Uploads by Klw14
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Date | Name | Thumbnail | Size | Description | Versions |
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10:46, 3 November 2016 | Nose-Hoover 0.0005.png (file) | ![]() |
456 KB | 1 | |
10:44, 3 November 2016 | Nose-Hoover 0.005.png (file) | ![]() |
84 KB | 1 | |
10:44, 3 November 2016 | MD berendsen energy.png (file) | ![]() |
239 KB | 1 | |
13:48, 19 October 2016 | MD berendsen energy plot.tiff (file) | ![]() |
33 KB | 3 | |
13:07, 19 October 2016 | MD Hoover energy plot.tiff (file) | ![]() |
23 KB | 1 | |
16:11, 15 August 2016 | NaCl packmol 1000K-NPT scale100 energy.tiff (file) | ![]() |
23 KB | 1 | |
16:10, 15 August 2016 | NaCl packmol 1000K-NPT scale10000 energy.tiff (file) | ![]() |
24 KB | 1 | |
16:07, 15 August 2016 | NaCl packmol 1000K energy.tiff (file) | ![]() |
29 KB | 1 | |
11:30, 16 February 2016 | Jmol error.png (file) | ![]() |
19 KB | 1 | |
11:22, 16 February 2016 | Jmol error.tiff (file) | ![]() |
19 KB | 1 | |
14:04, 5 February 2016 | N2 vibrational details.png (file) | ![]() |
16 KB | 1 | |
13:53, 5 February 2016 | H2 Vibrational Details.png (file) | ![]() |
15 KB | 1 | |
11:52, 5 February 2016 | NH3 Display Vibrations.gif (file) | ![]() |
55 KB | 1 | |
11:39, 5 February 2016 | Nh3 optf pop.mol2 (file) | ![]() |
365 bytes | 1 | |
11:05, 7 August 2015 | YCl4-Na2 opt com.jpg (file) | ![]() |
27 KB | 1 | |
10:51, 29 July 2015 | Pentagon.jpg (file) | ![]() |
7 KB | 1 | |
10:50, 29 July 2015 | Building-Pentagon.jpg (file) | ![]() |
13 KB | 1 | |
10:39, 29 July 2015 | Building pentagon.jpg (file) | ![]() |
13 KB | 1 | |
11:09, 28 July 2015 | YCl-Z-Cartesian.tiff (file) | ![]() |
38 KB | Fig 4: YCl4Na using both Cartesian and Z-matrix | 1 |
11:03, 28 July 2015 | NH3-Z-V-C.tiff (file) | ![]() |
19 KB | Fig 1: NH3 Z-Matrix with variables and bond lengths frozen | 1 |
11:02, 28 July 2015 | NH3-Z-V.tiff (file) | ![]() |
19 KB | Fig 1: NH3 Z-Matrix with variables | 1 |
11:01, 28 July 2015 | NH3-Z.tiff (file) | ![]() |
17 KB | Fig 1: Basic NH3 Z-Matrix | 1 |
10:32, 28 July 2015 | NH3 Z-matrix.tiff (file) | ![]() |
46 KB | Fig 1: NH3 basic z-matrix | 1 |