|
obj
|
create utils
|
2019-03-20 13:38:42 +01:00 |
|
DIIS_extrapolation.f90
|
fix DIIS in GW
|
2019-04-01 15:53:39 +02:00 |
|
elements.f90
|
IntPak read geom fixed
|
2019-03-31 22:28:04 +02:00 |
|
Makefile
|
remove ERI copy in qsGW
|
2019-10-30 10:31:05 +01:00 |
|
norm_coeff.f90
|
create utils
|
2019-03-20 13:38:42 +01:00 |
|
read_auxiliary_basis.f90
|
create utils
|
2019-03-20 13:38:42 +01:00 |
|
read_basis.f90
|
clean up
|
2020-01-17 13:45:02 +01:00 |
|
read_geometry.f90
|
clean up
|
2020-01-17 13:45:02 +01:00 |
|
read_integrals_sph.f90
|
correcting bug in read_integrals
|
2019-05-08 08:59:26 +02:00 |
|
read_integrals.f90
|
examples
|
2020-01-17 17:35:40 +01:00 |
|
read_molecule.f90
|
create utils
|
2019-03-20 13:38:42 +01:00 |
|
utils.f90
|
create utils
|
2019-03-20 13:38:42 +01:00 |
|
wrap_lapack.f90
|
remove ERI copy in qsGW
|
2019-10-30 10:31:05 +01:00 |
