1. 05 Jul, 2022 1 commit
  2. 04 Jul, 2022 1 commit
    • Thomas Hellemans's avatar
      Improvement fsc_nr · 9df69651
      Thomas Hellemans authored
      ExactLdos.potential sorted according to pescado units, PescadoKwantProblem.depleted reset in each reduce() operation, builder.make_pescado_system such that interfaces for any layer thicknesses are respected, calibration_v2 adapted to different dielectric constants
      9df69651
  3. 01 Jul, 2022 1 commit
  4. 30 Jun, 2022 1 commit
  5. 29 Jun, 2022 2 commits
  6. 27 Jun, 2022 1 commit
  7. 24 Jun, 2022 2 commits
  8. 23 Jun, 2022 1 commit
  9. 17 Jun, 2022 2 commits
  10. 14 Jun, 2022 1 commit
    • Thomas Hellemans's avatar
      PescadoKwantProblem · 33a38243
      Thomas Hellemans authored
      Filtering flexible indices to set to neumann based on density and ldos instead of on potential + reduction kpm_system updated
      33a38243
  11. 13 Jun, 2022 1 commit
  12. 12 Jun, 2022 1 commit
  13. 10 Jun, 2022 1 commit
  14. 09 Jun, 2022 2 commits
  15. 03 Jun, 2022 1 commit
    • Thomas Hellemans's avatar
      reduction kwant/kpm + fork/mpi · 5f8cfe7a
      Thomas Hellemans authored
      Reduction of the kwant/kpm system based on the potential and a threshold value is possible now, redext() can expand the obtained data from kwant calculation on a reduced kwant system towards all the flexible sites in rpp_problem. When finalising a pp_builder an extra argument can be passed such that one can choose between parallelisation with fork (e.g. comp/jupyter notebook) or mpi on the cluster.
      5f8cfe7a
  16. 02 Jun, 2022 1 commit
  17. 30 May, 2022 1 commit
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  20. 23 May, 2022 3 commits
  21. 22 May, 2022 1 commit
  22. 17 May, 2022 1 commit
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  24. 13 May, 2022 1 commit
  25. 12 May, 2022 1 commit
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  27. 10 May, 2022 1 commit
  28. 09 May, 2022 3 commits
  29. 04 May, 2022 1 commit