Skip to content
Snippets Groups Projects
  1. Sep 23, 2021
    • Philipp Rüssmann's avatar
      Write G_LL'(k,E) to npy files · 38dbc4cf
      Philipp Rüssmann authored
      Works only for the Chebychev solver and for this combination of inputs:
      
      <use_chebychev_solver>=  T # requires Chebychev solver
      <calc_gmat_lm_full>= T     # activates computation of the full Gmat
      <gflle_to_npy>=  T         # switch from writing a fortran file (gflle) to numpy npy files for each atom and energy
      <use_qdos>=  T             # optional, use qvecs from qdos mode for k-points
      
      This version is still experimental.
      38dbc4cf
  2. Aug 10, 2021
  3. Aug 09, 2021
  4. Jul 21, 2021
  5. May 28, 2021
  6. May 05, 2021
  7. May 04, 2021
  8. Apr 28, 2021
  9. Mar 29, 2021
  10. Jan 26, 2021
  11. Jan 25, 2021
  12. Jan 21, 2021
  13. Jan 20, 2021
Loading