Thomas Applencourt f69d458ab6 Update module_handler.py		2017-01-19 16:03:57 -06:00
..
compilation	Moved n_states_diag	2016-09-25 23:28:25 +02:00
ezfio_interface	Working pseudo	2016-11-08 15:29:35 -06:00
module	Update module_handler.py	2017-01-19 16:03:57 -06:00
pseudo	Working with the new emsl	2016-01-15 10:26:42 +01:00
utility	Removed git --local in is_master_repository.py	2015-11-13 09:36:04 +01:00
.gitignore	Remove check_dependencies.sh, is no handle by module_handler.py	2015-05-04 15:53:42 +02:00
entanglement.py	Added the Orbital Entanglement plugin, added the list of active orbitals in bitmasks.irp.f.	2016-02-12 12:27:13 +01:00
generate_h_apply.py	Include S^2 inside davidson	2016-09-27 15:55:38 +02:00
get_basis.sh	Some modif for the interface with qmcpack	2016-01-14 15:18:31 +01:00
make_binary.sh	QPACKAGE_ROOT => QP_ROOT =D	2015-06-08 14:49:10 +02:00
perturbation.py	QPACKAGE_ROOT => QP_ROOT =D	2015-06-08 14:49:10 +02:00
qp_bitmasks.py	Added qpackage run command	2014-06-27 01:26:46 +02:00
qp_set_frozen_core.py	Added -q to qp_set_frozen_core	2016-09-09 19:31:30 +02:00
save_current_mos.sh	Error in bash scripts	2015-09-22 09:08:26 +02:00