User contributions for Jrc10
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20 January 2013
- 16:3616:36, 20 January 2013 diff hist +1 Rep:Mod:quantumblock →BH3 Optimization Calculation
- 16:3516:35, 20 January 2013 diff hist +1 Rep:Mod:quantumblock →Using a better basis set on BH3
- 16:3516:35, 20 January 2013 diff hist +1 Rep:Mod:quantumblock →Thallium Tribromide
- 16:3416:34, 20 January 2013 diff hist +2 Rep:Mod:quantumblock →Boron Tribromide
- 16:3416:34, 20 January 2013 diff hist +1 Rep:Mod:quantumblock →Boron Tribromide
- 16:3416:34, 20 January 2013 diff hist +1 Rep:Mod:quantumblock →Thallium Tribromide
- 16:3316:33, 20 January 2013 diff hist +3 Rep:Mod:quantumblock →Using a better basis set on BH3
- 16:3216:32, 20 January 2013 diff hist +3 Rep:Mod:quantumblock →BH3 Optimization Calculation
- 16:3116:31, 20 January 2013 diff hist −8 Rep:Mod:quantumblock →Molecular Orbital Analysis of BH3
- 16:3016:30, 20 January 2013 diff hist −60 Rep:Mod:quantumblock →Comparison of BH3 and TlBr3
- 16:2916:29, 20 January 2013 diff hist −47 Rep:Mod:quantumblock →Summary Table of Frequency Animations and Description
- 16:2816:28, 20 January 2013 diff hist +3 Rep:Mod:quantumblock →Calculation data
- 16:2716:27, 20 January 2013 diff hist −14 Rep:Mod:quantumblock →Calculation data
- 16:2616:26, 20 January 2013 diff hist −8 Rep:Mod:quantumblock →Summary Table of Frequency Animations and Description
- 16:2616:26, 20 January 2013 diff hist −39 Rep:Mod:quantumblock →Summary Table of Frequency Animations and Description
- 16:2516:25, 20 January 2013 diff hist −14 Rep:Mod:quantumblock →Calcuation data
- 16:2416:24, 20 January 2013 diff hist −9 Rep:Mod:quantumblock →Analysis of results
- 16:2316:23, 20 January 2013 diff hist −14 Rep:Mod:quantumblock →Boron Tribromide
- 16:2316:23, 20 January 2013 diff hist −14 Rep:Mod:quantumblock →Thallium Tribromide
- 16:2216:22, 20 January 2013 diff hist −13 Rep:Mod:quantumblock →Using a better basis set on BH3
- 16:2116:21, 20 January 2013 diff hist −12 Rep:Mod:quantumblock →BH3 Optimization Calculation
- 16:1316:13, 20 January 2013 diff hist +153 Rep:Mod:quantumblock →Energy calculations
- 16:1116:11, 20 January 2013 diff hist +56 Rep:Mod:quantumblock →Energy calculations
- 16:1016:10, 20 January 2013 diff hist +298 Rep:Mod:quantumblock →Energy calculations
- 16:0316:03, 20 January 2013 diff hist 0 Rep:Mod:quantumblock →Molecular Orbital Calculations
- 16:0316:03, 20 January 2013 diff hist 0 Rep:Mod:quantumblock →Frequency Analysis
- 16:0316:03, 20 January 2013 diff hist 0 Rep:Mod:quantumblock →Optimization Calculation
- 16:0216:02, 20 January 2013 diff hist 0 File:CRON NH3 OPTIMIZATION 631G DP.LOG uploaded a new version of "File:CRON NH3 OPTIMIZATION 631G DP.LOG": .log file for optimization of NH3 current
- 15:5715:57, 20 January 2013 diff hist +1 Rep:Mod:quantumblock →Energy calculations
- 15:3815:38, 20 January 2013 diff hist +528 Rep:Mod:quantumblock →Energy calculations
- 15:2615:26, 20 January 2013 diff hist +1 Rep:Mod:quantumblock →Energy calculations
- 15:2515:25, 20 January 2013 diff hist −4 Rep:Mod:quantumblock →Energy calculations
- 15:2515:25, 20 January 2013 diff hist +6 Rep:Mod:quantumblock →Optimization calculation
- 15:2415:24, 20 January 2013 diff hist +383 Rep:Mod:quantumblock →Frequency calculation
- 15:1915:19, 20 January 2013 diff hist +115 Rep:Mod:quantumblock →Frequency calculation
- 15:1415:14, 20 January 2013 diff hist +14 Rep:Mod:quantumblock →Frequency calculation
- 15:0815:08, 20 January 2013 diff hist +634 Rep:Mod:quantumblock →Frequency calculation
- 14:5814:58, 20 January 2013 diff hist +11 Rep:Mod:quantumblock →Frequency calculation
- 14:5714:57, 20 January 2013 diff hist +48 N File:CRON NH3BH3 FREQUENCY 631G DP.LOG .log file for ammonium borane frequency analysis current
- 14:5614:56, 20 January 2013 diff hist 0 Rep:Mod:quantumblock →Optimization calculation
- 14:5514:55, 20 January 2013 diff hist +6 Rep:Mod:quantumblock →Frequency calculation
- 14:5414:54, 20 January 2013 diff hist +6 Rep:Mod:quantumblock →Optimization calculation
- 14:5314:53, 20 January 2013 diff hist −44 Rep:Mod:quantumblock →Frequency calculation
- 14:4614:46, 20 January 2013 diff hist +1,216 Rep:Mod:quantumblock →Frequency calculation
- 14:4414:44, 20 January 2013 diff hist +33 Rep:Mod:quantumblock →Optimization calculation
- 14:4114:41, 20 January 2013 diff hist +11 Rep:Mod:quantumblock →Optimization calculation
- 14:4114:41, 20 January 2013 diff hist +39 N File:CRON NH3BH3 optimization.mol Jmol file for ammonium borane optimized current
- 14:3914:39, 20 January 2013 diff hist 0 Rep:Mod:quantumblock →Optimization Calculation
- 14:3914:39, 20 January 2013 diff hist +468 Rep:Mod:quantumblock →Optimization Calculation
- 14:3614:36, 20 January 2013 diff hist −3 Rep:Mod:quantumblock →Optimization= Calculation