Branches

• safari/fciqmc-caspt2-pose

  2a5738cf · coded up commutators of Fock contraction, verification pending · Sep 12, 2023
• libxc_update

  70147ada · Update Libxc to 6.2.2 · Sep 08, 2023
• cho_mp2_0

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

  8b7a3b94 · Remove test of Breit integrals. · Aug 15, 2023
• kalyan/RAS_input_bug

  9ef0d2ee · error out when no holes and particles are specifed · Aug 09, 2023
• safari/spin-correlation-bugfix

  f823b841 · added test · Aug 07, 2023
• corrOCA

  ae777f27 · Merge remote-tracking branch 'origin/master' into corrOCA · Aug 03, 2023
• fix_spinmult

  88366c12 · add docs · Aug 02, 2023
• 418-wfa-allocation

  fdc997af · AT_LISTS in wfa documentation · Jul 31, 2023
• auger-symm

  0d18131b · radial int WB · Jul 27, 2023
• 417-wfa-symmetry

  ffc277a3 · Update WFA doc · Jul 04, 2023
• spin

  0d4343d5 · RASSI: Save spin matrix in HDF5 · Jul 03, 2023
• orbfiles

  7c1e4b7a · Fix dummy · Jun 29, 2023
• safari/state-specific-gradient

  4ac09fb6 · Added tests and keyword for root orbital gradients. · Jun 27, 2023
• safari/fciqmc-caspt2

  178a8e51 · remove debug printing from sbdiag · Jun 23, 2023
• 415-add-transition-charges-to-wfa

  0cf0dd99 · udpate tests for new print-out · Jun 19, 2023
• g-family

  1cda3772 · Merge remote-tracking branch 'origin/master' into g-family · Jun 12, 2023
• hennefarth/lpdft

  d72ba590 · fix implicit type · Jun 01, 2023
• notrick

  1be12d93 · Fix trick for expkap.f90. · May 29, 2023
• 1CCD_Corr

  fa600edc · Fix proper type for some arrays. · May 25, 2023