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mirror of https://github.com/QuantumPackage/qp2.git synced 2024-11-19 11:52:21 +01:00
qp2/plugins/local
2024-03-15 16:27:02 +01:00
..
ao_many_one_e_ints fixed bug for env_type = None 2024-01-17 19:23:24 +01:00
ao_tc_eff_map hamiltonian -> jastrow 2024-01-15 19:02:05 +01:00
basis_correction cas_ful -> cas_full 2023-11-11 16:13:23 +01:00
bi_ort_ints new keywords for Jastrow 2024-01-15 12:02:38 +01:00
bi_ortho_mos Moved many modules in plugins/local for quicker installation 2023-11-07 10:27:34 +01:00
casscf_tc_bi Moved many modules in plugins/local for quicker installation 2023-11-07 10:27:34 +01:00
cipsi_tc_bi_ortho fci_tc_bi_ortho works for multi state ninja 2024-03-12 18:23:09 +01:00
fci_tc_bi added script_tc_bh_h2o_gd_exc.sh in fci_tc_bi 2024-03-15 16:27:02 +01:00
jastrow few modif 2024-02-23 23:51:03 +01:00
mo_localization Moved many modules in plugins/local for quicker installation 2023-11-07 10:27:34 +01:00
non_h_ints_mu Boys & Handy Jastrow: OK 2024-02-16 16:45:54 +01:00
non_hermit_dav added fit 1e-Jastrow on AOs 2024-01-16 23:10:44 +01:00
ortho_three_e_ints Moved many modules in plugins/local for quicker installation 2023-11-07 10:27:34 +01:00
qmckl Fixing compilation 2023-11-07 11:12:10 +01:00
tc_bi_ortho changed print_tc_wf 2024-03-13 11:20:03 +01:00
tc_keywords added the keyword to minimize tc angles at the end of TC SCF 2024-03-15 15:40:18 +01:00
tc_scf added the keyword to minimize tc angles at the end of TC SCF 2024-03-15 15:40:18 +01:00
.gitignore Develop (#15) 2019-03-07 16:29:06 +01:00