9
1
mirror of https://github.com/QuantumPackage/qp2.git synced 2024-10-15 20:21:34 +02:00
qp2/src/csf
2022-09-15 19:18:13 +02:00
..
cfgCI_interface.f90 Working on LAPACK gramSchmidt. Not working with naive dgeqrf. 2022-07-09 09:00:29 +02:00
cfgCI_utils.c Fixed bug in AIJ container initialization for doublet. 2022-09-14 23:26:48 +02:00
configuration_CI_sigma_helpers.irp.f Fixed some bugs for S>0. 2022-06-20 19:55:44 +02:00
configuration_CI_sigma_helpers.org Added davidson without S2 2021-02-17 00:46:58 +01:00
configurations.irp.f Merge branch 'dev' into csf_verified 2022-06-13 16:27:30 +02:00
connected_to_ref.irp.f Fix gfortran10 problem #153 2021-04-19 23:57:28 +02:00
conversion.irp.f Triplet seems to be working. Doublet needs work. 2022-09-14 15:07:34 +02:00
create_excitations.irp.f Working on frozen core for CFG-CI. 2022-06-17 11:05:27 +02:00
NEED Added davidson without S2 2021-02-17 00:46:58 +01:00
obtain_I_foralpha.irp.f Fixed some bugs for S>0. 2022-06-20 19:55:44 +02:00
sigma_vector.irp.f Doublet also works. Running tests. 2022-09-15 19:18:13 +02:00
tree_utils.c Triplet seems to be working. Doublet needs work. 2022-09-14 15:07:34 +02:00
tree_utils.h Working on LAPACK gramSchmidt. Not working with naive dgeqrf. 2022-07-09 09:00:29 +02:00