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Uploads by Rg1712

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Date Name Thumbnail Size Description Versions
16:38, 28 November 2014 DA TS HOMO Solid.jpg (file) 240 KB   1
14:03, 28 November 2014 DA part1 Mesh LUMO Butadiene.jpg (file) 1.09 MB   1
14:02, 28 November 2014 DA part1 Mesh HOMO Cis Butadiene.jpg (file) 1.07 MB   1
14:00, 28 November 2014 DA part1 Solid LUMO Cis Butadiene.jpg (file) 203 KB   1
13:55, 28 November 2014 DA part1 Solid HOMO Cis Butadiene.jpg (file) 203 KB   1
16:20, 27 November 2014 Boat RMS.PNG (file) 16 KB   1
16:18, 27 November 2014 Boat IRC.PNG (file) 14 KB   2
16:16, 27 November 2014 Chair Transition State IRC Part d.PNG (file) 15 KB   1
16:09, 27 November 2014 Chair Transition Cope Rearrangement.gif (file) 1.74 MB   2
15:42, 27 November 2014 Labelled Chair for Comparison of Frozen bond and normal method.PNG (file) 97 KB   1
00:28, 27 November 2014 QST2 Boat TS.mol (file) 2 KB   1
00:24, 27 November 2014 Boat Transition Cope Rearrangement.gif (file) 1.02 MB   1
00:21, 27 November 2014 QST2 Dissociated Chair.mol (file) 2 KB   2
00:13, 27 November 2014 Boat TS Labelled.PNG (file) 65 KB   1
19:37, 25 November 2014 Chair TS b.mol (file) 2 KB   1
19:07, 25 November 2014 IR Spectrum Anti 2.PNG (file) 23 KB   1
18:45, 25 November 2014 Snip20141125 12.png (file) 126 KB   1
16:07, 25 November 2014 Labelled Diagram for Optimisation of Reactants and Products.PNG (file) 38 KB   1
00:11, 25 November 2014 Anti 2 DFT check label.mol (file) 2 KB   1
23:46, 24 November 2014 Anti 2 DFT check label.gjf (file) 1 KB   1
20:00, 24 November 2014 Rg1712 react strange.mol (file) 2 KB   1
17:31, 24 November 2014 Rg1712 react anti 4.mol (file) 2 KB   1
17:30, 24 November 2014 Rg1712 react anti 2.mol (file) 2 KB   1
17:29, 24 November 2014 Rg1712 react anti 1.mol (file) 2 KB   1
17:27, 24 November 2014 Rg1712 react gauche 6.mol (file) 2 KB   1
17:25, 24 November 2014 Rg1712 react gauche 5.mol (file) 2 KB   1
17:24, 24 November 2014 Rg1712 react gauche 4.mol (file) 2 KB   1
17:20, 24 November 2014 Rg1712 react gauche 2.mol (file) 2 KB   1
17:09, 24 November 2014 Rg1712 react gauche 1.mol (file) 2 KB   1
14:42, 24 November 2014 Rg1712 react gauche 3.mol (file) 2 KB   1
14:17, 24 November 2014 Rg1712 react anti 3.mol (file) 2 KB   2
21:36, 6 November 2014 Snip20141106 10.png (file) 205 KB   1
21:21, 6 November 2014 Snip20141106 9.png (file) 141 KB   1
20:46, 6 November 2014 Snip20141106 8.png (file) 109 KB   1
19:02, 6 November 2014 MgO32 supercell.png (file) 32 KB   1
14:31, 6 November 2014 Snip20141106 7.png (file) 74 KB   1
14:28, 6 November 2014 Snip20141106 6.png (file) 71 KB   1
14:20, 6 November 2014 Snip20141106 4.png (file) 66 KB   1
14:15, 6 November 2014 Snip20141106 3.png (file) 76 KB   1
16:24, 5 November 2014 Rg1712.MgO.image7.png (file) 32 KB   1
16:23, 5 November 2014 Rg1712.MgO.image6.png (file) 29 KB   1
16:23, 5 November 2014 Rg1712.MgO.image5.png (file) 31 KB   1
16:22, 5 November 2014 Rg1712.MgO.image4.png (file) 33 KB   1
16:21, 5 November 2014 Rg1712.MgO.image3.png (file) 26 KB   1
16:20, 5 November 2014 Rg1712.MgO.image2.png (file) 26 KB   1
14:36, 5 November 2014 Rg1712.MgO.image1.png (file) 34 KB   1
13:05, 5 November 2014 MgOconv.png (file) 28 KB   2
12:55, 5 November 2014 Primitive Cell.png (file) 19 KB   2
16:21, 28 October 2014 RG1712.MgO.Figure1.png (file) 35 KB   1
16:13, 28 October 2014 RG1712.MgO Figures.odp (file) 53 KB   1
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