User contributions for Kvm12
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5 March 2015
- 14:3014:30, 5 March 2015 diff hist 0 N File:KVM BENZENE FREQ.LOG No edit summary current
- 14:2414:24, 5 March 2015 diff hist +686 Rep:MOD:KVM125133 →Benzene
- 14:2414:24, 5 March 2015 diff hist 0 N File:KVM BENZENE OPT D6h.mol No edit summary current
- 14:2314:23, 5 March 2015 diff hist 0 N File:Kvm benzene opt d6h summary.PNG No edit summary current
- 14:2214:22, 5 March 2015 diff hist 0 N File:KVM BENZENE OPT D6H.LOG No edit summary current
- 14:2014:20, 5 March 2015 diff hist +139 Rep:MOD:KVM125133 →Benzene
- 14:1614:16, 5 March 2015 diff hist +674 Rep:MOD:KVM125133 →Benzene
- 14:1614:16, 5 March 2015 diff hist 0 N File:KVM BENZENE OPT.mol No edit summary current
- 14:1414:14, 5 March 2015 diff hist 0 N File:Kvm benzene opt summary.PNG No edit summary current
- 14:1414:14, 5 March 2015 diff hist 0 N File:KVM BENZENE OPT.LOG No edit summary current
- 14:1314:13, 5 March 2015 diff hist +126 Rep:MOD:KVM125133 →Week 2: Aromaticity Project
- 14:1014:10, 5 March 2015 diff hist +31 Rep:MOD:KVM125133 →Association Energy
- 14:0914:09, 5 March 2015 diff hist +10 Rep:MOD:KVM125133 No edit summary
- 14:0814:08, 5 March 2015 diff hist −76 Rep:MOD:KVM125133 →Association Energy
3 March 2015
- 15:5715:57, 3 March 2015 diff hist +829 Rep:MOD:KVM125133 →Charge Distribution of NH3
- 15:5115:51, 3 March 2015 diff hist −12 Rep:MOD:KVM125133 →Charge Distribution of NH3
- 15:5015:50, 3 March 2015 diff hist +3,775 Rep:MOD:KVM125133 →Charge Distribution of NH3
- 15:3415:34, 3 March 2015 diff hist +188 Rep:MOD:KVM125133 →Association Energy
- 15:2115:21, 3 March 2015 diff hist +771 Rep:MOD:KVM125133 →Molecular Orbitals of BH3
- 15:0415:04, 3 March 2015 diff hist +307 Rep:MOD:KVM125133 →Vibrational spectrum for GaBr3
- 14:5414:54, 3 March 2015 diff hist +681 Rep:MOD:KVM125133 →Geometry Comparison
- 14:3414:34, 3 March 2015 diff hist +3 Rep:MOD:KVM125133 →Frequency NH3BH3:B3LYP/6-31G(d,p)
- 14:3314:33, 3 March 2015 diff hist 0 N File:Kvm nh3bh3 freq4 summary.PNG No edit summary current
- 14:3314:33, 3 March 2015 diff hist 0 N File:KVM NH3BH3 FREQ4.LOG No edit summary current
- 14:3014:30, 3 March 2015 diff hist +5 Rep:MOD:KVM125133 →Optimisation of NH3BH3:B3LYP/6-31G(d,p)
- 14:3014:30, 3 March 2015 diff hist −2 Rep:MOD:KVM125133 →Optimisation of NH3BH3:B3LYP/6-31G(d,p)
- 14:2914:29, 3 March 2015 diff hist 0 N File:KVM NH3BH3 OPT2.mol No edit summary current
- 14:2914:29, 3 March 2015 diff hist 0 N File:KVM NH3BH3 OPT2.LOG No edit summary current
- 14:2814:28, 3 March 2015 diff hist 0 N File:Kvm nh3bh3 opt2 summary.PNG No edit summary current
- 14:1314:13, 3 March 2015 diff hist +192 Rep:MOD:KVM125133 →Frequency NH3:B3LYP/6-31G(d,p)
- 14:1114:11, 3 March 2015 diff hist 0 N File:KVM NH3 freq c3v sum.PNG No edit summary current
- 14:1114:11, 3 March 2015 diff hist 0 N File:KVM NH3 FREQ3.LOG No edit summary current
- 14:0114:01, 3 March 2015 diff hist +169 Rep:MOD:KVM125133 →Optimisation of NH3:B3LYP/6-31G(d,p)
- 13:5713:57, 3 March 2015 diff hist +346 Rep:MOD:KVM125133 →GaBr3: B3LYP/LANL2DZ
- 13:5413:54, 3 March 2015 diff hist +111 Rep:MOD:KVM125133 →BH3: B3LYP/6-31G(d,p)
- 13:5313:53, 3 March 2015 diff hist +616 Rep:MOD:KVM125133 →BH3: B3LYP/6-31G(d,p)
- 13:5313:53, 3 March 2015 diff hist 0 N File:KVM BH3 SYMMETRY OPT.mol No edit summary current
- 13:5113:51, 3 March 2015 diff hist 0 N File:KVM bh3 symmetry op summary.PNG No edit summary current
- 13:5013:50, 3 March 2015 diff hist +40 Rep:MOD:KVM125133 →BH3: B3LYP/6-31G(d,p)
- 13:5013:50, 3 March 2015 diff hist 0 N File:KVM BH3 SYMMETRY OPT.LOG No edit summary current
- 13:4913:49, 3 March 2015 diff hist −130 Rep:MOD:KVM125133 →BH3: B3LYP/6-31G(d,p)
- 13:3913:39, 3 March 2015 diff hist −22 Rep:MOD:KVM125133 →Geometry Comparison
- 13:3113:31, 3 March 2015 diff hist +188 Rep:MOD:KVM125133 →Geometry Comparison
- 13:2113:21, 3 March 2015 diff hist +188 Rep:MOD:KVM125133 →BBr3:B3LYP/6-31G(d,p)LANL2DZ
- 13:1913:19, 3 March 2015 diff hist +110 Rep:MOD:KVM125133 →GaBr3:B3LYP/LANL2DZ
- 13:1813:18, 3 March 2015 diff hist +204 Rep:MOD:KVM125133 →EX3 Optimisation
- 10:5010:50, 3 March 2015 diff hist +311 Rep:MOD:KVM125133 →Association Energy
- 10:4710:47, 3 March 2015 diff hist +131 Rep:MOD:KVM125133 →Association Energy
- 10:4110:41, 3 March 2015 diff hist +234 Rep:MOD:KVM125133 →Association Energies: Ammonia-Borane
- 10:3210:32, 3 March 2015 diff hist +1 Rep:MOD:KVM125133 →Frequency NH3BH3:B3LYP/6-31G(d,p)