User contributions for Za511
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15 December 2014
- 13:3413:34, 15 December 2014 diff hist −57 User:Za511 →AlCl4Br2 - Isomer 1: B3LYP/GEN
- 13:3013:30, 15 December 2014 diff hist +59 User:Za511 →Optimisation of AlCl4Br2 - Isomer 3
- 13:2913:29, 15 December 2014 diff hist +1 User:Za511 →Optimisation of AlCl4Br2 - Isomer 2
- 13:2713:27, 15 December 2014 diff hist +1,932 User:Za511 →Frequency calculation: AlCl4Br2 - Isomer 2
- 13:2513:25, 15 December 2014 diff hist 0 File:ZA STRCUTURE2 FREQ PPP.LOG Za511 uploaded a new version of "File:ZA STRCUTURE2 FREQ PPP.LOG"
- 13:2513:25, 15 December 2014 diff hist 0 N File:ZA STRCUTURE2 FREQ PPP.LOG No edit summary
- 13:2413:24, 15 December 2014 diff hist 0 N File:ZA STRCUTURE2 freq PPP SUMMARYTABLE.JPG No edit summary
- 13:2313:23, 15 December 2014 diff hist +74 User:Za511 →B3LYP/GEN level
- 13:2313:23, 15 December 2014 diff hist +764 User:Za511 →Optimisation of AlCl4Br2 - Isomer 2
- 13:2313:23, 15 December 2014 diff hist 0 N File:ZA STRCUTURE2 OPTI PPP jmol.mol2 No edit summary current
- 13:2113:21, 15 December 2014 diff hist 0 N File:ZA STRCUTURE2 OPTI PPP.chk No edit summary current
- 13:2013:20, 15 December 2014 diff hist −1 User:Za511 →AlCl4Br2 - Isomer 1: B3LYP/GEN)
- 13:1813:18, 15 December 2014 diff hist −848 User:Za511 →Comparison of energies of NH3BH3 molecule and NH3 - BH3 fragements
- 13:1713:17, 15 December 2014 diff hist −61 User:Za511 →Vibrational spectrum for AlCl4Br2 - Isomer 1
- 13:1713:17, 15 December 2014 diff hist 0 N File:ZA STRCUTURE1 IR SUMMARYTABLE.JPG No edit summary current
- 13:0813:08, 15 December 2014 diff hist +1 User:Za511 →B3LYP/6-31G (d,p) level
- 10:5310:53, 15 December 2014 diff hist +3,057 User:Za511 →Optimisation of NH3BH3
- 10:4510:45, 15 December 2014 diff hist 0 N File:ZA STRCUTURE1 FREQ PPP SUMMARYTABLE.JPG No edit summary current
- 10:4510:45, 15 December 2014 diff hist 0 N File:ZA STRCUTURE1 freq PPP.chk No edit summary current
- 10:4210:42, 15 December 2014 diff hist 0 N File:ZA STRCUTURE1 OPTI PPP jmol.mol2 No edit summary current
- 10:3910:39, 15 December 2014 diff hist 0 N File:ZA STRCUTURE1 OPTI PPP SUMMARYTABLE.JPG No edit summary current
- 10:3810:38, 15 December 2014 diff hist 0 N File:Za strcuture1 opti ppp.chk No edit summary current
13 December 2014
- 19:0519:05, 13 December 2014 diff hist +51 User:Za511 →BH3:B3LYP/6-31G(d,p)
- 18:5918:59, 13 December 2014 diff hist +129 User:Za511 →Vibrational spectrum for GaBr3
- 18:4618:46, 13 December 2014 diff hist +31 User:Za511 →GaBr3:B3LYP/6-31G(d,p)
- 18:4518:45, 13 December 2014 diff hist +688 User:Za511 →Vibrational spectrum for BH3
- 16:4216:42, 13 December 2014 diff hist 0 User:Za511 →Vibrational spectrum for BH3
- 16:4216:42, 13 December 2014 diff hist −13 User:Za511 →BH3:B3LYP/6-31G(d,p)
- 16:4116:41, 13 December 2014 diff hist 0 N File:ZA BH3 FREQUENCY summarytablee.JPG No edit summary current
- 16:4016:40, 13 December 2014 diff hist 0 N File:ZA BH3 FREQUENCY.LOG No edit summary current
- 16:3816:38, 13 December 2014 diff hist +1 User:Za511 →BH3:B3LYP/6-31G(d,p)
- 16:3616:36, 13 December 2014 diff hist +1,637 User:Za511 →Geometry Comparison
- 15:4915:49, 13 December 2014 diff hist +2 User:Za511 →Frequency calculations
- 15:4815:48, 13 December 2014 diff hist −2 User:Za511 →Introduction
- 15:4815:48, 13 December 2014 diff hist −3,727 User:Za511 →ANSWERS TO QUESTIONS IN SCRIPT
- 15:4715:47, 13 December 2014 diff hist +2,055 User:Za511 →Geometry Information
- 13:3313:33, 13 December 2014 diff hist +800 User:Za511 →Optimisation of BBr3
- 13:3313:33, 13 December 2014 diff hist −29 User:Za511 →Optimisation of GaBr3
- 13:3213:32, 13 December 2014 diff hist −771 User:Za511 →BBr3:6-31G/LANL2DZ
- 13:3013:30, 13 December 2014 diff hist +25 User:Za511 →Optimisation of BH3
- 13:3013:30, 13 December 2014 diff hist +3 User:Za511 →EX3 Section
- 13:1713:17, 13 December 2014 diff hist +15 User:Za511 →GaBr3:B3LYP/LANL2DZ
- 13:1613:16, 13 December 2014 diff hist +3 User:Za511 →B3LYP/6-31G(d,p) level
- 13:0913:09, 13 December 2014 diff hist +61 User:Za511 →Introduction
- 12:1412:14, 13 December 2014 diff hist +150 User:Za511 →Introduction
- 12:1312:13, 13 December 2014 diff hist +892 User:Za511 →Borane
- 11:4911:49, 13 December 2014 diff hist +9 User:Za511 →Optimisation of BH3
- 11:4911:49, 13 December 2014 diff hist −21 User:Za511 →Boron tribromide
- 11:4911:49, 13 December 2014 diff hist −2 User:Za511 →Optimisation of BBr3
- 11:4811:48, 13 December 2014 diff hist −2 User:Za511 →Optimisation of GaBr3