| .. |
|
11.tc_scf.bats
|
Moved many modules in plugins/local for quicker installation
|
2023-11-07 10:27:34 +01:00 |
|
combine_lr_tcscf.irp.f
|
Moved many modules in plugins/local for quicker installation
|
2023-11-07 10:27:34 +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 |
|
diago_vartcfock.irp.f
|
Moved many modules in plugins/local for quicker installation
|
2023-11-07 10:27:34 +01:00 |
|
diis_tcscf.irp.f
|
Moved many modules in plugins/local for quicker installation
|
2023-11-07 10:27:34 +01:00 |
|
EZFIO.cfg
|
few modif
|
2024-02-23 23:51:03 +01:00 |
|
fock_3e_bi_ortho_cs.irp.f
|
Moved many modules in plugins/local for quicker installation
|
2023-11-07 10:27:34 +01:00 |
|
fock_3e_bi_ortho_os.irp.f
|
Moved many modules in plugins/local for quicker installation
|
2023-11-07 10:27:34 +01:00 |
|
fock_3e_bi_ortho_uhf_old.irp.f
|
Moved many modules in plugins/local for quicker installation
|
2023-11-07 10:27:34 +01:00 |
|
fock_3e_bi_ortho_uhf.irp.f
|
Moved many modules in plugins/local for quicker installation
|
2023-11-07 10:27:34 +01:00 |
|
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
|
Moved many modules in plugins/local for quicker installation
|
2023-11-07 10:27:34 +01:00 |
|
fock_tc.irp.f
|
Moved many modules in plugins/local for quicker installation
|
2023-11-07 10:27:34 +01:00 |
|
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 |
|
fock_vartc.irp.f
|
new keywords for Jastrow
|
2024-01-15 12:05:26 +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 |
|
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 |
|
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
|
Boys & Handy Jastrow: OK
|
2024-02-16 16:45:54 +01:00 |
|
rh_tcscf_simple.irp.f
|
Moved many modules in plugins/local for quicker installation
|
2023-11-07 10:27:34 +01:00 |
|
rh_vartcscf_simple.irp.f
|
Moved many modules in plugins/local for quicker installation
|
2023-11-07 10:27:34 +01:00 |
|
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
|
saving olympe2 modif
|
2024-04-07 00:29:40 +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
|
Moved many modules in plugins/local for quicker installation
|
2023-11-07 10:27:34 +01:00 |
|
tc_scf.irp.f
|
new keywords for Jastrow
|
2024-01-15 12:02:38 +01:00 |
|
tcscf_energy_naive.irp.f
|
Moved many modules in plugins/local for quicker installation
|
2023-11-07 10:27:34 +01:00 |
|
test_int.irp.f
|
new keywords for Jastrow
|
2024-01-15 12:05:26 +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 |
