Antoine Marie c74579254d save file before pull		2023-04-20 17:00:34 +02:00
..
obj	create utils	2019-03-20 13:38:42 +01:00
DIIS_extrapolation.f90	BeO	2022-11-29 16:01:02 +01:00
Makefile	bug in makefile debug	2020-10-14 16:02:09 +02:00
chem_to_phys_ERI.f90	major modification for makefiles	2020-09-30 00:10:57 +02:00
dfac.f90	dfac	2020-10-14 08:41:01 +02:00
elements.f90	IntPak read geom fixed	2019-03-31 22:28:04 +02:00
level_shifting.f90	fix ACFDT for Tmatrix	2022-02-03 10:05:58 +01:00
norm_coeff.f90	create utils	2019-03-20 13:38:42 +01:00
orthogonalization_matrix.f90	fix bug in T matrix	2021-02-16 10:00:01 +01:00
overlap.f90	major modification for makefiles	2020-09-30 00:10:57 +02:00
phys_to_chem_ERI.f90	major modification for makefiles	2020-09-30 00:10:57 +02:00
read_F12_integrals.f90	remove old methods and options	2022-11-29 09:54:18 +01:00
read_LR.f90	RS in GW	2020-04-16 17:02:01 +02:00
read_MOs.f90	major modification for makefiles	2020-09-30 00:10:57 +02:00
read_auxiliary_basis.f90	create utils	2019-03-20 13:38:42 +01:00
read_basis.f90	update UGW	2020-09-21 16:54:38 +02:00
read_dipole_integrals.f90	major modification for makefiles	2020-09-30 00:10:57 +02:00
read_geometry.f90	save file before pull	2023-04-20 17:00:34 +02:00
read_integrals.f90	oscillator strength and dipole integrals	2020-09-28 21:25:25 +02:00
read_integrals_sph.f90	correcting bug in read_integrals	2019-05-08 08:59:26 +02:00
read_molecule.f90	iterative dynamic correction for BSE	2020-05-21 16:13:52 +02:00
rij.f90	major modification for makefiles	2020-09-30 00:10:57 +02:00
sort.f90	RS in GW	2020-04-16 17:02:01 +02:00
spatial_to_spin_ERI.f90	major modification for makefiles	2020-09-30 00:10:57 +02:00
spatial_to_spin_MO_energy.f90	major modification for makefiles	2020-09-30 00:10:57 +02:00
spatial_to_spin_fock.f90	CID and CISD	2022-01-04 11:39:33 +01:00
utils.f90	modif in utils	2023-03-14 14:12:43 +01:00
wrap_lapack.f90	optimize memory in diagonalizations	2023-03-13 10:14:26 +01:00