Uploads by Cav09
This special page shows all uploaded files.
| Date | Name | Thumbnail | Size | Description | Versions |
|---|---|---|---|---|---|
| 22:45, 25 November 2013 | MoS2-5 Summary.PNG (file) |  |
54 KB | 1 | |
| 22:40, 25 November 2013 | MoS2-3&4 Summary.PNG (file) |  |
42 KB | 1 | |
| 14:32, 11 November 2011 | DA TS 1 OPT FREEZECOORD AM1 P2 3 MO.LOG (file) |  |
19 KB | 1 | |
| 14:22, 11 November 2011 | DA TS1 lowest+ movie.gif (file) |  |
1.1 MB | 1 | |
| 14:09, 11 November 2011 | DA TS1 Jmol.mol (file) | |
2 KB | 1 | |
| 14:05, 11 November 2011 | DA CISBUTADIENE OPT AM1 MO 2.LOG (file) | |
32 KB | 1 | |
| 14:02, 11 November 2011 | DA ALKENE OPT MO.LOG (file) | |
11 KB | 1 | |
| 14:01, 11 November 2011 | DA ethene LUMO.gif (file) |  |
746 KB | 1 | |
| 14:00, 11 November 2011 | DA ethene HOMO.gif (file) |  |
576 KB | 1 | |
| 13:54, 11 November 2011 | Cope anti 2 opt+freq output.out (file) | |
231 KB | 1 | |
| 13:49, 11 November 2011 | Cope ts boat opt+freq dft output.out (file) | |
257 KB | 1 | |
| 13:34, 11 November 2011 | Cope TS Boat IRC2 movie.gif (file) |  |
303 KB | 1 | |
| 13:33, 11 November 2011 | COPE TS BOAT IRC 1.LOG (file) | |
266 KB | 2 | |
| 13:24, 11 November 2011 | Cope ts chair unfreeze coord opt+freq output.out (file) | |
184 KB | 1 | |
| 13:21, 11 November 2011 | Cope ts chair frozen imagfreq image.gif (file) |  |
268 KB | 1 | |
| 13:04, 11 November 2011 | Cope ts chair Hessian Jmol.mol (file) | |
2 KB | 1 | |
| 12:28, 11 November 2011 | DA2 exo HOMO1 image.gif (file) |  |
339 KB | 2 | |
| 12:27, 11 November 2011 | DA2 exo LUMO image.gif (file) |  |
319 KB | 2 | |
| 11:57, 11 November 2011 | DA2 endo HOMO1 image.gif (file) |  |
284 KB | 1 | |
| 11:56, 11 November 2011 | DA2 endo LUMO image.gif (file) |  |
344 KB | 1 | |
| 11:55, 11 November 2011 | DA2 exo LUMO2 image.gif (file) |  |
358 KB | 1 | |
| 11:54, 11 November 2011 | DA2 exo jmol.mol (file) | |
2 KB | 1 | |
| 11:53, 11 November 2011 | DA2 exo imagfreq movie.gif (file) |  |
514 KB | 2 | |
| 11:53, 11 November 2011 | DA2 endo imagfreq movie.gif (file) |  |
585 KB | 2 | |
| 11:52, 11 November 2011 | DA2 EXO AM1 UNFREEZE OPT 1.LOG (file) | |
492 KB | 1 | |
| 11:51, 11 November 2011 | DA2 ENDO AM1 UNFREEZE NEW OPT 1.LOG (file) | |
510 KB | 1 | |
| 11:44, 11 November 2011 | DA2 ENDO AM1QST2 OPT 4.LOG (file) | |
2 MB | 1 | |
| 11:43, 11 November 2011 | DA2 endo numbering 4.gjf (file) | |
3 KB | 1 | |
| 11:24, 11 November 2011 | DA TS1 LUMO.gif (file) |  |
663 KB | 1 | |
| 11:24, 11 November 2011 | DA TS1 HOMO.gif (file) |  |
655 KB | 1 | |
| 10:06, 11 November 2011 | Cope ts boat opt+freq 2 output log 48687.out (file) | |
696 KB | 1 | |
| 10:04, 11 November 2011 | Cope ts chair Hessian opt+freq log 48647.out (file) | |
911 KB | 1 | |
| 09:56, 11 November 2011 | COPE CHAIR REOPTIMISED DFT OPT+FREQ.LOG (file) | |
150 KB | 1 | |
| 00:01, 11 November 2011 | Cope anti 2 IR Spectrum 298K.gif (file) |  |
96 KB | 1 | |
| 21:43, 10 November 2011 | Cope Reaction Scheme.gif (file) |  |
2 KB | 2 | |
| 21:31, 10 November 2011 | Cope sigmatropic shift scheme.gif (file) |  |
3 KB | 1 | |
| 19:18, 10 November 2011 | DA2 endo imagfreq movie 2.gif (file) |  |
1.78 MB | 1 | |
| 13:17, 10 November 2011 | DA TS1 imagfreq movie.gif (file) |  |
896 KB | 1 | |
| 13:03, 10 November 2011 | DA TS 1 OPT FREEZECOORD AM1 P2 3.chk (file) | |
1.53 MB | 1 | |
| 12:38, 10 November 2011 | DA TS 1 OPT FREEZECOORD HF 6 P2.chk (file) | |
1.13 MB | 1 | |
| 12:37, 10 November 2011 | DA TS 1 OPT FREEZECOORD AM1 6.LOG (file) | |
506 KB | 1 | |
| 11:40, 10 November 2011 | DA cisbutadiene LUMO.gif (file) |  |
456 KB | 1 | |
| 11:39, 10 November 2011 | DA cisbutadiene HOMO.gif (file) |  |
509 KB | 1 | |
| 09:59, 10 November 2011 | Cope ts boat irc step20 image.gif (file) |  |
44 KB | 1 | |
| 09:57, 10 November 2011 | COPE TS BOAT IRC STEP20 OPT jmol.mol (file) | |
2 KB | 1 | |
| 09:55, 10 November 2011 | Cope ts boat image.gif (file) |  |
61 KB | 1 | |
| 09:51, 10 November 2011 | Cope ts boat checkpoint.fchk (file) | |
184 KB | 1 | |
| 09:50, 10 November 2011 | COPE TS BOAT IRC STEP20 OPT.LOG (file) | |
206 KB | 1 | |
| 09:07, 10 November 2011 | COPE TS CHAIR HESSIAN OPT DFT.LOG (file) | |
164 KB | 1 | |
| 09:06, 10 November 2011 | Cope ts boat irc 2 output.out (file) | |
512 KB | 1 |
