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14:40, 11 November 2011 Jy1109 talk contribs uploaded File:Boat optimisation g.png
14:30, 11 November 2011 Jy1109 talk contribs uploaded File:Structure after optmiization in part g.PNG
14:14, 11 November 2011 Jy1109 talk contribs uploaded File:IRC III.PNG
12:47, 11 November 2011 Jy1109 talk contribs uploaded File:IRC i final structure.PNG
11:41, 11 November 2011 Jy1109 talk contribs uploaded File:Trans state opt after modifying angle.PNG
11:38, 11 November 2011 Jy1109 talk contribs uploaded File:Reactants and products after adjusting angles.PNG
11:28, 11 November 2011 Jy1109 talk contribs uploaded File:Labelling the reactants and products.PNG
10:14, 11 November 2011 Jy1109 talk contribs uploaded a new version of File:Endo mechanism.png
07:53, 11 November 2011 Jy1109 talk contribs uploaded a new version of File:Endo mechanism.png
19:44, 10 November 2011 Jy1109 talk contribs uploaded File:Endo LUMO.PNG
19:37, 10 November 2011 Jy1109 talk contribs uploaded File:Endo HOMO.PNG
19:28, 10 November 2011 Jy1109 talk contribs uploaded a new version of File:Endo labelled structure.PNG
19:27, 10 November 2011 Jy1109 talk contribs uploaded File:Endo labelled structure.PNG
18:45, 10 November 2011 Jy1109 talk contribs uploaded a new version of File:Part iii opt of exo unfreeze barny structure.PNG
18:42, 10 November 2011 Jy1109 talk contribs uploaded a new version of File:Endo DFT optimised structure.PNG
18:40, 10 November 2011 Jy1109 talk contribs uploaded a new version of File:Endo DFT optimised structure.PNG
18:34, 10 November 2011 Jy1109 talk contribs uploaded File:Part iii opt of exo unfreeze barny structure.PNG
18:33, 10 November 2011 Jy1109 talk contribs uploaded File:Part iii opt of endo freeze structure.PNG
18:32, 10 November 2011 Jy1109 talk contribs uploaded File:Endo DFT optimised structure.PNG
16:08, 10 November 2011 Jy1109 talk contribs uploaded File:Exo LUMO sketch.PNG
16:04, 10 November 2011 Jy1109 talk contribs uploaded File:Exo HOMO.PNG
11:12, 10 November 2011 Jy1109 talk contribs uploaded a new version of File:Exo labelled diagram for geometry analysis.PNG
11:12, 10 November 2011 Jy1109 talk contribs uploaded File:Exo labelled diagram for geometry analysis.PNG
10:13, 10 November 2011 Jy1109 talk contribs uploaded a new version of File:Part iii opt of exo freeze structure.PNG
10:12, 10 November 2011 Jy1109 talk contribs uploaded a new version of File:Part iii opt of exo freeze structure.PNG
10:11, 10 November 2011 Jy1109 talk contribs uploaded a new version of File:Part iii opt of exo freeze structure.PNG
10:07, 10 November 2011 Jy1109 talk contribs uploaded File:Part iii opt of exo DFT structure.PNG
10:03, 10 November 2011 Jy1109 talk contribs uploaded File:Part iii opt of endo unfreeze TS barney structure.PNG
10:02, 10 November 2011 Jy1109 talk contribs uploaded File:Part iii opt of exo freeze structure.PNG
09:00, 10 November 2011 Jy1109 talk contribs uploaded File:Part iii maleic LUMO.PNG
08:59, 10 November 2011 Jy1109 talk contribs uploaded File:Part iii maleic HOMO.PNG
08:58, 10 November 2011 Jy1109 talk contribs uploaded File:Part iii cyclohex LUMO.PNG
08:57, 10 November 2011 Jy1109 talk contribs uploaded File:Part iii cyclohex HOMO.PNG
07:42, 10 November 2011 Jy1109 talk contribs uploaded File:Part iii reaction.png
17:06, 9 November 2011 Jy1109 talk contribs uploaded File:Part ii LUMO.PNG
17:06, 9 November 2011 Jy1109 talk contribs uploaded File:PART ii HOMO.PNG
16:40, 9 November 2011 Jy1109 talk contribs uploaded File:Part ii labelled diagram after optimization.PNG
15:48, 9 November 2011 Jy1109 talk contribs uploaded File:Part ii opt after unfreeze.PNG
15:35, 9 November 2011 Jy1109 talk contribs uploaded File:Part ii after opt using freezing coordinate.PNG
15:18, 9 November 2011 Jy1109 talk contribs uploaded File:Part ii transition state before opt.PNG
15:13, 9 November 2011 Jy1109 talk contribs uploaded File:Prototype reac.png
15:01, 9 November 2011 Jy1109 talk contribs uploaded File:Part i LUMO.PNG
14:59, 9 November 2011 Jy1109 talk contribs uploaded File:Part i HOMO.PNG
14:16, 6 November 2011 Jy1109 talk contribs uploaded File:Imaginary frequency in part b.gif
14:11, 6 November 2011 Jy1109 talk contribs uploaded File:Optimized strcuture for b.PNG
13:34, 6 November 2011 Jy1109 talk contribs uploaded File:Mimic transition state.PNG
11:35, 6 November 2011 Jy1109 talk contribs uploaded File:IR spectrum for part g.PNG
22:17, 5 November 2011 Jy1109 talk contribs uploaded File:App optimization -labelled,DFT.PNG
22:16, 5 November 2011 Jy1109 talk contribs uploaded File:App optimization - labelled,HF,3-21G.PNG
20:12, 5 November 2011 Jy1109 talk contribs uploaded File:Gauche optimization in part c.PNG