Jump to content

User contributions for Ej410

Results for Ej410 talk block log uploads logs

A user with 359 edits. Account created on 10 October 2014.

12:2512:25, 20 October 2014 diff hist 0 N File:EKJ BENZENE 6-31G FREQ.LOG No edit summary current
12:2512:25, 20 October 2014 diff hist 0 N File:EKJ Benzene freq summary.jpg No edit summary current
12:2412:24, 20 October 2014 diff hist +309 Rep:Mod:EKJ1021 →Frequency analysis
12:2212:22, 20 October 2014 diff hist +54 Rep:Mod:EKJ1021 →Benzene
12:1012:10, 20 October 2014 diff hist +1 Rep:Mod:EKJ1021 →Aromaticity
12:1012:10, 20 October 2014 diff hist 0 N File:EKJ BENZENE 6-31G.LOG No edit summary
12:0912:09, 20 October 2014 diff hist −5 Rep:Mod:EKJ1021 →Aromaticity
12:0812:08, 20 October 2014 diff hist 0 N File:EKJ benzene 6-31G.mol No edit summary current
12:0812:08, 20 October 2014 diff hist 0 N File:EKJ Benzene summary.jpg No edit summary current
12:0712:07, 20 October 2014 diff hist +691 Rep:Mod:EKJ1021 →3rd Year Computational Lab: Inorganic Module

14:0314:03, 17 October 2014 diff hist +2 Rep:Mod:EKJ1021 →Determination of bond energy
13:5813:58, 17 October 2014 diff hist +2 Rep:Mod:EKJ1021 →Determination of bond energy
13:5213:52, 17 October 2014 diff hist +1 Rep:Mod:EKJ1021 →BH3 frequency file
13:2913:29, 17 October 2014 diff hist +40 Rep:Mod:EKJ1021 →BH3 frequency file
13:1913:19, 17 October 2014 diff hist +11 Rep:Mod:EKJ1021 →Molecule of BBr3
13:1813:18, 17 October 2014 diff hist −29 Rep:Mod:EKJ1021 →Using pseudo-potentials and larger basis sets
13:1613:16, 17 October 2014 diff hist −13 Rep:Mod:EKJ1021 →Pseudo-potentials and basis sets
13:1513:15, 17 October 2014 diff hist +11 Rep:Mod:EKJ1021 →Pseudo-potentials and basis sets
13:1413:14, 17 October 2014 diff hist +71 Rep:Mod:EKJ1021 →Pseudo-potentials and basis sets
13:1213:12, 17 October 2014 diff hist +1 Rep:Mod:EKJ1021 →Geometry Comparison
13:1213:12, 17 October 2014 diff hist +2 Rep:Mod:EKJ1021 →Total energy and RMS plot
13:1113:11, 17 October 2014 diff hist −8 Rep:Mod:EKJ1021 →Understanding optimisation part a
13:1113:11, 17 October 2014 diff hist +246 Rep:Mod:EKJ1021 →Understanding optimisation part a
13:0513:05, 17 October 2014 diff hist +160 Rep:Mod:EKJ1021 →Understanding optimisation part a
13:0013:00, 17 October 2014 diff hist −2 Rep:Mod:EKJ1021 →Pseudo-potentials and basis sets
12:5812:58, 17 October 2014 diff hist +70 Rep:Mod:EKJ1021 →Pseudo-potentials and basis sets
12:5612:56, 17 October 2014 diff hist +77 Rep:Mod:EKJ1021 →Day 1
12:5412:54, 17 October 2014 diff hist +3 Rep:Mod:EKJ1021 →Day 1
12:5412:54, 17 October 2014 diff hist +68 Rep:Mod:EKJ1021 →Day 1
12:3112:31, 17 October 2014 diff hist +22 Rep:Mod:EKJ1021 →Vibrational spectrum for NH3BH3
12:3112:31, 17 October 2014 diff hist +22 Rep:Mod:EKJ1021 →NH3BH3 Analysis
12:3112:31, 17 October 2014 diff hist +11 Rep:Mod:EKJ1021 →NBO analysis of NH3
12:3012:30, 17 October 2014 diff hist +11 Rep:Mod:EKJ1021 →Vibrational spectrum for NH3
12:3012:30, 17 October 2014 diff hist +11 Rep:Mod:EKJ1021 →NH3 frequency file
12:3012:30, 17 October 2014 diff hist +11 Rep:Mod:EKJ1021 →NH3 optimisation
12:3012:30, 17 October 2014 diff hist +11 Rep:Mod:EKJ1021 →Vibrational spectrum for GaBr3
12:2912:29, 17 October 2014 diff hist +11 Rep:Mod:EKJ1021 →Vibrational spectrum for BH3
12:2912:29, 17 October 2014 diff hist +33 Rep:Mod:EKJ1021 →Geometry Comparison
12:2812:28, 17 October 2014 diff hist +11 Rep:Mod:EKJ1021 →Checking convergence of BH3 molecule
12:2712:27, 17 October 2014 diff hist +1 Rep:Mod:EKJ1021 →Check your job has really converged
12:2712:27, 17 October 2014 diff hist −244 Rep:Mod:EKJ1021 →3rd Year Computational Lab: Inorganic Module
12:1412:14, 17 October 2014 diff hist +4 Rep:Mod:EKJ1021 →Determination of bond energy
12:1312:13, 17 October 2014 diff hist 0 Rep:Mod:EKJ1021 →Determination of bond energy
12:1212:12, 17 October 2014 diff hist +90 Rep:Mod:EKJ1021 →Determination of bond energy

Retrieved from "https://chemwiki.ch.ic.ac.uk/wiki/Special:Contributions/Ej410"