Uploads by Gjs09
This special page shows all uploaded files.
| Date | Name | Thumbnail | Size | Description | Versions |
|---|---|---|---|---|---|
| 16:28, 11 November 2011 | BOAT IRC FINAL FINALE.mol2 (file) |  |
978 bytes | 1 | |
| 16:21, 11 November 2011 | BOAT IRC FINALE.mol2 (file) | |
959 bytes | 1 | |
| 16:18, 11 November 2011 | RMS boat graph.jpg (file) |  |
180 KB | 1 | |
| 16:17, 11 November 2011 | Boat Graph.jpg (file) |  |
198 KB | 1 | |
| 13:50, 11 November 2011 | IR Spectrum DA.jpg (file) |  |
211 KB | 1 | |
| 13:35, 11 November 2011 | LUMO Transition State Symmetric.jpg (file) |  |
289 KB | 1 | |
| 13:34, 11 November 2011 | HOMO Transition State Anti Symmetric.jpg (file) |  |
295 KB | 1 | |
| 12:44, 11 November 2011 | EXO MO 37.jpg (file) |  |
294 KB | 1 | |
| 12:44, 11 November 2011 | EXO MO 16.jpg (file) |  |
295 KB | 1 | |
| 12:40, 11 November 2011 | ENDO MO 37.jpg (file) |  |
350 KB | 1 | |
| 12:38, 11 November 2011 | ENDO MO 16.jpg (file) |  |
304 KB | 1 | |
| 12:04, 11 November 2011 | Exo Numbered.jpg (file) |  |
310 KB | 1 | |
| 12:02, 11 November 2011 | Endo Numbered.jpg (file) |  |
323 KB | 1 | |
| 11:45, 11 November 2011 | Reaction Mechanism figure 1 important bonds.png (file) |  |
28 KB | 1 | |
| 11:42, 11 November 2011 | EXO LOG FILE FROM OPT.txt (file) |  |
421 KB | 1 | |
| 11:40, 11 November 2011 | ENDO LOG FILE FROM OPT.txt (file) | |
208 KB | 1 | |
| 11:27, 11 November 2011 | Reaction Mechanism figure 1.png (file) |  |
28 KB | 1 | |
| 11:22, 11 November 2011 | Reaction Mechanism.png (file) |  |
27 KB | 1 | |
| 11:00, 11 November 2011 | EXO OPT.mol2 (file) | |
1 KB | 1 | |
| 10:59, 11 November 2011 | ENDO OPT.mol2 (file) | |
1 KB | 1 | |
| 21:08, 10 November 2011 | SE AM1 FCH C.LOG (file) | |
230 KB | 1 | |
| 19:56, 10 November 2011 | SE AM1 FREQ OPT FROZEN TO MINIMUM TRANS IMAGINARY VIBRATION.gif (file) |  |
539 KB | 1 | |
| 19:43, 10 November 2011 | SE AM1 freq opt Frozen to minimum Trans Numbered Large.jpg (file) |  |
267 KB | 1 | |
| 19:42, 10 November 2011 | SE AM1 freq opt Frozen to minimum Trans Numbered.jpg (file) |  |
215 KB | 1 | |
| 15:49, 10 November 2011 | DFT Boat LOG FILE.txt (file) | |
625 KB | 1 | |
| 15:48, 10 November 2011 | HF Boat LOG FILE.txt (file) | |
610 KB | 1 | |
| 15:23, 10 November 2011 | DFT Chair AE LOG FILE.txt (file) | |
170 KB | 1 | |
| 14:44, 10 November 2011 | HF Chair AE LOG FILE.txt (file) | |
436 KB | 1 | |
| 22:06, 9 November 2011 | SE AM1 Opt Freq TS Berny DA 1.mol2 (file) | |
973 bytes | 1 | |
| 21:29, 9 November 2011 | SE AM1 Opt Freq TS Berny DA Imaginary Vib.gif (file) |  |
551 KB | 1 | |
| 18:29, 9 November 2011 | 4 2 Diels Alder Example.png (file) |  |
6 KB | 1 | |
| 17:51, 9 November 2011 | LUMO Ethylene DFT with plane.png (file) |  |
177 KB | 1 | |
| 17:43, 9 November 2011 | HOMO Ethylene DFT with plane.png (file) |  |
120 KB | 1 | |
| 17:34, 9 November 2011 | LUMO Ethylene AM1 with plane.png (file) |  |
146 KB | 1 | |
| 17:33, 9 November 2011 | HOMO Ethylene AM1 with plane.png (file) |  |
194 KB | 1 | |
| 16:38, 9 November 2011 | LUMO Cis Butadiene 631G d with plane.png (file) |  |
351 KB | 1 | |
| 16:37, 9 November 2011 | HOMO Cis Butadiene 631G d with plane.png (file) |  |
321 KB | 1 | |
| 16:10, 9 November 2011 | LUMO Cis Butadiene with plane.jpg (file) |  |
112 KB | 1 | |
| 16:09, 9 November 2011 | HOMO Cis Butadiene with plane.jpg (file) |  |
163 KB | 1 | |
| 12:30, 9 November 2011 | Chair Transition Part B new.mol2 (file) | |
1,001 bytes | 1 | |
| 12:27, 9 November 2011 | DFT QST2 Boat Trans with linking.mol2 (file) | |
993 bytes | 1 | |
| 12:23, 9 November 2011 | HF Boat Trans with linking.mol2 (file) | |
993 bytes | 1 | |
| 11:15, 9 November 2011 | DFT B3LYP 6-31G (D) QST2 FREQ OPT BOAT Log 48471.mol2 (file) | |
972 bytes | 1 | |
| 16:21, 8 November 2011 | Chair Transition Structure Part D.mol2 (file) | |
1,001 bytes | 1 | |
| 16:19, 8 November 2011 | Chair Transition Structure Part B.mol2 (file) | |
997 bytes | 1 | |
| 15:20, 8 November 2011 | HF 321G QST2 Boat Trans.mol2 (file) | |
968 bytes | 1 | |
| 15:16, 8 November 2011 | Boat Transition State B3LYP 631G d QTS2 summary.txt (file) | |
427 bytes | 1 | |
| 15:15, 8 November 2011 | Boat Transition State HF 321G QTS2 summary.txt (file) | |
419 bytes | 1 | |
| 15:03, 8 November 2011 | DFT B3LYP 631G d Boat imaginary vibration 531cm LOG 48471.gif (file) |  |
642 KB | 1 | |
| 14:15, 8 November 2011 | IRC calculation at every step for chair transition structure summary 2.txt (file) | |
386 bytes | 1 |
