Uploads by Ac4515
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This special page shows all uploaded files.
Date | Name | Thumbnail | Size | Description | Versions |
---|---|---|---|---|---|
18:03, 10 February 2018 | Ac4515-endo-MO diagram.png (file) | ![]() |
219 KB | 1 | |
17:55, 10 February 2018 | Ac4515-exo-MO diagram.png (file) | ![]() |
213 KB | 1 | |
14:43, 10 February 2018 | Ac4515Alt-endo-irc.gif (file) | ![]() |
704 KB | 1 | |
14:37, 10 February 2018 | Ac4515Alt-exo-irc.gif (file) | ![]() |
670 KB | 1 | |
14:20, 10 February 2018 | Ac4515IRC-chelo.gif (file) | ![]() |
1.9 MB | 1 | |
14:15, 10 February 2018 | Ac4515IRC endo.gif (file) | ![]() |
1.05 MB | 1 | |
14:11, 10 February 2018 | IRC-exo-movie-better.gif (file) | ![]() |
1.38 MB | 1 | |
14:04, 10 February 2018 | Ac4515IRC-exo-movie.gif (file) | ![]() |
660 KB | 1 | |
16:15, 9 February 2018 | AC4515-ex-1-MO diagram.png (file) | ![]() |
173 KB | 1 | |
16:22, 8 February 2018 | Ac4515-endo-B3-TS-BERNY-POPGFULLPRINT.LOG (file) | ![]() |
2.34 MB | 1 | |
15:13, 8 February 2018 | Ac4515-exo-ex2-B3-TS-BERNY-3-POPGFULLPRINT.LOG (file) | ![]() |
2.34 MB | 1 | |
14:41, 8 February 2018 | Ac4515-ex2-EXO-B3-TS-BERNY-2.LOG (file) | ![]() |
465 KB | 1 | |
13:52, 8 February 2018 | AC4515TS-PM6-2ND.LOG (file) | ![]() |
342 KB | 1 | |
13:23, 8 February 2018 | AC4515PM6-BUTADIENE.LOG (file) | ![]() |
287 KB | 1 | |
11:50, 8 February 2018 | AC4515PM6-ETHENE-OPT.LOG (file) | ![]() |
122 KB | 1 | |
06:50, 6 December 2017 | K vector.png (file) | ![]() |
8 KB | 1 | |
06:00, 6 December 2017 | Thermal coefficient eq.png (file) | ![]() |
11 KB | 1 | |
05:03, 6 December 2017 | MD vs QHA- vol vs temp.png (file) | ![]() |
43 KB | 1 | |
04:59, 6 December 2017 | MD- vol vs temp .png (file) | ![]() |
31 KB | 1 | |
04:11, 6 December 2017 | Comp vs lit correct.png (file) | ![]() |
40 KB | 1 | |
04:10, 6 December 2017 | Comp vs exp QH correct.png (file) | ![]() |
43 KB | 2 | |
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 |