[io_ao_two_e_integrals] type: Disk_access doc: Read/Write |AO| integrals from/to disk [ Write | Read | None ] interface: ezfio,provider,ocaml default: None [io_ao_cholesky] type: Disk_access doc: Read/Write |AO| integrals from/to disk [ Write | Read | None ] interface: ezfio,provider,ocaml default: None [ao_integrals_threshold] type: Threshold doc: If | (pq|rs) | < `ao_integrals_threshold` then (pq|rs) is zero interface: ezfio,provider,ocaml default: 1.e-15 ezfio_name: threshold_ao [ao_cholesky_threshold] type: Threshold doc: If | (ii|jj) | < `ao_cholesky_threshold` then (ii|jj) is zero interface: ezfio,provider,ocaml default: 1.e-12 [do_direct_integrals] type: logical doc: Compute integrals on the fly (very slow, only for debugging) interface: ezfio,provider,ocaml default: False ezfio_name: direct [do_ao_cholesky] type: logical doc: Perform Cholesky decomposition of AO integrals interface: ezfio,provider,ocaml default: False [io_ao_two_e_integrals_erf] type: Disk_access doc: Read/Write |AO| erf integrals from/to disk [ Write | Read | None ] interface: ezfio,provider,ocaml default: None [use_only_lr] type: logical doc: If true, use only the long range part of the two-electron integrals instead of 1/r12 interface: ezfio, provider, ocaml default: False