Anthony Scemama ccf7f5a741 Corrected bug with multiple basis sets		2015-11-22 15:18:51 +01:00
..
compilation	Added integrals access benchmark	2015-11-17 00:16:00 +01:00
ezfio_interface	Spelling in comments	2015-07-25 00:18:19 +02:00
module	Removed print	2015-11-08 21:43:32 +01:00
pseudo	Option to add automatically dummy basis functions	2015-11-17 22:25:26 +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
generate_h_apply.py	bitstring_to_list_ab	2015-11-20 19:51:56 +01:00
get_basis.sh	Corrected bug with multiple basis sets	2015-11-22 15:18:51 +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	Accelerated S^2	2015-07-14 01:06:28 +02:00
save_current_mos.sh	Error in bash scripts	2015-09-22 09:08:26 +02:00