Uploads by Rah113
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This special page shows all uploaded files.
| Date | Name | Thumbnail | Size | Description | Versions |
|---|---|---|---|---|---|
| 21:22, 10 March 2016 | Rah113 - VPFU MD QH v T.png (file) | 155 KB | 1 | ||
| 16:12, 10 March 2016 | Rah113- CV & LC against T.png (file) | 202 KB | 1 | ||
| 16:12, 10 March 2016 | Rah113-HFE v T.png (file) | 125 KB | 1 | ||
| 15:04, 8 March 2016 | Rah113 DOS graph.png (file) | 252 KB | 2 | ||
| 20:18, 7 March 2016 | Rah113-primative unit cell.png (file) | 123 KB | 1 | ||
| 20:17, 7 March 2016 | Rah113-conventional unit cell.png (file) | 484 KB | 1 | ||
| 17:12, 15 February 2016 | RAH113-Replot at 50 points.jpg (file) | 110 KB | 1 | ||
| 16:14, 17 December 2015 | Rah113-TS EXO IRC DFTB3LYP.mol (file) | 375 KB | 2 | ||
| 12:16, 17 December 2015 | TS EXO OPTFREQ AM1.jpg (file) | Error creating thumbnail: File with dimensions greater than 12.5 MP |
775 KB | 1 | |
| 12:13, 17 December 2015 | TS EXO OPTFREQ DFTB3LYP.jpg (file) | Error creating thumbnail: File with dimensions greater than 12.5 MP |
804 KB | 1 | |
| 15:48, 14 December 2015 | Ethenefrag Opt DFTB3LYP.jpg (file) | 1.91 MB | 5 | ||
| 12:36, 14 December 2015 | Rah113-TS ENDO OPTFREQ DFTB3LYP.jpg (file) | 183 KB | 1 | ||
| 17:22, 10 December 2015 | RAH113-Cope reaction scheme 2.jpg (file) | 11 KB | 1 | ||
| 17:21, 10 December 2015 | RAH113-Cope reaction scheme.jpg (file) | 11 KB | 9 | ||
| 13:34, 10 December 2015 | Rah113-TS ENDO opt(min) DFTB3LYP.jpg (file) | 1.89 MB | 1 | ||
| 11:45, 10 December 2015 | Rah113-CHAIR TS IRC.gif (file) | 6 bytes | 1 | ||
| 15:01, 9 December 2015 | Rah113-Diels alder WH.jpg (file) | ![]() |
5 KB | 2 | |
| 13:33, 9 December 2015 | Rah113-TS Guess opt AM1.jpg (file) | 1.44 MB | 1 | ||
| 19:28, 8 December 2015 | RAH113-Butadiene AM1 opt LUMO.jpg (file) | 1.21 MB | 1 | ||
| 19:27, 8 December 2015 | RAH113-Butadiene AM1 opt HOMO.jpg (file) | 1.25 MB | 1 | ||
| 17:39, 8 December 2015 | Rah113-CHAIR TS IRC.spt (file) | 8 KB | 1 | ||
| 16:44, 8 December 2015 | Rah113-CHAIR TS IRC.LOG (file) | 464 KB | 1 | ||
| 16:43, 8 December 2015 | CHAIR TS IRC.LOG (file) | 885 KB | Reverted to version as of 19:46, 6 December 2012 | 3 | |
| 15:52, 8 December 2015 | Rah113-BOAT TS OPT(E2).jpg (file) | 164 KB | 1 | ||
| 13:00, 8 December 2015 | Rah113-react gauche3 mo23.cub (file) | 1.96 MB | 1 | ||
| 12:43, 8 December 2015 | CHAIR TS OPT(B2).log (file) | 334 KB | 1 | ||
| 12:32, 8 December 2015 | Rah113-CHAIR TS OPT(B2).LOG (file) | 334 KB | 1 | ||
| 12:30, 8 December 2015 | Rah113-CHAIR TS OPT(B2).mol (file) | 334 KB | 2 | ||
| 11:44, 8 December 2015 | RAh113-react gauche3.mol2 (file) | 978 bytes | 1 | ||
| 19:04, 7 December 2015 | RAh113-react gauche3.jpg (file) | 1.33 MB | 1 | ||
| 18:31, 7 December 2015 | Rah113-react anti Ci DFT freq.mol (file) | 2 KB | 1 | ||
| 18:30, 7 December 2015 | Rah113-react anti Ci.mol (file) | 2 KB | 1 | ||
| 18:28, 7 December 2015 | RAh113-react gauche3.mol (file) | 2 KB | 1 | ||
| 18:23, 7 December 2015 | Rah113-react gauche run2.mol (file) | 2 KB | 1 | ||
| 18:20, 7 December 2015 | Rah113-react anti.mol (file) | 2 KB | 1 | ||
| 16:47, 7 December 2015 | RAH113-Energyvsdangle.jpg (file) | 97 KB | 1 | ||
| 14:49, 7 December 2015 | RAH113-endo-exo.jpg (file) | 7 KB | 1 | ||
| 14:30, 7 December 2015 | RAH113-DA WH.jpg (file) | ![]() |
6 KB | 1 | |
| 12:49, 7 December 2015 | RAH113-Cope WH.jpg (file) | ![]() |
5 KB | 1 |


