User contributions for Jrc10

22 January 2013

• 22:0822:08, 22 January 2013 diff hist +18 N File:CRON Benzene mo copy.pdf Benzene MO diagram current
• 17:0517:05, 22 January 2013 diff hist +1 Rep:Mod:quantumblock →Optimization=
• 17:0417:04, 22 January 2013 diff hist +9 Rep:Mod:quantumblock →Optimization
• 17:0317:03, 22 January 2013 diff hist +15 N File:CRON Benzene optimization 631G dp.mol Jmol of benzene current
• 16:3916:39, 22 January 2013 diff hist −5 Rep:Mod:quantumblock →Optimization
• 16:3916:39, 22 January 2013 diff hist +196 Rep:Mod:quantumblock →Optimization
• 16:3816:38, 22 January 2013 diff hist +130 Rep:Mod:quantumblock →Benzene
• 16:2716:27, 22 January 2013 diff hist −13 Rep:Mod:quantumblock →NBO analysis
• 16:2116:21, 22 January 2013 diff hist +847 Rep:Mod:quantumblock →NBO analysis
• 16:0916:09, 22 January 2013 diff hist +527 Rep:Mod:quantumblock →NBO analysis
• 15:2815:28, 22 January 2013 diff hist +1 Rep:Mod:quantumblock →NBO analysis
• 15:2815:28, 22 January 2013 diff hist +51 Rep:Mod:quantumblock →NBO analysis
• 15:2715:27, 22 January 2013 diff hist +34 N File:CRON Benzene charge distribution.jpg The charge distribution on Benzene current
• 15:2615:26, 22 January 2013 diff hist +37 Rep:Mod:quantumblock →NBO analysis
• 15:2215:22, 22 January 2013 diff hist +30 Rep:Mod:quantumblock →NBO Analysis
• 15:2015:20, 22 January 2013 diff hist +261 Rep:Mod:quantumblock →NBO analysis
• 15:1215:12, 22 January 2013 diff hist −2 Rep:Mod:quantumblock →NBO Analysis
• 15:1115:11, 22 January 2013 diff hist +47 Rep:Mod:quantumblock →Molecular Orbitals

21 January 2013

• 15:5215:52, 21 January 2013 diff hist 0 Rep:Mod:quantumblock →Molecular Orbitals
• 15:4515:45, 21 January 2013 diff hist +643 Rep:Mod:quantumblock →Frequency analysis
• 15:2215:22, 21 January 2013 diff hist +60 Rep:Mod:quantumblock →Optimization
• 15:2015:20, 21 January 2013 diff hist +388 Rep:Mod:quantumblock →Optimization
• 14:5614:56, 21 January 2013 diff hist +128 Rep:Mod:quantumblock →Frequency analysis
• 14:5314:53, 21 January 2013 diff hist −20 Rep:Mod:quantumblock →Frequency analysis
• 14:4314:43, 21 January 2013 diff hist +876 Rep:Mod:quantumblock →Frequency analysis
• 14:3814:38, 21 January 2013 diff hist −58 Rep:Mod:quantumblock →Frequency analysis
• 14:3114:31, 21 January 2013 diff hist −33 Rep:Mod:quantumblock →Frequency analysis
• 14:2514:25, 21 January 2013 diff hist +125 Rep:Mod:quantumblock →Frequency analysis
• 14:1914:19, 21 January 2013 diff hist +1,394 Rep:Mod:quantumblock →Frequency Analysis
• 14:1514:15, 21 January 2013 diff hist +28 Rep:Mod:quantumblock →Optimization
• 11:5311:53, 21 January 2013 diff hist +6 Rep:Mod:quantumblock →Optimization
• 11:5211:52, 21 January 2013 diff hist +264 Rep:Mod:quantumblock →Optimization
• 11:2411:24, 21 January 2013 diff hist −29 Rep:Mod:quantumblock →Benzene
• 11:2311:23, 21 January 2013 diff hist +44 Rep:Mod:quantumblock →Optimization
• 11:2111:21, 21 January 2013 diff hist 0 Rep:Mod:quantumblock →Optimization
• 11:1911:19, 21 January 2013 diff hist +23 Rep:Mod:quantumblock →Benzene
• 11:1311:13, 21 January 2013 diff hist +622 Rep:Mod:quantumblock →Benzene
• 10:3310:33, 21 January 2013 diff hist −1 Rep:Mod:quantumblock No edit summary
• 10:3110:31, 21 January 2013 diff hist −16 Rep:Mod:quantumblock No edit summary
• 10:3110:31, 21 January 2013 diff hist +9 Rep:Mod:quantumblock No edit summary
• 10:1310:13, 21 January 2013 diff hist +603 Rep:Mod:quantumblock →Energy calculations

20 January 2013

• 16:4216:42, 20 January 2013 diff hist +1 Rep:Mod:quantumblock →Frequency calculation
• 16:4116:41, 20 January 2013 diff hist +10 Rep:Mod:quantumblock →Optimization calculation
• 16:4016:40, 20 January 2013 diff hist +1 Rep:Mod:quantumblock →Molecular Orbital Calculations
• 16:4016:40, 20 January 2013 diff hist +1 Rep:Mod:quantumblock →Frequency Analysis
• 16:4016:40, 20 January 2013 diff hist +10 Rep:Mod:quantumblock →Optimization Calculation
• 16:3916:39, 20 January 2013 diff hist −2 Rep:Mod:quantumblock →Molecular Orbital Analysis of BH3
• 16:3916:39, 20 January 2013 diff hist +1 Rep:Mod:quantumblock →Calculation data
• 16:3716:37, 20 January 2013 diff hist +1 Rep:Mod:quantumblock →Calcuation data
• 16:3716:37, 20 January 2013 diff hist +2 Rep:Mod:quantumblock →Calcuation data