6 Commits

Author	SHA1	Message	Date
Anthony Scemama	ff5d62f840	Fix normalization factor in trexio	2023-05-31 11:01:51 +02:00
Anthony Scemama	f0ad63966a	Fixes for numerical orbitals in qp_import	2023-05-30 22:08:40 +02:00
Anthony Scemama	b8804f058a	Moved qp_import_trexio.py	2023-05-12 21:38:01 +02:00
Anthony Scemama	6d1cf74e09	Added NEED in trexio	2023-05-12 19:58:15 +02:00
Anthony Scemama	a2627e7925	Introduced TREXIO in QP	2023-05-12 16:04:45 +02:00
Anthony Scemama	4959882293	Added TREXIO module	2023-05-11 22:48:48 +02:00