Branches

• cho_mp2_0

  ef706320 · Generate CHFV files on the fly if not present. · Aug 18, 2023
• libxc_update

  70147ada · Update Libxc to 6.2.2 · Sep 08, 2023
• safari/fciqmc-caspt2-pose

  2a5738cf · coded up commutators of Fock contraction, verification pending · Sep 12, 2023
• srmp2 diverged from upstream

  86a3803d · (MBP2) SRMP2 for NoSym and No Frozen Orbitals · Sep 18, 2023
• filesToModule

  e8174464 · Merge branch 'filesToModule' of gitlab.com:Molcas/OpenMolcas into filesToModule · Oct 25, 2023
• citation

  71f80c17 · Update citation · Oct 27, 2023
• debugprint

  24cc6fd6 · Fix for test 000 · Oct 28, 2023
• integral_util_updates

  1bde82cd · Fix debugprint complier errors. · Oct 30, 2023
• cleanup_832

  594c779e · Complement with a updated checkfile for 832. · Nov 03, 2023
• iWROpt

  cc339045 · Cleanup. · Nov 10, 2023
• wipe

  a1ee3b57 · verify: Ignore matches (-w, -m, --grep) inside >FILE blocks · Nov 13, 2023
• parallel_verify

  1de3a859 · verify: Implement simultaneous jobs (-j N) · Nov 14, 2023
• full-ldf-removal

  22347826 · Remove unused variables. · Nov 14, 2023
• auger-tiresia

  cdc4ec03 · allow different ras3 · Nov 19, 2023
• print_format

  1c7bdc23 · Replace also D and P formats · Nov 22, 2023
• hdf5

  3caa076c · Skip HDF5 tests · Nov 24, 2023
• aniso

  211a4ba3 · Merge remote-tracking branch 'upstream/master' into aniso · Dec 11, 2023
• torsional_force

  3b8aa496 · Test new syntax and keywords · Dec 13, 2023
• intel_llvm

  6400abf3 · Safer optimization · Dec 19, 2023
• minor_update

  e1a33bc1 · Some minor updates: · Feb 02, 2024