1. 09 Apr, 2018 1 commit
  2. 03 Apr, 2018 1 commit
  3. 29 Mar, 2018 1 commit
  4. 28 Mar, 2018 2 commits
  5. 24 Nov, 2017 1 commit
  6. 31 Aug, 2017 2 commits
  7. 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
  8. 27 Jun, 2017 1 commit
  9. 13 Feb, 2017 1 commit
  10. 17 Jan, 2017 1 commit
  11. 26 Sep, 2016 1 commit
  12. 21 Jun, 2016 1 commit
  13. 20 May, 2016 1 commit
  14. 29 Apr, 2016 1 commit
  15. 28 Apr, 2016 1 commit
    • Gregor Michalicek's avatar
      Initial commit of xml input file generator. · 12c8019f
      Gregor Michalicek authored
      Besides the conventional input, the new inpgen now also generates an
      inp.xml file containing all required data to start a calculation. The
      commit also includes additional command line parameters for inpgen:
      
         "-explicit": This writes k-points, symmetry operations, and the Bravais
                      matrix explicitly into the inp.xml file.
         "-noXML":    This switches of the generation of the inp.xml file.
      12c8019f
  16. 26 Apr, 2016 1 commit