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mirror of https://github.com/QuantumPackage/qp2.git synced 2024-11-03 20:53:54 +01:00
QuantumPackage/src/tc_bi_ortho
2023-01-16 23:36:05 +01:00
..
compute_deltamu_right.irp.f it compiles again 2022-10-24 12:22:19 +02:00
dressing_vectors_lr.irp.f new jast added in QP 2022-10-21 23:27:51 +02:00
e_corr_bi_ortho.irp.f added tc_bi_ortho 2022-10-05 17:01:27 +02:00
EZFIO.cfg added tc_bi_ortho 2022-10-05 17:01:27 +02:00
h_biortho.irp.f new jast added in QP 2022-10-21 23:27:51 +02:00
h_tc_bi_ortho_psi.irp.f added tc_bi_ortho 2022-10-05 17:01:27 +02:00
NEED added tc_bi_ortho 2022-10-05 17:01:27 +02:00
normal_ordered.irp.f added tc_bi_ortho 2022-10-05 17:01:27 +02:00
print_he_tc_energy.irp.f cycle in integ added 2022-11-21 10:38:42 +01:00
print_tc_wf.irp.f added tc_bi_ortho 2022-10-05 17:01:27 +02:00
psi_det_tc_sorted.irp.f added tc_bi_ortho 2022-10-05 17:01:27 +02:00
psi_left_qmc.irp.f added tc_bi_ortho 2022-10-05 17:01:27 +02:00
psi_r_l_prov.irp.f new jast added in QP 2022-10-21 23:27:51 +02:00
save_bitcpsileft_for_qmcchem.irp.f clean fork with + TC stuffs 2023-01-16 23:36:05 +01:00
save_lr_bi_ortho_states.irp.f added tc_bi_ortho 2022-10-05 17:01:27 +02:00
save_tc_bi_ortho_nat.irp.f removed the angle minimization after the diagonalization of tc mat 2022-10-30 12:20:30 +01:00
select_dets_bi_ortho.irp.f added tc_bi_ortho 2022-10-05 17:01:27 +02:00
slater_tc_3e.irp.f vec Anthony + fixed bugs + cycle 2022-11-25 23:54:33 +01:00
slater_tc.irp.f new jast added in QP 2022-10-21 23:27:51 +02:00
symmetrized_3_e_int.irp.f added tc_bi_ortho 2022-10-05 17:01:27 +02:00
tc_bi_ortho_prop.irp.f added tc_bi_ortho 2022-10-05 17:01:27 +02:00
tc_bi_ortho.irp.f added tc_bi_ortho 2022-10-05 17:01:27 +02:00
tc_cisd_sc2_utils.irp.f diagonalization before starting tc cisd(SC)2 2022-11-08 00:25:41 +01:00
tc_cisd_sc2.irp.f added tc_bi_ortho 2022-10-05 17:01:27 +02:00
tc_h_eigvectors.irp.f added tc_bi_ortho 2022-10-05 17:01:27 +02:00
tc_hmat.irp.f vec Anthony + fixed bugs + cycle 2022-11-25 23:54:33 +01:00
tc_natorb.irp.f merged version: ok 2022-10-31 19:14:27 +01:00
tc_prop.irp.f split tc_prop.irp.f into tc_natorb.irp.f 2022-10-29 18:53:25 +02:00
tc_som.irp.f clean fork with + TC stuffs 2023-01-16 23:36:05 +01:00
test_natorb.irp.f split tc_prop.irp.f into tc_natorb.irp.f 2022-10-29 18:53:25 +02:00
test_normal_order.irp.f added tc_bi_ortho 2022-10-05 17:01:27 +02:00
test_tc_bi_ortho.irp.f added tc_bi_ortho 2022-10-05 17:01:27 +02:00
test_tc_fock.irp.f clean fork with + TC stuffs 2023-01-16 23:36:05 +01:00