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mirror of https://github.com/QuantumPackage/qp2.git synced 2024-12-04 19:03:28 +01:00
qp2/src/two_body_rdm
2020-03-18 15:13:49 +01:00
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all_states_act_2_rdm_dav_routines.irp.f beginning the cleaning of two_body_rdm 2020-03-18 15:13:49 +01:00
all_states_act_2_rdm_prov.irp.f beginning the cleaning of two_body_rdm 2020-03-18 15:13:49 +01:00
all_states_act_2_rdm_update_routines.irp.f beginning the cleaning of two_body_rdm 2020-03-18 15:13:49 +01:00
NEED added the RDMS 2019-06-27 18:23:28 +02:00
README.rst beginning the cleaning of two_body_rdm 2020-03-18 15:13:49 +01:00
state_av_act_2_rdm_dav_routines.irp.f beginning the cleaning of two_body_rdm 2020-03-18 15:13:49 +01:00
state_av_act_2_rdm_prov.irp.f beginning the cleaning of two_body_rdm 2020-03-18 15:13:49 +01:00
state_av_act_2_rdm_update_routines.irp.f beginning the cleaning of two_body_rdm 2020-03-18 15:13:49 +01:00

============
two_body_rdm
============

Contains the two rdms $\alpha\alpha$, $\beta\beta$ and $\alpha\beta$ stored as
arrays, with pysicists notation, consistent with the two-electron integrals in the
MO basis.