Branches

• caspt2-gradients

  b09b3f5d · Update manual for gradients · Jan 26, 2023
• FNO-RASPT2

  70e9a6ce · Fix doc · Jan 27, 2023
• prpr-addons

  b895e5de · fixed one more line in hfcts.f header · Jan 30, 2023
• wfafix2

  705a8268 · add test with correct version information · Feb 02, 2023
• doc_and_ci

  2ccd2587 · Update tests · Feb 08, 2023
• prwfbiorth

  03265f62 · apply a threshold on prwf_biorth.F90 · Feb 11, 2023
• outsource

  a3f5d11d · Pass pipeline source · Feb 14, 2023
• fix-mult

  41f22e04 · Small logic fix for onlyroot · Feb 22, 2023
• fix_spherical

  e8839607 · matrix multiplication · Feb 25, 2023
• is-gek

  7b431bc6 · This test needs the Fermi=2 option. · Mar 01, 2023
• CholeskyCorrection

  2586b375 · Update checkfiles. · Mar 15, 2023
• hennefarth/pdft-cleanup

  aaaee6f7 · add .idea to gitignore · Mar 16, 2023
• hennefarth/pdft-exp

  aaaee6f7 · add .idea to gitignore · Mar 16, 2023
• kriging_mecp

  0ebb4cfd · New try · Mar 17, 2023
• added_repermute

  6196ac4c · added repermute · Mar 29, 2023
• tinker

  6791f1fe · test tinker · Mar 30, 2023
• basis_mult

  87988639 · CI: Fix tinker location · Mar 30, 2023
• pcalio/CMS_NACs

  32c22e0a · Update test 925 input to read orbital · Apr 19, 2023
• scf_f90

  b9e0d8a6 · Update to f90 format. · Apr 24, 2023
• oups

  944b24d4 · Update to f90 format. · Apr 24, 2023