OpenMolcas is a quantum chemistry software package.

The key feature of OpenMolcas is the multiconfigurational approach to the electronic structure.

  • Jellby's avatar
    Cosmetic changes · 93e942ef
    Jellby authored
    Removed unused routine and interface. Change CMakeLists.txt file
    because apparently NAG doesn't search for module files in the
    directory where it creates module files (doh!)
    93e942ef
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