User contributions for Aa15712
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14 November 2014
- 15:2415:24, 14 November 2014 diff hist 0 N File:NAS BH3 FREQ IR.PNG No edit summary current
- 15:2215:22, 14 November 2014 diff hist +325 Rep:Title=Mod:NAS13 No edit summary
- 14:5314:53, 14 November 2014 diff hist +309 Rep:Title=Mod:NAS13 →B3LYP/6-21G (dp) level
- 14:4814:48, 14 November 2014 diff hist 0 N File:NAS BH3 FREQ2 PIC.png No edit summary current
- 14:4714:47, 14 November 2014 diff hist 0 N File:NAS BH3 FREQ2.LOG No edit summary current
- 13:2613:26, 14 November 2014 diff hist 0 Rep:Title=Mod:NAS13 →EX3
- 13:2513:25, 14 November 2014 diff hist 0 Rep:Title=Mod:NAS13 →GaBr2
- 13:2513:25, 14 November 2014 diff hist 0 Rep:Title=Mod:NAS13 →B3LYP/6-31G(d,p)LANL2DZ BBr3 level
- 13:2413:24, 14 November 2014 diff hist +3 Rep:Title=Mod:NAS13 →B3LYP/6-31G(d,p)LANL2DZ BBr3 level
- 13:2313:23, 14 November 2014 diff hist +23 Rep:Title=Mod:NAS13 →B3LYP/6-31G(d,p)LANL2DZ BBr3 level
- 13:1213:12, 14 November 2014 diff hist +27 Rep:Title=Mod:NAS13 →B3LYP/GEN level
- 13:1113:11, 14 November 2014 diff hist +746 Rep:Title=Mod:NAS13 No edit summary
- 13:0713:07, 14 November 2014 diff hist 0 N File:NAS BBR3 OPT GEN RUN3.mol No edit summary current
- 13:0613:06, 14 November 2014 diff hist 0 N File:NAS BBR3 OPT GEN PIC.png No edit summary current
- 13:0213:02, 14 November 2014 diff hist 0 N File:NAS BBR3 OPT GEN RUN3.log No edit summary current
- 12:5712:57, 14 November 2014 diff hist +15 Rep:Title=Mod:NAS13 No edit summary
12 November 2014
- 16:5016:50, 12 November 2014 diff hist +23 Rep:Title=Mod:NAS13 No edit summary
- 16:4116:41, 12 November 2014 diff hist +15 Rep:Title=Mod:NAS13 →B3LYP/3-21G level
- 16:4016:40, 12 November 2014 diff hist +765 Rep:Title=Mod:NAS13 →BH3
- 16:3616:36, 12 November 2014 diff hist 0 N File:NAS GABR3 OPT LanL2DZ PP.mol No edit summary current
- 16:3516:35, 12 November 2014 diff hist 0 N File:NAS GABR3 OPT LanL2DZ PP PIC.png No edit summary current
- 16:3416:34, 12 November 2014 diff hist 0 N File:NAS GABR3 OPT LanL2DZ PP.log No edit summary current
- 16:0916:09, 12 November 2014 diff hist +9 Rep:Title=Mod:NAS13 →B3LYP/3-21G level
- 16:0416:04, 12 November 2014 diff hist +26 Rep:Title=Mod:NAS13 →B3LYP/6-21G (dp) level
- 16:0216:02, 12 November 2014 diff hist 0 N File:NAS BH3 OPT 631G DP.mol No edit summary current
- 16:0016:00, 12 November 2014 diff hist 0 N File:NAS BH3 631G DP PIC.PNG No edit summary current
- 15:5515:55, 12 November 2014 diff hist 0 N File:NAS BH3 OPT 631G DP.LOG No edit summary current
- 15:5515:55, 12 November 2014 diff hist +694 Rep:Title=Mod:NAS13 →BH3
- 15:5015:50, 12 November 2014 diff hist +152 Rep:Title=Mod:NAS13 →B3LYP/3-21G level
- 12:2912:29, 12 November 2014 diff hist 0 Rep:Title=Mod:NAS13 →B3LYP/3-21G level
- 12:2812:28, 12 November 2014 diff hist 0 Rep:Title=Mod:NAS13 →B3LYP/3-21G level
- 12:2512:25, 12 November 2014 diff hist −2 Rep:Title=Mod:NAS13 No edit summary
- 12:2212:22, 12 November 2014 diff hist 0 N File:NAS BH3 OPT1.mol No edit summary current
- 12:2012:20, 12 November 2014 diff hist 0 N File:NAS BH3 PIC.png No edit summary current
- 12:1912:19, 12 November 2014 diff hist 0 File:NAS BH3 OPT.LOG Aa15712 uploaded a new version of "File:NAS BH3 OPT.LOG" current
- 12:1812:18, 12 November 2014 diff hist +729 N Rep:Title=Mod:NAS13 Created page with "==EX<sub>3</sub>== ===BH<sub>3</sub>=== ====B3LYP/3-21G level==== Optimisation log file here {| class="wikitable" |+ ! summary data !! conve..."
11 November 2014
- 17:2717:27, 11 November 2014 diff hist 0 File:NAS BH3 summary table.PNG Aa15712 uploaded a new version of "File:NAS BH3 summary table.PNG" current
- 17:0217:02, 11 November 2014 diff hist +6 Rep:MOD:NAS13 →B3LYP/3-21G level
- 17:0117:01, 11 November 2014 diff hist −7 Rep:MOD:NAS13 →B3LYP/3-21G level
- 16:5716:57, 11 November 2014 diff hist +41 Rep:MOD:NAS13 →B3LYP/3-21G level
- 16:5516:55, 11 November 2014 diff hist 0 N File:NAS BH3 summary table.PNG No edit summary
- 16:4816:48, 11 November 2014 diff hist 0 Rep:MOD:NAS13 →B3LYP/3-21G level
- 16:4716:47, 11 November 2014 diff hist +2 Rep:MOD:NAS13 →BH3
- 16:4616:46, 11 November 2014 diff hist +5 Rep:MOD:NAS13 →B3LYP/3-21G level
- 16:4416:44, 11 November 2014 diff hist −5 Rep:MOD:NAS13 →B3LYP/3-21G level
- 16:4316:43, 11 November 2014 diff hist 0 Rep:MOD:NAS13 →B3LYP/3-21G level
- 16:3416:34, 11 November 2014 diff hist −2 Rep:MOD:NAS13 →BH3
- 16:3216:32, 11 November 2014 diff hist 0 Rep:MOD:NAS13 →B3LYP/3-21G level
- 16:3116:31, 11 November 2014 diff hist +506 N Rep:MOD:NAS13 Created page with "==EX<sub>3</sub>== ===BH<sub>3</sub>=== ====B3LYP/3-21G level==== BH<sub>3</sub> Optimisation log file here {| class="wikitable" |+ ! summary dat..."
- 16:2216:22, 11 November 2014 diff hist 0 N File:NAS BH3 OPT.LOG No edit summary