mirror of
https://github.com/QuantumPackage/qp2.git
synced 2024-11-19 20:42:36 +01:00
5 lines
195 B
Plaintext
5 lines
195 B
Plaintext
change all correlation functionals with the pbe_on_top general
|
|
factor 2 in two-rdm involved in:
|
|
on-top, mu(r), pbe-on-top, sc_basis_corr and so on
|
|
casscf : state_av_act_2_rdm_spin_trace_mo
|