hist −56 Rep:Sunkiss pl1208 3 →Analysis of Results Via the Hessian Implementation
01:2201:22, 18 March 2011 diff hist 0 N File:Log 41598 pl1208.txt No edit summary current
01:2001:20, 18 March 2011 diff hist 0 N File:Log 41598 2.txt No edit summary current
01:1601:16, 18 March 2011 diff hist +1,758 Rep:Sunkiss pl1208 3 →Process Under taken towards Hessian Implementation
01:1401:14, 18 March 2011 diff hist 0 N File:Log 41598 pl1208.out No edit summary current
01:0801:08, 18 March 2011 diff hist 0 N File:Summary pl1208 berney.JPG No edit summary current
00:5500:55, 18 March 2011 diff hist +531 Rep:Sunkiss pl1208 3 →Process Under taken towards Hessian Implementation
00:5400:54, 18 March 2011 diff hist 0 N File:Schematic pl1208.bmp No edit summary current
00:4700:47, 18 March 2011 diff hist 0 N File:Arranged allyl pl1208.mol No edit summary current

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