Uploads by Rgarcia
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This special page shows all uploaded files.
| Date | Name | Thumbnail | Size | Description | Versions |
|---|---|---|---|---|---|
| 17:31, 10 July 2012 | Xcrysden.tgz (file) |  |
12 KB | tar gz | 2 |
| 12:44, 18 November 2014 | Dimerdiag.tgz (file) | |
56 KB | To use with the script "getdimer" It takes the Hessian matrix from an OUTCAR file, symmetrized it, and diagonalizes it without doing the mass-weighting procedure. Source code included. It requires LaPack to be compiled. | 1 |
| 16:42, 20 November 2014 | Breaker.tgz (file) | |
260 KB | 1 | |
| 13:08, 28 February 2019 | Feff85exafs-master.tgz (file) | |
37 MB | Feff file already compiled and working. | 1 |
| 12:23, 29 October 2019 | Palettes.tgz (file) | |
8 KB | Colour palettes for Origin. | 1 |
| 17:23, 4 April 2022 | Mk-maple.tgz (file) | |
4 KB | Toy example of a microkinetic model done in Maple | 1 |