2020-04-07 11:03:19 +02:00
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change all correlation functionals with the pbe_on_top general
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2023-02-27 15:27:39 +01:00
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factor 2 in two-rdm involved in:
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on-top, mu(r), pbe-on-top, sc_basis_corr and so on
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2023-02-27 15:45:09 +01:00
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casscf : state_av_act_2_rdm_spin_trace_mo
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