1. 08 May, 2019 1 commit
  2. 22 Feb, 2019 1 commit
  3. 15 Feb, 2019 1 commit
  4. 29 Nov, 2018 1 commit
  5. 20 Mar, 2017 1 commit
  6. 17 Mar, 2017 1 commit
  7. 26 Sep, 2016 1 commit
    • Gregor Michalicek's avatar
      Corrected too optimistic guess for maxCubeAtoms · 4fe49922
      Gregor Michalicek authored
      The parameter maxCubeAtoms is used in chkmt to determine the
      size of some arrays. It was chosen too small for some limiting
      cases.
      
      Also in this commit: Added an error message for too small distances
      between atoms.
      4fe49922
  8. 30 Jun, 2016 1 commit
  9. 27 Apr, 2016 1 commit
    • Gregor Michalicek's avatar
      Rewrote chkmt.f90. · 2712fa64
      Gregor Michalicek authored
      This commit introduces the new chkmt.f90. Besides some exceptions this
      new routine should yield the same results as the old one. With a runtime
      scaling of O(N_atoms) it overcomes the bad O(N_atoms^4) scaling of the
      old pendant.
      2712fa64
  10. 26 Apr, 2016 1 commit