Anthony Scemama 6289508c1e Swapped indices in CCSD(T)		2023-05-13 13:54:24 +02:00
..
compilation	Introduced TREXIO in QP	2023-05-12 16:04:45 +02:00
ezfio_interface	allow no basis set	2023-05-10 15:05:18 +02:00
functionals/do_not_touch_func
module
utility	Added qp_json	2023-05-10 11:14:57 +02:00
verif_omp
.gitignore
cipsi_save.sh
generate_h_apply.py
get_fci_conv.sh	added the get_fci_conv.sh script	2023-03-16 22:11:26 +01:00
get_fci_tc_conv.sh	added Hn.py	2023-03-28 12:43:15 +02:00
hello.py
Hn.py	added Hn.py	2023-03-28 12:43:15 +02:00
opam_installer_no_usr_bin.sh
perturbation.py
qp_exc_energy.py	Added qp_json	2023-05-10 11:14:57 +02:00
qp_extract_cipsi_data.py	qp_extract_cipsi_data.py uses qp_json	2023-05-10 12:54:02 +02:00
qp_import_trexio.py	Swapped indices in CCSD(T)	2023-05-13 13:54:24 +02:00
remove_trailing_spaces
save_current_mos.sh
script_fci_tc.sh	added script_fci_tc.sh	2023-03-17 11:26:51 +01:00