Pinned

1. aims_DosBand aims_DosBand Public

   Plot Band structure and DOS from FHI-aims outputfiles via xmgrace.

   Shell 1 1

2. fhi2xsf fhi2xsf Public

   visualizing FHI-aims geometry.in via xcrysden

   Shell 2 1

3. bestoon bestoon Public archive

   JavaScript 2

4. elk2xsf elk2xsf Public

   visualizing elk.in (input file for elk, a dft code) via xcrysden

   Shell 1

5. gaussian-grep gaussian-grep Public

   some linux shell script for grepping data from gaussian output

   Shell 3 1

6. gaussian-hyperpolarizability-grep gaussian-hyperpolarizability-grep Public

   extracting hyperpolarizability components from Gaussian 09 output

   Shell 2