Uploads by Jt2010
This special page shows all uploaded files.
| Date | Name | Thumbnail | Size | Description | Versions |
|---|---|---|---|---|---|
| 18:11, 1 November 2012 | Log 65175.log (file) |  |
791 KB | 1 | |
| 18:11, 1 November 2012 | Diels TS.JPG (file) |  |
24 KB | 1 | |
| 18:09, 1 November 2012 | Diels optfreq product.JPG (file) |  |
24 KB | 1 | |
| 17:06, 1 November 2012 | Butadiene opt AM1.mol (file) | |
1,008 bytes | 2 | |
| 17:03, 1 November 2012 | Butadiene opt AM1 LUMO.JPG (file) |  |
20 KB | 1 | |
| 17:02, 1 November 2012 | Butadiene opt AM1 HOMO.JPG (file) |  |
20 KB | 1 | |
| 16:46, 1 November 2012 | Butadiene opt AM1 summary.JPG (file) |  |
30 KB | 1 | |
| 14:40, 1 November 2012 | Chair IRC gradient.JPG (file) |  |
84 KB | 1 | |
| 14:37, 1 November 2012 | Boat freq 6-31G summary.JPG (file) |  |
25 KB | 1 | |
| 14:37, 1 November 2012 | BOAT FREQ 6-31G.LOG (file) | |
80 KB | 1 | |
| 14:15, 1 November 2012 | CHair opt 6-31G summary.JPG (file) |  |
33 KB | 1 | |
| 14:11, 1 November 2012 | CHAIR OPTFREQ 6-31G.LOG (file) | |
79 KB | 1 | |
| 13:29, 1 November 2012 | Chair irc4 gradient.JPG (file) |  |
95 KB | 1 | |
| 13:28, 1 November 2012 | Chair irc4 energy.JPG (file) |  |
71 KB | 1 | |
| 13:23, 1 November 2012 | Log 65092.log (file) | |
457 KB | 1 | |
| 13:23, 1 November 2012 | Chair IRC output4.gif (file) |  |
627 KB | 1 | |
| 12:44, 1 November 2012 | Chair IRC energypath.JPG (file) |  |
72 KB | 1 | |
| 12:40, 1 November 2012 | Chair IRC output.gif (file) |  |
627 KB | 1 | |
| 12:38, 1 November 2012 | Chair IRC output.log (file) | |
455 KB | 1 | |
| 00:42, 1 November 2012 | Chair redunandance3 summary.JPG (file) |  |
33 KB | 3 | |
| 00:37, 1 November 2012 | CHAIR REDUNANDANCE3.LOG (file) | |
520 KB | 1 | |
| 00:37, 1 November 2012 | Chair redunandance3.JPG (file) |  |
25 KB | 1 | |
| 00:30, 1 November 2012 | Chair opt redundance3 part2 summary.JPG (file) |  |
32 KB | 2 | |
| 00:29, 1 November 2012 | Chair opt redundance3 part2.JPG (file) |  |
24 KB | 1 | |
| 00:29, 1 November 2012 | CHAIR REDUNANDANCE3 PART2.LOG (file) | |
278 KB | 1 | |
| 00:06, 1 November 2012 | Boat qst2 angled2 freq.JPG (file) |  |
12 KB | 1 | |
| 00:01, 1 November 2012 | Boat Qst2 angled2 summary.JPG (file) |  |
31 KB | 2 | |
| 23:57, 31 October 2012 | Boat Qst2 angled summary.JPG (file) |  |
25 KB | 2 | |
| 23:57, 31 October 2012 | Boat Qst2 angled2.JPG (file) |  |
25 KB | 1 | |
| 23:57, 31 October 2012 | BOAT QST2 ANGLED2.LOG (file) | |
610 KB | 1 | |
| 23:45, 31 October 2012 | Boat Qst2 angled.JPG (file) |  |
23 KB | 1 | |
| 23:33, 31 October 2012 | BOAT QST2.LOG (file) | |
543 KB | 1 | |
| 23:17, 31 October 2012 | Boat angles changed.JPG (file) |  |
22 KB | 1 | |
| 23:03, 31 October 2012 | Boat QSt2 before optimization.JPG (file) |  |
19 KB | 1 | |
| 22:58, 31 October 2012 | Boat Qst2 summary.JPG (file) |  |
30 KB | 1 | |
| 22:55, 31 October 2012 | Boat QST2.JPG (file) |  |
26 KB | 1 | |
| 20:32, 31 October 2012 | Chair opt redundant summary.JPG (file) |  |
29 KB | 1 | |
| 20:31, 31 October 2012 | CHAIR OPT REDUNDANT.LOG (file) | |
520 KB | 1 | |
| 18:23, 31 October 2012 | Chair optfreq.mol (file) | |
2 KB | 1 | |
| 18:14, 31 October 2012 | Chair ts guess.gjf (file) | |
1 KB | 1 | |
| 18:13, 31 October 2012 | Chair optfreq 818freq.JPG (file) |  |
17 KB | 1 | |
| 18:12, 31 October 2012 | Chair optfreq summary.JPG (file) |  |
29 KB | 1 | |
| 18:11, 31 October 2012 | CHAIR OPTFREQ.LOG (file) | |
698 KB | 1 | |
| 17:40, 31 October 2012 | Ally HF opt.mol (file) | |
812 bytes | 1 | |
| 17:37, 31 October 2012 | Ally HF opt summary.JPG (file) |  |
30 KB | 1 | |
| 17:35, 31 October 2012 | ALLY HF OPT.LOG (file) | |
35 KB | 1 | |
| 23:25, 30 October 2012 | REACT DFT FREQ.LOG (file) | |
79 KB | 1 | |
| 23:12, 30 October 2012 | React DFT freq summary.JPG (file) |  |
33 KB | 1 | |
| 22:47, 30 October 2012 | REACT DFT.LOG (file) | |
141 KB | 1 | |
| 22:47, 30 October 2012 | React DFT.JPG (file) |  |
31 KB | 1 |
