[threshold_singles] type: double precision doc: threshold to select the pertinent single excitations at second order interface: ezfio,provider,ocaml default: 0.01 [threshold_fobo_dm] type: double precision doc: threshold to eliminate small density matrix elements in the fobo procedure interface: ezfio,provider,ocaml default: 0.00001 [do_it_perturbative] type: logical doc: if true, you do the FOBOCI calculation perturbatively interface: ezfio,provider,ocaml default: .False. [second_order_h] type: logical doc: if true, you do the FOBOCI calculation using second order intermediate Hamiltonian interface: ezfio,provider,ocaml default: .False. [do_all_2p] type: logical doc: if true, you do all 2p type excitation on the LMCT interface: ezfio,provider,ocaml default: .True.