Uploads by Ss2310
This special page shows all uploaded files.
| Date | Name | Thumbnail | Size | Description | Versions |
|---|---|---|---|---|---|
| 13:55, 8 October 2012 | Summary-results.png (file) |  |
14 KB | 1 | |
| 15:08, 8 October 2012 | BH3 animated molecule.gif (file) |  |
19 KB | 4 | |
| 15:27, 8 October 2012 | Animated BH3 molecule.gif (file) |  |
17 KB | 1 | |
| 15:41, 8 October 2012 | BH3 energy gradient plot.svg (file) |  |
16 KB | 1 | |
| 11:58, 9 October 2012 | Better basis set for optimised BH3.gjf (file) |  |
434 bytes | 2 | |
| 12:54, 9 October 2012 | BH3 molecule original.gjf (file) | |
443 bytes | 2 | |
| 12:58, 9 October 2012 | Results Table.png (file) |  |
39 KB | 1 | |
| 13:00, 9 October 2012 | Results Table BH3.PNG (file) |  |
17 KB | 1 | |
| 13:05, 9 October 2012 | Job convergence check.PNG (file) |  |
22 KB | 1 | |
| 13:21, 9 October 2012 | BH3 optimise test.png (file) |  |
43 KB | 1 | |
| 13:29, 9 October 2012 | Optimised BH3 molecule.gif (file) |  |
25 KB | 4 | |
| 13:33, 9 October 2012 | Vibrating BH3 molecule.gif (file) |  |
16 KB | 1 | |
| 13:37, 9 October 2012 | BH3 vibrations.gif (file) |  |
17 KB | 1 | |
| 13:50, 9 October 2012 | Total Energy plot.svg (file) |  |
17 KB | 1 | |
| 13:55, 9 October 2012 | Slower BH3 vibrations.gif (file) |  |
22 KB | 2 | |
| 13:57, 9 October 2012 | RMS Gradient Plot.svg (file) |  |
16 KB | 1 | |
| 14:08, 9 October 2012 | BH3 new basis set molecule.gif (file) |  |
6 KB | 1 | |
| 14:16, 9 October 2012 | Results Summary Table.PNG (file) |  |
14 KB | 1 | |
| 14:24, 9 October 2012 | Optimised bond length.gif (file) |  |
6 KB | 1 | |
| 14:27, 9 October 2012 | Optimised bond length.PNG (file) |  |
26 KB | 1 | |
| 14:30, 9 October 2012 | Item file.PNG (file) |  |
20 KB | 1 | |
| 14:32, 9 October 2012 | Optimised bond angle.PNG (file) |  |
26 KB | 2 | |
| 14:55, 9 October 2012 | TlBr3 restricted point group.gif (file) |  |
4 KB | 1 | |
| 14:59, 9 October 2012 | TlBr3 restricted symmetry.gif (file) |  |
7 KB | 1 | |
| 15:28, 9 October 2012 | TlBr3 optimised molecule.gif (file) |  |
7 KB | 1 | |
| 15:37, 9 October 2012 | TlBr3 Results Summary Table.PNG (file) |  |
14 KB | 1 | |
| 15:40, 9 October 2012 | TlBrs Item table.PNG (file) |  |
22 KB | 1 | |
| 15:45, 9 October 2012 | TlBr3 optimised bond length.PNG (file) |  |
27 KB | 1 | |
| 15:46, 9 October 2012 | TlBr3 optimised bond angle.PNG (file) |  |
26 KB | 1 | |
| 16:14, 9 October 2012 | BBr3 Gaussian text file.txt (file) |  |
554 bytes | 1 | |
| 16:25, 9 October 2012 | BBr3 Item Tables.PNG (file) |  |
24 KB | 1 | |
| 16:33, 9 October 2012 | BBr3 RMS Energy Gradient.svg (file) |  |
20 KB | 1 | |
| 16:33, 9 October 2012 | BBrs Total Energy Plot.svg (file) |  |
18 KB | 1 | |
| 16:35, 9 October 2012 | Creating a BBr3 molecule.gif (file) |  |
8 KB | 3 | |
| 16:37, 9 October 2012 | BBr3 Result Summary Table.PNG (file) |  |
17 KB | 1 | |
| 16:43, 9 October 2012 | BBr3 optimised bond length.PNG (file) |  |
27 KB | 1 | |
| 16:44, 9 October 2012 | Bbr3 optimised bond angle.PNG (file) |  |
26 KB | 1 | |
| 16:46, 9 October 2012 | BBr3 bond length optimisation.PNG (file) |  |
31 KB | 1 | |
| 16:47, 9 October 2012 | BBr3 bond angle optimisation.PNG (file) |  |
27 KB | 1 | |
| 10:38, 11 October 2012 | BH3 result summary.PNG (file) |  |
13 KB | 1 | |
| 11:10, 11 October 2012 | Optimising BH3 molecule to 6-31G.gjf (file) | |
466 bytes | 1 | |
| 11:11, 11 October 2012 | OPTIMISING BH3 MOLECULE TO 6-31G.LOG (file) | |
27 KB | 1 | |
| 11:16, 11 October 2012 | Results Summary 6-31G basis set.PNG (file) |  |
13 KB | 1 | |
| 11:28, 11 October 2012 | Item Table for 6-31G basis set.PNG (file) |  |
20 KB | 1 | |
| 13:15, 11 October 2012 | SS2310 FREQUENCY ANALYSIS BH3.LOG (file) | |
23 KB | 1 | |
| 15:19, 11 October 2012 | Ss2310 optimised BH3 Item File.txt (file) | |
47 KB | 1 | |
| 15:28, 11 October 2012 | Ss2310 newoptimising BH3 molecule.gjf (file) | |
434 bytes | 1 | |
| 15:32, 11 October 2012 | SS2310 NEWOPTIMISING BH3 MOLECULE.LOG (file) | |
20 KB | 1 | |
| 15:34, 11 October 2012 | Ss2310 optimised BH3 molecule.png (file) |  |
12 KB | 2 | |
| 15:42, 11 October 2012 | Ss2310 BH3 optimised bond length.PNG (file) |  |
27 KB | 1 |
