| .. |
|
31.tc_bi_ortho.bats
|
The test works for fci_tc_bi but not for tc_bi_ortho
|
2024-03-12 17:09:58 +01:00 |
|
dav_h_tc_s2.irp.f
|
Moved many modules in plugins/local for quicker installation
|
2023-11-07 10:27:34 +01:00 |
|
diagonalize_tc_h.irp.f
|
updated default keywords in tc_keywords and ao_twoe_e_ints
|
2024-05-08 17:26:48 +02:00 |
|
e_corr_bi_ortho.irp.f
|
trying to speed up the PT2 in TC by transposing the array of tc integrals
|
2024-05-07 19:43:05 +02:00 |
|
EZFIO.cfg
|
TC SPRING CLEANING: BEGINNING
|
2024-05-01 20:25:01 +02:00 |
|
h_tc_u0.irp.f
|
Moved many modules in plugins/local for quicker installation
|
2023-11-07 10:27:34 +01:00 |
|
NEED
|
Begining to make some cleaning in TC
|
2024-04-25 19:48:17 +02:00 |
|
psi_det_tc_sorted.irp.f
|
changed print_tc_wf
|
2024-03-13 11:20:03 +01:00 |
|
psi_left_qmc.irp.f
|
Moved many modules in plugins/local for quicker installation
|
2023-11-07 10:27:34 +01:00 |
|
psi_r_l_prov.irp.f
|
Merge branch 'dev-stable' of https://github.com/QuantumPackage/qp2 into dev-stable
|
2024-01-25 14:43:29 +01:00 |
|
spin_mulliken.irp.f
|
Moved many modules in plugins/local for quicker installation
|
2023-11-07 10:27:34 +01:00 |
|
symmetrized_3_e_int.irp.f
|
Moved many modules in plugins/local for quicker installation
|
2023-11-07 10:27:34 +01:00 |
|
tc_h_eigvectors.irp.f
|
removed prints in plugins/local/tc_bi_ortho/tc_h_eigvectors.irp.f
|
2024-05-22 17:32:56 +02:00 |
|
tc_natorb.irp.f
|
removed STUPID stop in save_tc_natorb
|
2024-03-08 17:25:48 +01:00 |
|
tc_prop.irp.f
|
Moved many modules in plugins/local for quicker installation
|
2023-11-07 10:27:34 +01:00 |
|
tc_utils.irp.f
|
Merge branch 'dev-stable' of https://github.com/AbdAmmar/qp2 into dev-stable
|
2024-08-08 11:40:02 +02:00 |
|
test_spin_dens.irp.f
|
Moved many modules in plugins/local for quicker installation
|
2023-11-07 10:27:34 +01:00 |
|
TODO
|
added script_tc_jmu_h2o_gd_exc.sh
|
2024-03-15 17:10:22 +01:00 |
|
two_rdm_naive.irp.f
|
Moved many modules in plugins/local for quicker installation
|
2023-11-07 10:27:34 +01:00 |
