1. 03 Apr, 2018 1 commit
  2. 29 Mar, 2018 5 commits
  3. 28 Mar, 2018 2 commits
  4. 29 Nov, 2017 1 commit
  5. 24 Nov, 2017 1 commit
  6. 14 Nov, 2017 1 commit
  7. 13 Nov, 2017 1 commit
  8. 06 Nov, 2017 2 commits
    • Gregor Michalicek's avatar
      Probably fixed missing initialization of sliceplot variables · d839bacd
      Gregor Michalicek authored
      Daniel complained that valgrind complained. But that was not on my machine.
      Therefore I can only hope that this fixes the problem.
      d839bacd
    • Gregor Michalicek's avatar
      Use density matrix stored in cdn.hdf file · 075d7301
      Gregor Michalicek authored
      Note: Also in this commit:
      
      1. Changed test values in NiO_ldauXML test since now the broyden files get deleted
         when a new density matrix is generated
      2. The NiO_ldau test should not work any more since linear mixing for the density
         matrix is removed for the old inp file. (It is not specified in the n_mmp_mat
         file any more)
      075d7301
  9. 20 Oct, 2017 1 commit
  10. 26 Sep, 2017 1 commit
  11. 22 Sep, 2017 1 commit
  12. 20 Sep, 2017 2 commits
  13. 19 Sep, 2017 1 commit
  14. 18 Sep, 2017 2 commits
  15. 08 Sep, 2017 1 commit
  16. 06 Sep, 2017 1 commit
  17. 01 Sep, 2017 1 commit
  18. 31 Aug, 2017 1 commit
  19. 24 Aug, 2017 2 commits
  20. 22 Aug, 2017 1 commit
  21. 14 Aug, 2017 1 commit
  22. 11 Aug, 2017 2 commits
  23. 04 Aug, 2017 1 commit
  24. 25 Jul, 2017 3 commits
  25. 24 Jul, 2017 1 commit
  26. 19 Jul, 2017 1 commit
  27. 18 Jul, 2017 1 commit
    • Daniel Wortmann's avatar
      Reordered the hybrid code. · dd1053a5
      Daniel Wortmann authored
      Now fleur.F90 calls a subroutine that does most of the hybrid stuff.
      In eigen.F90 only the non-local potential is added to the Hamiltonian
      dd1053a5
  28. 11 Jul, 2017 1 commit