Uploads by Df910
This special page shows all uploaded files.
| Date | Name | Thumbnail | Size | Description | Versions |
|---|---|---|---|---|---|
| 14:43, 20 February 2013 | BH3OPTIMISATION3.LOG (file) |  |
46 KB | BH3 B3LYP optimisaion | 1 |
| 15:18, 20 February 2013 | 631GDPBH3OPTIMISATION.LOG (file) | |
48 KB | BH3 6-31G(d,p) optimisation | 1 |
| 12:20, 21 February 2013 | BBr3 Gen Optimisation log.log (file) | |
49 KB | BBr3 Gen Optimisation .log | 1 |
| 18:02, 21 February 2013 | BH3 OPT 9.LOG (file) | |
47 KB | 1 | |
| 18:02, 21 February 2013 | BH3 OPT 9 631GDP.LOG (file) | |
31 KB | 1 | |
| 13:48, 22 February 2013 | BH3 321G 8px OPT.log (file) | |
46 KB | 1 | |
| 13:48, 22 February 2013 | BH3 631Gdp log again.log (file) | |
31 KB | 1 | |
| 14:00, 22 February 2013 | BH3 Freq 8px log.log (file) | |
25 KB | 1 | |
| 14:08, 22 February 2013 | BH3 calculated IR spectrum.png (file) |  |
24 KB | 1 | |
| 14:57, 22 February 2013 | NH3 631GDP OPT.LOG (file) | |
63 KB | 1 | |
| 15:20, 22 February 2013 | NH3 631GDP OPT2.LOG (file) | |
108 KB | 1 | |
| 15:25, 22 February 2013 | NH3 FREQ ANAL 2.LOG (file) | |
26 KB | 1 | |
| 15:28, 22 February 2013 | NH3 IR Spectrum.png (file) |  |
17 KB | 1 | |
| 13:14, 25 February 2013 | NH3BH3 IR Spectrum.PNG (file) |  |
31 KB | 1 | |
| 13:14, 25 February 2013 | NH3BH3 321G OPT.LOG (file) | |
90 KB | 2 | |
| 13:14, 25 February 2013 | NH3BH3 6-31GDP FREQ2.LOG (file) | |
37 KB | 1 | |
| 13:14, 25 February 2013 | NH3BH3 6-31GDP OPT2.LOG (file) | |
44 KB | 1 | |
| 13:20, 25 February 2013 | NH3BH3 IR overview.PNG (file) |  |
13 KB | 1 | |
| 17:04, 26 February 2013 | TlBr3 Ir Spectrum.PNG (file) |  |
35 KB | 1 | |
| 14:32, 27 February 2013 | Mo diagram2.png (file) |  |
444 KB | 1 | |
| 14:55, 27 February 2013 | NH3 NBO colour analysis +-1.125.PNG (file) |  |
23 KB | 1 | |
| 14:55, 27 February 2013 | NH3 631GDP MO CALC.LOG (file) | |
28 KB | 1 | |
| 17:30, 27 February 2013 | Isomer picture.png (file) |  |
23 KB | 1 | |
| 17:33, 27 February 2013 | Isomer picture 2.png (file) |  |
22 KB | 1 | |
| 18:14, 27 February 2013 | Cis-pic.png (file) |  |
16 KB | 1 | |
| 18:43, 27 February 2013 | Br2AlCl2AlBr2 pic.png (file) |  |
12 KB | 1 | |
| 18:43, 27 February 2013 | Br2AlClBrAlBrCl pic.png (file) |  |
12 KB | 1 | |
| 18:43, 27 February 2013 | Trans-ClBrAlBr2AlClBr.png (file) |  |
12 KB | 1 | |
| 12:48, 28 February 2013 | AlCl2Br GEN OPT LOG.log (file) | |
80 KB | 1 | |
| 16:14, 28 February 2013 | Br2AlCl2AlBr2 IR spectrum.PNG (file) |  |
35 KB | 1 | |
| 17:49, 28 February 2013 | Cis ClBrAlBr2AlClBr IRSPECTRUM.PNG (file) |  |
36 KB | 1 | |
| 19:33, 28 February 2013 | Trans-ClBrAlBr2AlClBr IRSPECTRUM.PNG (file) |  |
37 KB | 1 | |
| 20:45, 28 February 2013 | Br2AlClBrAlBrCl IR Spectrum.PNG (file) |  |
33 KB | 1 | |
| 12:20, 1 March 2013 | MO10 (Bonding).PNG (file) | .PNG) |
134 KB | 1 | |
| 12:20, 1 March 2013 | MO14 (B and AB).PNG (file) | .PNG) |
159 KB | 1 | |
| 12:20, 1 March 2013 | MO16 (AB).PNG (file) | .PNG) |
177 KB | 1 | |
| 12:20, 1 March 2013 | MO16 (AB)TOP.PNG (file) | TOP.PNG) |
106 KB | 1 | |
| 12:20, 1 March 2013 | MO17 (B) TOP.PNG (file) | _TOP.PNG) |
107 KB | 1 | |
| 12:20, 1 March 2013 | MO17 (B).PNG (file) | .PNG) |
128 KB | 1 | |
| 12:20, 1 March 2013 | MO21 (NB).PNG (file) | .PNG) |
124 KB | 1 | |
| 12:20, 1 March 2013 | MO21 (NB) TOP.PNG (file) | _TOP.PNG) |
106 KB | 1 | |
| 12:20, 1 March 2013 | MO14(B and AB)TOP.PNG (file) | TOP.PNG) |
121 KB | 1 | |
| 13:14, 1 March 2013 | MO10 (Bonding) nodes.png (file) | _nodes.png) |
85 KB | 1 | |
| 13:14, 1 March 2013 | MO14 (B and AB)Nodes.png (file) | Nodes.png) |
95 KB | 1 | |
| 13:14, 1 March 2013 | MO16 (AB)TOPnodes.png (file) | TOPnodes.png) |
71 KB | 1 | |
| 13:14, 1 March 2013 | MO16 (AB)nodes.png (file) | nodes.png) |
111 KB | 1 | |
| 13:14, 1 March 2013 | MO17 (B) TOP nodes.png (file) | _TOP_nodes.png) |
69 KB | 1 | |
| 13:14, 1 March 2013 | MO21 (NB) TOP nodes.png (file) | _TOP_nodes.png) |
67 KB | 1 | |
| 13:42, 1 March 2013 | NH3 631GDP MO Calc.chk (file) | |
616 KB | 1 | |
| 15:14, 1 March 2013 | BH3 opt pic.PNG (file) |  |
42 KB | 1 |
