Uploads by Wyc08
This special page shows all uploaded files.
| Date | Name | Thumbnail | Size | Description | Versions |
|---|---|---|---|---|---|
| 12:04, 22 March 2011 | Cope rearrangement mech.png (file) |  |
6 KB | 1 | |
| 16:56, 21 March 2011 | Chair ts guess(d)novib.png (file) | novib.png) |
24 KB | 1 | |
| 16:40, 21 March 2011 | Chair ts guess(c)novib.png (file) | novib.png) |
24 KB | 1 | |
| 16:35, 21 March 2011 | Chair ts guess(b)novib.png (file) | novib.png) |
24 KB | 1 | |
| 16:29, 21 March 2011 | Chair ts guess(b).png (file) | .png) |
21 KB | 1 | |
| 10:35, 21 March 2011 | REACT GAUCHE OPTIMISATION(GAUCHE3).LOG (file) |  |
245 KB | 1 | |
| 10:35, 21 March 2011 | React gauche optimisation(gauche3).mol (file) | |
2 KB | 1 | |
| 10:11, 21 March 2011 | REACT ANTI OPTIMISATION(ANTI1).LOG (file) | |
246 KB | 1 | |
| 10:08, 21 March 2011 | React anti optimisation(anti1).mol (file) | |
2 KB | 1 | |
| 18:33, 20 March 2011 | React anti optimisation(anti2DFT) label atoms.png (file) | _label_atoms.png) |
19 KB | 1 | |
| 17:49, 20 March 2011 | REAC ANTI OPTIMISATION (ANTI2DFT631G) FREQ.LOG (file) | |
79 KB | 1 | |
| 17:27, 20 March 2011 | Reac anti optimisation (DFT631G).mol (file) | |
2 KB | 1 | |
| 17:27, 20 March 2011 | React anti optimisation(anti2).mol (file) | |
2 KB | 1 | |
| 13:49, 20 March 2011 | Summaries.png (file) |  |
16 KB | 1 | |
| 15:24, 15 March 2011 | HOMO-1.png (file) |  |
65 KB | 5 | |
| 15:23, 15 March 2011 | N(SiH3)3 opt 3rd trial 6-31g(d,p) MO.fchk (file) | |
353 KB | 1 | |
| 15:22, 15 March 2011 | LUMO+1.png (file) |  |
69 KB | 2 | |
| 15:20, 15 March 2011 | HOMO-2.png (file) |  |
72 KB | 2 | |
| 14:49, 15 March 2011 | Nbod.png (file) |  |
19 KB | 1 | |
| 14:42, 15 March 2011 | Nbo.png (file) |  |
11 KB | 1 | |
| 14:34, 15 March 2011 | Numbers.png (file) |  |
27 KB | 1 | |
| 14:32, 15 March 2011 | Atoms colour change.png (file) |  |
24 KB | 1 | |
| 11:06, 15 March 2011 | N(SiH3)3 opt 3rd trial 6-31g(d,p).mol (file) | |
1 KB | 1 | |
| 11:03, 15 March 2011 | P(SiH3)3 opt 6-31g(d,p).mol (file) | |
1 KB | 1 | |
| 10:59, 15 March 2011 | P(CH3)3 opt 6-31g(d,p).mol (file) | |
1 KB | 1 | |
| 10:57, 15 March 2011 | N(CH3)3 opt 6-31g(d,p) 2nd trial.mol (file) | |
1 KB | 1 | |
| 22:10, 14 March 2011 | WYC08 TLBR3 FREQ.LOG (file) | |
119 KB | 1 | |
| 22:09, 14 March 2011 | WYC08 BH3 FREQ.LOG (file) | |
44 KB | 1 | |
| 17:42, 14 March 2011 | Trans vib 2.png (file) |  |
28 KB | 2 | |
| 17:41, 14 March 2011 | Trans vib 1.png (file) |  |
27 KB | 2 | |
| 17:38, 14 March 2011 | Cis vib 17.png (file) |  |
27 KB | 1 | |
| 17:36, 14 March 2011 | Cis vib 11.png (file) |  |
27 KB | 1 | |
| 16:21, 14 March 2011 | Trans optimisation new job.mol (file) | |
2 KB | 1 | |
| 16:20, 14 March 2011 | Cis optimisation new job.mol (file) | |
2 KB | 1 | |
| 16:19, 14 March 2011 | Cis optimisation new job.out (file) | |
155 KB | 1 | |
| 16:19, 14 March 2011 | Trans optimisation new job.out (file) | |
213 KB | 1 | |
| 15:53, 14 March 2011 | Trans 2nd optimisation.out (file) | |
329 KB | 1 | |
| 15:53, 14 March 2011 | Cis 2nd optimisation.out (file) | |
655 KB | 1 | |
| 15:42, 14 March 2011 | Trans 2nd optimisation.mol (file) | |
2 KB | 1 | |
| 15:42, 14 March 2011 | Cis 2nd optimisation.mol (file) | |
1 KB | 1 | |
| 15:06, 14 March 2011 | Mo energies.png (file) |  |
5 KB | 1 | |
| 00:31, 14 March 2011 | Bh3 NBOcharges.png (file) |  |
24 KB | 1 | |
| 20:58, 13 March 2011 | MO diagram of BH3 +real.png (file) |  |
129 KB | 1 | |
| 20:54, 13 March 2011 | Bh3 modiagram1.gif (file) |  |
17 KB | 2 | |
| 20:31, 13 March 2011 | MO diagram of BH3.png (file) |  |
65 KB | 1 | |
| 17:16, 12 March 2011 | TlBr3 low frequencies.png (file) |  |
8 KB | 1 | |
| 17:16, 12 March 2011 | TlBr3 IR spectrum.png (file) |  |
15 KB | 2 | |
| 16:10, 12 March 2011 | Vib6.png (file) |  |
21 KB | 1 | |
| 16:09, 12 March 2011 | Vib5.png (file) |  |
22 KB | 1 | |
| 16:09, 12 March 2011 | Vib4.png (file) |  |
23 KB | 1 |
