User contributions for Njm08
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10 October 2012
- 22:2122:21, 10 October 2012 diff hist +21 Rep:Mod:1101927 No edit summary
- 22:1922:19, 10 October 2012 diff hist +18 N Category:3rd year computational lab Created page with "Category:Njm08"
- 22:1822:18, 10 October 2012 diff hist +22 Rep:Mod:1101927 No edit summary
- 22:1722:17, 10 October 2012 diff hist +18 N Category:MSci research Created page with "Category:Njm08"
- 22:1722:17, 10 October 2012 diff hist −18 Category:Njm08 MSci research Blanked the page current
- 22:1422:14, 10 October 2012 diff hist +27 N Category:Njm08 Created page with "Wiki pages created by njm08"
- 22:1222:12, 10 October 2012 diff hist +18 N Category:Njm08 MSci research Created page with "Category:Njm08"
- 15:0215:02, 10 October 2012 diff hist +38 N User:Njm08/MSci research Created page with "Documentation of MSci research project"
- 14:4714:47, 10 October 2012 diff hist +2 User:Njm08 No edit summary
- 14:4714:47, 10 October 2012 diff hist +2 User:Njm08 No edit summary
- 14:4714:47, 10 October 2012 diff hist −4 User:Njm08 No edit summary
- 14:4614:46, 10 October 2012 diff hist −327 User:Njm08 No edit summary
4 April 2012
- 02:3702:37, 4 April 2012 diff hist +14 Rep:Mod:8039662 →cis/trans sterochemistry of the bis-PPh3 adduct
3 April 2012
- 21:5821:58, 3 April 2012 diff hist +748 Rep:Mod:8039662 →Optimisations
- 21:4221:42, 3 April 2012 diff hist −5 Rep:Mod:8039662 →Binding energies
- 21:4021:40, 3 April 2012 diff hist +3 Rep:Mod:8039662 →Conclusions
- 21:3621:36, 3 April 2012 diff hist +2,856 Rep:Mod:8039662 →Extra d-functions on phosphorous
- 21:1921:19, 3 April 2012 diff hist +598 Rep:Mod:8039662 →Binding energies
- 21:0721:07, 3 April 2012 diff hist −149 Rep:Mod:8039662 →Optimisations
- 16:0816:08, 3 April 2012 diff hist +1,005 Rep:Mod:8039662 →Optimisations
- 13:4413:44, 3 April 2012 diff hist 0 N File:P4 opt SDD free njm08.mol No edit summary current
2 April 2012
- 22:4022:40, 2 April 2012 diff hist −37 Rep:Mod:8039662 →Structure and Bonding
- 22:3322:33, 2 April 2012 diff hist +90 Rep:Mod:8039662 →Optimisations
- 22:1422:14, 2 April 2012 diff hist +1,396 Rep:Mod:8039662 →Coordination of 2 to L-type ligands
1 April 2012
- 23:2623:26, 1 April 2012 diff hist +533 Rep:Mod:8039662 →Structure and Bonding
- 02:2702:27, 1 April 2012 diff hist +1 Rep:Mod:8039662 →From a "ideal" model
- 02:2602:26, 1 April 2012 diff hist +1 Rep:Mod:8039662 →From previously optimised coordinates
- 02:2602:26, 1 April 2012 diff hist +132 Rep:Mod:8039662 →From previously optimised coordinates
- 01:0901:09, 1 April 2012 diff hist +3,176 Rep:Mod:8039662 →Mini Project: The structure, bonding and coordination chemistry of [Pd4(C8H8)(C9H9)][BArf4]
29 March 2012
- 22:2622:26, 29 March 2012 diff hist 0 Rep:Mod:8039662 →Frequency analysis
- 22:2522:25, 29 March 2012 diff hist −30 Rep:Mod:8039662 →Frequency analysis
- 22:2222:22, 29 March 2012 diff hist +40 Rep:Mod:8039662 →Frequency analysis
- 22:1422:14, 29 March 2012 diff hist +115 Rep:Mod:8039662 →BH3
- 22:0022:00, 29 March 2012 diff hist +67 Rep:Mod:8039662 →TlBr3
25 March 2012
- 23:3323:33, 25 March 2012 diff hist +27 Rep:Mod:8039662 →Molecular Orbitals
- 23:3023:30, 25 March 2012 diff hist +93 Rep:Mod:8039662 →Frequency analysis
- 21:5221:52, 25 March 2012 diff hist +56 Rep:Mod:8039662 →An organometallic complex: Isomers of Mo(CO)4(PPh3)2
- 21:5021:50, 25 March 2012 diff hist +614 Rep:Mod:8039662 →TlBr3
- 01:3701:37, 25 March 2012 diff hist +2,146 Rep:Mod:8039662 →Getting to grips with Gaussian
- 01:0001:00, 25 March 2012 diff hist +1,382 Rep:Mod:8039662 →Getting to grips with Gaussian
- 00:2200:22, 25 March 2012 diff hist 0 N File:TLBR3 freq log 57572.out No edit summary current
24 March 2012
- 23:2523:25, 24 March 2012 diff hist +11 Rep:Mod:8039662 →TlBr3
23 March 2012
- 23:3723:37, 23 March 2012 diff hist −12 Rep:Mod:8039662 →Optimisation
- 23:3623:36, 23 March 2012 diff hist −37 Rep:Mod:8039662 →Optimisation
- 23:3123:31, 23 March 2012 diff hist −12 Rep:Mod:8039662 →Optimisation
- 23:3023:30, 23 March 2012 diff hist +179 Rep:Mod:8039662 →Optimisation
- 23:2523:25, 23 March 2012 diff hist 0 N File:Mo cis DZ starting geom.jpg No edit summary current
- 23:2523:25, 23 March 2012 diff hist 0 N File:Mo trans DZ starting geom.jpg No edit summary current
- 23:0523:05, 23 March 2012 diff hist +1,098 Rep:Mod:8039662 →Extra d-functions on phosphorous
- 22:1422:14, 23 March 2012 diff hist −28 Rep:Mod:8039662 →Extra d-functions on phosphorous