Abdallah Ammar c50018e8bd TC SPRING CLEANING: BEGINNING

2024-05-01 20:25:01 +02:00

..

11.tc_scf.bats

fixed the qp_test of tc_scf

2024-03-12 16:52:53 +01:00

diago_bi_ort_tcfock.irp.f

Moved many modules in plugins/local for quicker installation

2023-11-07 10:27:34 +01:00

diis_tcscf.irp.f

TC SPRING CLEANING: BEGINNING

2024-05-01 20:25:01 +02:00

EZFIO.cfg

TC SPRING CLEANING: BEGINNING

2024-05-01 20:25:01 +02:00

fock_hermit.irp.f

Moved many modules in plugins/local for quicker installation

2023-11-07 10:27:34 +01:00

fock_tc_mo_tot.irp.f

TC SPRING CLEANING: BEGINNING

2024-05-01 20:25:01 +02:00

fock_tc.irp.f

TC SPRING CLEANING: BEGINNING

2024-05-01 20:25:01 +02:00

fock_three_bi_ortho.irp.f

Moved many modules in plugins/local for quicker installation

2023-11-07 10:27:34 +01:00

fock_three_hermit.irp.f

Moved many modules in plugins/local for quicker installation

2023-11-07 10:27:34 +01:00

integrals_in_r_stuff.irp.f

Moved many modules in plugins/local for quicker installation

2023-11-07 10:27:34 +01:00

jast_schmos_90.irp.f

added some j for plotting

2024-02-29 18:44:40 +01:00

minimize_tc_angles.irp.f

saving olympe2 modif

2024-04-07 00:29:40 +02:00

molden_lr_mos.irp.f

Moved many modules in plugins/local for quicker installation

2023-11-07 10:27:34 +01:00

NEED

Moved many modules in plugins/local for quicker installation

2023-11-07 10:27:34 +01:00

plot_j_schMos.irp.f

added some j for plotting

2024-02-29 18:44:40 +01:00

print_fit_param.irp.f

Moved many modules in plugins/local for quicker installation

2023-11-07 10:27:34 +01:00

print_tcscf_energy.irp.f

new keywords for Jastrow

2024-01-15 12:02:38 +01:00

rh_tcscf_diis.irp.f

TC SPRING CLEANING: BEGINNING

2024-05-01 20:25:01 +02:00

rh_tcscf_simple.irp.f

TC SPRING CLEANING: BEGINNING

2024-05-01 20:25:01 +02:00

rotate_tcscf_orbitals.irp.f

Moved many modules in plugins/local for quicker installation

2023-11-07 10:27:34 +01:00

routines_rotates.irp.f

Merge branch 'dev-stable' into dev-stable

2024-05-01 18:54:03 +02:00

tc_petermann_factor.irp.f

Moved many modules in plugins/local for quicker installation

2023-11-07 10:27:34 +01:00

tc_scf_dm.irp.f

Moved many modules in plugins/local for quicker installation

2023-11-07 10:27:34 +01:00

tc_scf_energy.irp.f

TC SPRING CLEANING: BEGINNING

2024-05-01 20:25:01 +02:00

tc_scf.irp.f

TC SPRING CLEANING: BEGINNING

2024-05-01 20:25:01 +02:00

tcscf_energy_naive.irp.f

Moved many modules in plugins/local for quicker installation

2023-11-07 10:27:34 +01:00

three_e_energy_bi_ortho.irp.f

Moved many modules in plugins/local for quicker installation

2023-11-07 10:27:34 +01:00

write_ao_2e_tc_integ.irp.f

saving lcpq-ampere

2024-04-07 00:43:44 +02:00