Pierre-Francois Loos a2a63862c1 saving cRHF		2024-04-22 15:59:02 +02:00
..
obj	create utils	2019-03-20 13:38:42 +01:00
DIIS_extrapolation.f90	fix scf convergence issues in RHF, UHF, ROHF and GHF	2023-11-17 00:26:44 +01:00
Makefile	bug in makefile debug	2020-10-14 16:02:09 +02:00
elements.f90	saving cRHF	2024-04-22 15:59:02 +02:00
level_shifting.f90	remove COHSEX and modify phLR in GW routines	2023-07-18 14:59:18 +02:00
orthogonalization_matrix.f90	saving cRHF	2024-04-22 15:59:02 +02:00
read_CAP_integrals.f90	saving cRHF	2024-04-22 15:59:02 +02:00
read_auxiliary_basis.f90	saving cRHF	2024-04-22 15:59:02 +02:00
read_basis.f90	saving cRHF	2024-04-22 15:59:02 +02:00
read_basis_pyscf.f90	fixing openmp bugs and some warning	2023-08-21 10:54:33 +02:00
read_dipole_integrals.f90	saving cRHF	2024-04-22 15:59:02 +02:00
read_geometry.f90	saving cRHF	2024-04-22 15:59:02 +02:00
read_integrals.f90	saving cRHF	2024-04-22 15:59:02 +02:00
read_molecule.f90	saving cRHF	2024-04-22 15:59:02 +02:00
sort.f90	minimal changes in many files	2023-12-03 18:47:30 +01:00
spatial_to_spin_ERI.f90	saving cRHF	2024-04-22 15:59:02 +02:00
spatial_to_spin_MO_energy.f90	saving cRHF	2024-04-22 15:59:02 +02:00
spatial_to_spin_fock.f90	saving cRHF	2024-04-22 15:59:02 +02:00
utils.f90	minimal changes in many files	2023-12-03 18:47:30 +01:00
wrap_lapack.f90	minimal changes in many files	2023-12-03 18:47:30 +01:00