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mirror of https://github.com/QuantumPackage/qp2.git synced 2024-12-22 19:43:32 +01:00
qp2/scripts
2024-10-06 13:21:53 +02:00
..
compilation Better error message 2024-04-09 12:34:35 +02:00
ezfio_interface Fixed read/write in qp_edit 2024-03-18 17:53:22 +01:00
functionals/do_not_touch_func
module Merge branch 'macos' into dev-stable 2023-10-23 15:30:35 +02:00
utility python -> python3 2023-08-21 14:54:41 +02:00
verif_omp OpenMP nested merged 2021-11-29 10:39:34 +01:00
.gitignore gitignore in include 2023-02-06 17:57:07 +01:00
cipsi_save.sh Add cipsi_save.sh 2022-04-11 23:55:17 +02:00
generate_h_apply.py First python3 3 working installation 2020-03-17 18:02:29 +01:00
get_fci_conv.sh added the get_fci_conv.sh script 2023-03-16 22:11:26 +01:00
get_fci_tc_conv.sh modified scripts/get_fci_tc_conv.sh according to new printing 2024-05-21 12:53:55 +02:00
hello.py First python3 3 working installation 2020-03-17 18:02:29 +01:00
Hn.py python -> python3 2023-08-21 14:54:41 +02:00
import_champ_jastrow.py Qmckl TC JAstrow: jast -> j2e 2024-10-06 13:21:53 +02:00
opam_installer_no_usr_bin.sh added opam_installer_no_usr_bin.sh 2021-04-15 15:46:41 +02:00
perturbation.py First python3 3 working installation 2020-03-17 18:02:29 +01:00
qp_exc_energy.py python -> python3 2023-08-21 14:54:41 +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 Add possibility to use spherical trexio files 2024-09-13 13:37:47 +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
TANGLE_org_mode.sh Fixed qp_export_as_tgz 2023-12-05 17:19:47 +01:00