7 Commits

Author	SHA1	Message	Date
eginer	656709b7c1	added tc spin density	2023-02-23 16:12:00 +01:00
eginer	342a337b46	added the nuclear repulsion in src/tc_bi_ortho/slater_tc_opt_diag.irp.f	2023-02-19 10:51:07 +01:00
eginer	69f014bc9c	added nuclear repulsion in the diagonal TC matrix element bi_ortho	2023-02-14 23:45:15 +01:00
eginer	dd4ea54c6c	added test in fci_tc_bi_ortho ... changed names in ezfio functions in ortho_three_e_ints changed names in ezfio functions in ortho_three_e_ints	2023-02-08 15:36:36 +01:00
eginer	26bdbf7193	modified cipsi_tc_bi_ortho/selection.irp.f	2023-02-08 10:55:03 +01:00
eginer	80b66dee79	added	2023-02-07 17:24:09 +01:00
eginer	5bd19df0bc	added tc_bi_ortho	2023-02-07 17:07:49 +01:00