1. 17 Jul, 2018 1 commit
    • Gregor Michalicek's avatar
      Add dummy io/banddos_io.F90 file · a728ce3e
      Gregor Michalicek authored
      This is going to be extended with functionality for the output of augmented
      band structure data.
      
      ...It actually only is a test commit for my current development environment. :)
      a728ce3e
  2. 03 Jul, 2018 1 commit
  3. 27 Jun, 2018 2 commits
  4. 22 Jun, 2018 2 commits
  5. 21 Jun, 2018 1 commit
  6. 14 Jun, 2018 2 commits
  7. 13 Jun, 2018 2 commits
  8. 12 Jun, 2018 2 commits
  9. 11 Jun, 2018 6 commits
  10. 08 Jun, 2018 1 commit
  11. 07 Jun, 2018 1 commit
  12. 05 Jun, 2018 1 commit
  13. 04 Jun, 2018 4 commits
  14. 30 May, 2018 1 commit
    • Miriam Hinzen's avatar
      Add Preconditioning Parameter in Input File · 2ac3237f
      Miriam Hinzen authored
      I added preconditioning_param in the SCFLoopType in inp.xml as an optional parameter with default value 0.0.
      It does not appear in the old input file.
      Tests: a) generation of input file with default value; b) using this input file; c) using an inp.xml file with erased parameter; d) ctest. All tests (except ctests that currently also failed without this change) were OK.
      2ac3237f
  15. 22 May, 2018 1 commit
    • Gregor Michalicek's avatar
      Fixed possible bug in setting the XC functional in r_inpXML · a84b339f
      Gregor Michalicek authored
      The problem was that the output variable namex wasn't set any more. Of course,
      this variable is not used for most things but it is at least used in w_inpXML
      which is called at several points in the code. At some point this variable
      should be eliminated in the whole code.
      a84b339f
  16. 17 May, 2018 1 commit
  17. 15 May, 2018 1 commit
  18. 08 May, 2018 3 commits
  19. 02 May, 2018 1 commit
  20. 27 Apr, 2018 3 commits
  21. 26 Apr, 2018 3 commits