6 Commits

Author	SHA1	Message	Date
eginer	fe675fab92	fixed the Input_ao_extra_basis.ml and beginning to work on extra_basis	2024-12-16 19:01:31 +01:00
eginer	67d2301fde	beginning the fit on 1s functions	2024-12-11 14:30:42 +01:00
eginer	bb8ecd90e8	all one-body potentials are OK	2024-12-06 15:47:48 +01:00
eginer	7bce3135aa	mixed one-e integrals work	2024-12-06 15:05:47 +01:00
eginer	210179e8a0	pot_ao_extra ints work	2024-12-06 14:55:44 +01:00
eginer	0fdaa03d99	added extra basis	2024-12-04 15:58:59 +01:00