LCPQ/qp2
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2fe164af04
qp2/src/casscf_tc_bi
History
eginer 50f2fb0bfa all gradients are OK !
2023-08-22 13:48:01 +02:00
..
grad_dm.irp.f all gradients are OK ! 2023-08-22 13:48:01 +02:00
grad_old.irp.f all gradients are OK ! 2023-08-22 13:48:01 +02:00
gradient.irp.f inactive --> virtual one-e term gradient ok 2023-07-10 23:24:12 +02:00