1. 23 Apr, 2018 1 commit
  2. 20 Apr, 2018 2 commits
  3. 16 Apr, 2018 1 commit
  4. 13 Apr, 2018 1 commit
  5. 12 Apr, 2018 1 commit
  6. 10 Apr, 2018 1 commit
  7. 09 Apr, 2018 1 commit
  8. 05 Apr, 2018 2 commits
  9. 04 Apr, 2018 1 commit
  10. 03 Apr, 2018 1 commit
  11. 29 Mar, 2018 1 commit
  12. 28 Mar, 2018 3 commits
  13. 09 Jan, 2018 1 commit
  14. 12 Dec, 2017 1 commit
  15. 30 Nov, 2017 1 commit
    • Gustav Bihlmayer's avatar
      Update mapatom.F90, hsmt_extra.F90 and vec_for_lo.f90 to ensure a complex matrix setup · 5bf8da4d
      Gustav Bihlmayer authored
      with invsatom=0 etc. in case of LDA+U and SOC. Furthermore the i_u counter was reset
      for more that one atom per type in hsmt_extra.F90. l_lo1 and some fix spin-spiral + LO
      in pathological cases introduces in vec_for_lo.f90. The "scalar relativistic" energy
      parameter calculation for LO's was introduced in lodpot.f90. This will change the
      total energy in some test cases.
      5bf8da4d
  16. 29 Nov, 2017 1 commit
  17. 24 Nov, 2017 1 commit
  18. 22 Sep, 2017 2 commits
  19. 21 Sep, 2017 1 commit
  20. 20 Sep, 2017 1 commit
  21. 18 Sep, 2017 1 commit
    • Daniel Wortmann's avatar
      Refactoring of xcpot data type: · df91b524
      Daniel Wortmann authored
      -removing of variable icorr, use of member-functions instead
      -removal of icorrkeys module
      -removal of hybridmix module
      -cleanup at several places
      df91b524
  22. 14 Sep, 2017 1 commit
  23. 11 Sep, 2017 1 commit
  24. 08 Sep, 2017 1 commit
  25. 06 Sep, 2017 1 commit
  26. 01 Sep, 2017 1 commit
  27. 31 Aug, 2017 2 commits
  28. 22 Aug, 2017 1 commit
  29. 14 Aug, 2017 1 commit
  30. 04 Aug, 2017 2 commits
  31. 03 Aug, 2017 1 commit
  32. 02 Aug, 2017 1 commit
    • Gregor Michalicek's avatar
      Fix segmentation fault in init/brzone2.f90 · 4a3f4f96
      Gregor Michalicek authored
      The problem was that some arrays had predefined sizes that were
      not adapted to the actual problem. I changed this for some arrays
      now but there are still some other arrays that may become a problem
      at some point, too.
      4a3f4f96
  33. 28 Jul, 2017 1 commit