Uploads by Ac4515
This special page shows all uploaded files.
| Date | Name | Thumbnail | Size | Description | Versions |
|---|---|---|---|---|---|
| 21:05, 5 December 2017 | Comp vs lit QH.png (file) |  |
41 KB | 1 | |
| 19:47, 5 December 2017 | QH temp vs vol correct.png (file) |  |
33 KB | 1 | |
| 18:41, 5 December 2017 | QH vol vs temp .png (file) |  |
32 KB | 1 | |
| 18:33, 5 December 2017 | Free energy vs temp QH.png (file) |  |
34 KB | 1 | |
| 17:34, 5 December 2017 | Quasiharmoniceq.png (file) |  |
20 KB | 1 | |
| 16:17, 5 December 2017 | Variation of freeE with grid size 300K.png (file) |  |
24 KB | 1 | |
| 15:50, 5 December 2017 | 28x28x28 DOS.PNG (file) |  |
13 KB | 1 | |
| 22:31, 4 December 2017 | 40x40x40 density of states.PNG (file) |  |
11 KB | 1 | |
| 22:20, 4 December 2017 | 20x20x20 DOS.PNG (file) |  |
12 KB | 1 | |
| 22:20, 4 December 2017 | 5x5x5 density of states.PNG (file) |  |
18 KB | 1 | |
| 22:17, 4 December 2017 | 3x3x3 denisity of states.PNG (file) |  |
17 KB | 1 | |
| 22:14, 4 December 2017 | 1x1x1 density of states.PNG (file) |  |
17 KB | 2 | |
| 15:21, 4 December 2017 | 1x1x1 DOS correct.PNG (file) |  |
13 KB | 1 | |
| 15:12, 4 December 2017 | 50 kpoint dispersion curve.PNG (file) |  |
14 KB | 1 | |
| 16:56, 18 May 2017 | F+H2. PotEvstime-correct-1.png (file) |  |
12 KB | 1 | |
| 16:40, 18 May 2017 | H2+F. PotEvstime-correct-1.png (file) |  |
13 KB | 1 | |
| 15:53, 18 May 2017 | Internucleardistances time -H2 +F.PNG (file) |  |
18 KB | 1 | |
| 15:29, 18 May 2017 | Exo surface plot H2+F.PNG (file) |  |
100 KB | 1 | |
| 15:21, 18 May 2017 | H2+F. PotEvstime-correct.png (file) |  |
40 KB | 2 | |
| 14:55, 18 May 2017 | H2 +F- rts.png (file) |  |
82 KB | 1 | |
| 12:27, 18 May 2017 | P1=-1.25, p2=-2.5.png (file) |  |
99 KB | 1 | |
| 12:26, 18 May 2017 | P1=-2.5, p2=-5.0.png (file) |  |
100 KB | 1 | |
| 12:25, 18 May 2017 | P1=-2.5, p2=-5.2.png (file) |  |
100 KB | 1 | |
| 12:24, 18 May 2017 | P1=-1.5, p2=-2.5.png (file) |  |
96 KB | 1 | |
| 12:18, 18 May 2017 | P1=-1.5, p2=-2.0.png (file) |  |
95 KB | 1 | |
| 14:41, 16 May 2017 | Dynamics- H2.png (file) |  |
98 KB | 1 | |
| 14:37, 16 May 2017 | Mep- H2 +H.png (file) |  |
95 KB | 1 | |
| 13:51, 16 May 2017 | H2+H distances vs time.png (file) |  |
43 KB | 1 | |
| 16:05, 4 March 2016 | AC HBr vibrations.png (file) |  |
14 KB | 1 | |
| 16:01, 4 March 2016 | AC HBR OPTIMISATION.LOG (file) |  |
245 KB | 1 | |
| 15:38, 3 March 2016 | AC HCl orbitals 7.real.png (file) |  |
36 KB | 2 | |
| 15:36, 3 March 2016 | AC HCl orbitals 10.real.png (file) |  |
38 KB | 1 | |
| 15:33, 3 March 2016 | AC HCl orbitals 8.real.png (file) |  |
35 KB | 1 | |
| 15:28, 3 March 2016 | AC HCl orbitals 6.real.png (file) |  |
37 KB | 1 | |
| 15:26, 3 March 2016 | AC HCl orbitals 1.real.png (file) |  |
31 KB | 1 | |
| 15:06, 3 March 2016 | AC HCl Orbital 6.png (file) |  |
37 KB | 1 | |
| 15:05, 3 March 2016 | AC HCl Orbital 2.png (file) |  |
27 KB | 1 | |
| 15:04, 3 March 2016 | AC HCl Orbital 10.png (file) |  |
49 KB | 1 | |
| 15:11, 1 March 2016 | AC HCl Charges.png (file) |  |
17 KB | 1 | |
| 15:05, 1 March 2016 | AC HCl optimisation.png (file) |  |
15 KB | 1 | |
| 15:02, 1 March 2016 | AC HCL OPTIMISATION.LOG (file) | |
149 KB | 1 | |
| 16:20, 29 February 2016 | AC N2 vibrations.png (file) |  |
20 KB | 1 | |
| 16:16, 29 February 2016 | AC H2 vibrations.png (file) |  |
21 KB | 1 | |
| 16:12, 29 February 2016 | AC H2 OPTIMISATION.LOG (file) | |
95 KB | 1 | |
| 16:08, 29 February 2016 | AC N2 OPTIMISATION.LOG (file) | |
205 KB | 2 | |
| 15:25, 29 February 2016 | AC N2 molecule.PNG (file) |  |
18 KB | 1 | |
| 16:24, 22 February 2016 | Display vibrations nh3 opt.png (file) |  |
16 KB | 1 | |
| 16:03, 22 February 2016 | AC NH3 OPTF POP.LOG (file) | |
228 KB | 3 | |
| 16:01, 22 February 2016 | AC nh3 optf pop.gjf (file) | |
432 bytes | 1 | |
| 16:01, 22 February 2016 | AC nh3 optf pop.chk (file) | |
696 KB | 1 |
