Uploads by Sds111
This special page shows all uploaded files.
| Date | Name | Thumbnail | Size | Description | Versions |
|---|---|---|---|---|---|
| 15:30, 17 March 2014 | 124225HOMOView5.png (file) |  |
546 KB | 1 | |
| 15:30, 17 March 2014 | 124225HOMOView4.png (file) |  |
505 KB | 1 | |
| 15:15, 17 March 2014 | TSCALC BERNY DA HF 321G V5.LOG (file) |  |
971 KB | 1 | |
| 15:13, 17 March 2014 | 124225outputDAts.png (file) |  |
66 KB | 1 | |
| 15:13, 17 March 2014 | 124225inputDAts.png (file) |  |
62 KB | 4 | |
| 14:14, 17 March 2014 | 124225cisbutadienelumo.png (file) |  |
39 KB | 1 | |
| 14:08, 17 March 2014 | 124225cisbutadiene.png (file) |  |
363 KB | 1 | |
| 14:07, 17 March 2014 | CISBUTADIENE OPT HF 3-21G.LOG (file) | |
83 KB | 1 | |
| 14:06, 17 March 2014 | CISBUTADIENE OPT B3LYP 6-31GD.LOG (file) | |
72 KB | 1 | |
| 22:56, 15 March 2014 | OPTOFLASTOFIRCOPTFREQ.LOG (file) | |
213 KB | 1 | |
| 22:26, 15 March 2014 | Atomsnumbered124225.png (file) |  |
135 KB | 1 | |
| 22:10, 15 March 2014 | Partc .log (file) | |
778 KB | 1 | |
| 22:07, 15 March 2014 | Partb .LOG (file) | |
295 KB | 1 | |
| 16:40, 15 March 2014 | MovieofIRC.gif (file) |  |
311 KB | 2 | |
| 14:50, 14 March 2014 | Chair .LOG (file) | |
157 KB | 1 | |
| 14:48, 14 March 2014 | Chair b3lyp.LOG (file) | |
735 KB | 1 | |
| 14:17, 14 March 2014 | 631G calc for chair.mol2 (file) | |
1,019 bytes | 1 | |
| 14:13, 14 March 2014 | Boat b3lyp.LOG (file) | |
210 KB | 1 | |
| 14:12, 14 March 2014 | 631G CALC FOR BOAT.LOG (file) | |
210 KB | 1 | |
| 14:09, 14 March 2014 | Boat .LOG (file) | |
570 KB | 1 | |
| 13:48, 14 March 2014 | Abc.mol (file) | |
1.24 MB | 1 | |
| 13:46, 14 March 2014 | Anti2 b3lyp.LOG (file) | |
294 KB | 1 | |
| 13:21, 14 March 2014 | 124225anti2bonddistance.png (file) |  |
67 KB | 1 | |
| 13:17, 14 March 2014 | 124225afteroptoflastofircbonds.png (file) |  |
80 KB | 1 | |
| 12:57, 14 March 2014 | Anti2B3LYP .LOG (file) | |
294 KB | 3 | |
| 12:45, 14 March 2014 | 124225afteroptoflastofirc.png (file) |  |
77 KB | 1 | |
| 09:07, 14 March 2014 | 124225vibrationat840v3.gif (file) |  |
512 KB | 2 | |
| 15:08, 13 March 2014 | 124225 TS GUESS.LOG (file) | |
383 KB | 1 | |
| 14:06, 13 March 2014 | IRCCALC70STEP.LOG (file) | |
547 KB | 1 | |
| 13:30, 13 March 2014 | Irccalclaststructure2.png (file) |  |
403 KB | 1 | |
| 13:30, 13 March 2014 | Irccalclaststructure.png (file) |  |
576 KB | 1 | |
| 11:34, 13 March 2014 | 124225numberedatoms.png (file) |  |
167 KB | 1 | |
| 11:18, 13 March 2014 | 124225vibrationat840v2.gif (file) |  |
1.85 MB | 1 | |
| 11:15, 13 March 2014 | Vibration840.gif (file) |  |
4.71 MB | 1 | |
| 11:14, 13 March 2014 | 124225vibrationat840.gif (file) |  |
4.71 MB | 1 | |
| 15:27, 11 March 2014 | 124225parteboatview2.png (file) |  |
204 KB | 1 | |
| 15:25, 11 March 2014 | 124225parteboat.png (file) |  |
215 KB | 1 | |
| 14:02, 11 March 2014 | 124225partc.png (file) |  |
123 KB | 1 | |
| 13:46, 11 March 2014 | 124225optimisedchairTS1irspectrum.svg (file) |  |
28 KB | 1 | |
| 13:44, 11 March 2014 | 124225optimisedchairTS1.png (file) |  |
379 KB | 1 | |
| 13:43, 11 March 2014 | 124225optimisedchairTS1view2.png (file) |  |
369 KB | 1 | |
| 13:31, 11 March 2014 | 124225tsguess818v2.gif (file) |  |
727 KB | 1 | |
| 13:28, 11 March 2014 | 124225tsguess818.gif (file) |  |
1.53 MB | 1 | |
| 13:25, 11 March 2014 | Ts chair guess imagvibat818.gif (file) |  |
1.53 MB | 1 | |
| 13:25, 11 March 2014 | 124225optimisedallylfragment.png (file) |  |
405 KB | 1 | |
| 15:20, 10 March 2014 | 1718 32.gif (file) |  |
260 KB | 1 | |
| 15:20, 10 March 2014 | 1537 29.gif (file) |  |
258 KB | 1 | |
| 15:14, 10 March 2014 | 124225IRspectrumanti2.svg (file) |  |
28 KB | 1 | |
| 14:52, 10 March 2014 | 124225anti2view2.png (file) |  |
63 KB | 1 | |
| 14:52, 10 March 2014 | 124225anti2b3lypview2.png (file) |  |
67 KB | 1 |
