User contributions for Js8712
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8 December 2014
- 18:0618:06, 8 December 2014 diff hist +9 User:Js8712 →B3LYP/GEN
- 18:0418:04, 8 December 2014 diff hist −16 User:Js8712 →B3LYP/GEN
- 18:0318:03, 8 December 2014 diff hist 0 N File:JEROEN BBr3 OPT1 OUTPUT.mol No edit summary current
- 18:0118:01, 8 December 2014 diff hist −3 User:Js8712 →B3LYP/GEN
- 18:0118:01, 8 December 2014 diff hist −15 User:Js8712 →B3LYP/GEN
- 17:5917:59, 8 December 2014 diff hist 0 N File:JEROEN BBr3 OPT1 OUTPUT SUMMARY.PNG No edit summary current
- 17:5917:59, 8 December 2014 diff hist −8 User:Js8712 →B3LYP/3-21G level
- 17:5817:58, 8 December 2014 diff hist −4 User:Js8712 →B3LYP/3-21G level
- 17:5717:57, 8 December 2014 diff hist +771 User:Js8712 No edit summary
- 17:0517:05, 8 December 2014 diff hist 0 User:Js8712 →Geometry Specifications - Distances/Bond Angles
- 16:5416:54, 8 December 2014 diff hist +4 User:Js8712 →Geometry Specifications - Distances/Bond Angles
- 16:5316:53, 8 December 2014 diff hist +3 User:Js8712 →Geometry Specifications - Distances/Bond Angles
- 16:5116:51, 8 December 2014 diff hist +29 User:Js8712 →B3LYP/3-21G level
- 16:5116:51, 8 December 2014 diff hist 0 N File:JEROEN GaBr3 pp optimisation outputfile.mol No edit summary current
- 16:5016:50, 8 December 2014 diff hist +29 User:Js8712 No edit summary
- 16:4416:44, 8 December 2014 diff hist 0 N File:JEROEN GaBr3 pp optimisation outputfileSUMMARY.PNG No edit summary current
- 16:3116:31, 8 December 2014 diff hist +8 User:Js8712 No edit summary
- 16:2916:29, 8 December 2014 diff hist +710 User:Js8712 No edit summary
- 15:4115:41, 8 December 2014 diff hist +6 User:Js8712 No edit summary
- 15:3915:39, 8 December 2014 diff hist +252 User:Js8712 No edit summary
- 15:2915:29, 8 December 2014 diff hist +23 User:Js8712 →B3LYP/6-31G(d,p) level
- 15:2815:28, 8 December 2014 diff hist +1 User:Js8712 No edit summary
- 15:2715:27, 8 December 2014 diff hist +16 User:Js8712 No edit summary
- 15:2615:26, 8 December 2014 diff hist 0 N File:JEROEN BH3 OPT 631G(d,p)SUMMARY.PNG No edit summary current
- 15:1815:18, 8 December 2014 diff hist +8 User:Js8712 No edit summary
- 15:1715:17, 8 December 2014 diff hist 0 N File:JEROEN BH3 OPT 631G DP.LOG No edit summary current
- 15:1715:17, 8 December 2014 diff hist 0 N File:JS BH3 OPT 631G DP.LOG No edit summary
- 15:1515:15, 8 December 2014 diff hist +12 User:Js8712 →B3LYP/6-31G(d,p) level
- 15:1415:14, 8 December 2014 diff hist 0 N File:Jeroen BH3 OPT 631g dp.mol No edit summary current
- 15:0915:09, 8 December 2014 diff hist +685 User:Js8712 →B3LYP/3-21G level
- 14:4214:42, 8 December 2014 diff hist +18 User:Js8712 No edit summary
- 14:4014:40, 8 December 2014 diff hist 0 N File:Jeroen BH3 OPT.LOG No edit summary current
- 14:3814:38, 8 December 2014 diff hist −14 User:Js8712 No edit summary
- 14:3514:35, 8 December 2014 diff hist −1 User:Js8712 No edit summary
- 14:3414:34, 8 December 2014 diff hist 0 File:JS BH3 OPT.LOG Js8712 uploaded a new version of "File:JS BH3 OPT.LOG"
- 14:3314:33, 8 December 2014 diff hist +1 User:Js8712 No edit summary
- 14:2914:29, 8 December 2014 diff hist 0 File:JS BH3 OPT.LOG Js8712 uploaded a new version of "File:JS BH3 OPT.LOG"
- 14:2714:27, 8 December 2014 diff hist −8 User:Js8712 →BH3
- 14:1114:11, 8 December 2014 diff hist 0 File:JS BH3 OPT.LOG Js8712 uploaded a new version of "File:JS BH3 OPT.LOG"
- 14:1114:11, 8 December 2014 diff hist 0 File:JS BH3 OPT.LOG Js8712 uploaded a new version of "File:JS BH3 OPT.LOG"
- 14:0714:07, 8 December 2014 diff hist +14 User:Js8712 No edit summary
- 14:0414:04, 8 December 2014 diff hist +1 User:Js8712 No edit summary
- 14:0214:02, 8 December 2014 diff hist 0 N File:JS BH3 OPTImage.PNG No edit summary current
- 13:4513:45, 8 December 2014 diff hist 0 N File:JS BH3 opt Summaryimage.jpg No edit summary current
- 13:3813:38, 8 December 2014 diff hist +7 User:Js8712 No edit summary
- 13:2213:22, 8 December 2014 diff hist +25 User:Js8712 →B3LYP/3-21G level
- 13:1713:17, 8 December 2014 diff hist +14 User:Js8712 No edit summary
- 13:1513:15, 8 December 2014 diff hist 0 File:JS BH3 OPT.mol Js8712 uploaded a new version of "File:JS BH3 OPT.mol" current
- 13:1413:14, 8 December 2014 diff hist 0 N File:JS BH3 OPT.mol No edit summary
- 13:1113:11, 8 December 2014 diff hist +641 N User:Js8712 Created page with "===BH<sub>3</sub>=== ====B3LYP/3-21G level==== Optimisation log file [[Media:| here]] {| class="wikitable" |+ ! summary data !! convergence || Jmol |- |File:ART_BH3_OPT..."