5 Commits

Author	SHA1	Message	Date
Pierre-Francois Loos	329209cf9c	commit before removing restricted obselete routines	2021-11-30 09:29:23 +01:00
Pierre-Francois Loos	372a1a3b0e	dipole in UKS	2021-03-25 11:05:56 +01:00
Pierre-Francois Loos	eb82dd2d67	fix homo and lumo	2020-09-15 11:18:24 +02:00
Pierre-Francois Loos	91a0120eee	fix problem with individual energies	2020-07-08 10:55:03 +02:00
Pierre-Francois Loos	e14e8ac278	R or U	2020-03-15 08:24:15 +01:00