[ao_integrals_e_n] type: double precision doc: Nucleus-electron integrals in |AO| basis set size: (ao_basis.ao_num,ao_basis.ao_num) interface: ezfio [io_ao_integrals_e_n] type: Disk_access doc: Read/Write |AO| nucleus-electron attraction integrals from/to disk [ Write | Read | None ] interface: ezfio,provider,ocaml default: None [ao_integrals_kinetic] type: double precision doc: Kinetic energy integrals in |AO| basis set size: (ao_basis.ao_num,ao_basis.ao_num) interface: ezfio [io_ao_integrals_kinetic] type: Disk_access doc: Read/Write |AO| kinetic integrals from/to disk [ Write | Read | None ] interface: ezfio,provider,ocaml default: None [ao_integrals_pseudo] type: double precision doc: Pseudopotential integrals in |AO| basis set size: (ao_basis.ao_num,ao_basis.ao_num) interface: ezfio [io_ao_integrals_pseudo] type: Disk_access doc: Read/Write |AO| pseudopotential integrals from/to disk [ Write | Read | None ] interface: ezfio,provider,ocaml default: None [ao_integrals_overlap] type: double precision doc: Overlap integrals in |AO| basis set size: (ao_basis.ao_num,ao_basis.ao_num) interface: ezfio [io_ao_integrals_overlap] type: Disk_access doc: Read/Write |AO| overlap integrals from/to disk [ Write | Read | None ] interface: ezfio,provider,ocaml default: None [ao_one_e_integrals] type: double precision doc: Combined integrals in |AO| basis set size: (ao_basis.ao_num,ao_basis.ao_num) interface: ezfio [io_ao_one_e_integrals] type: Disk_access doc: Read/Write |AO| one-electron integrals from/to disk [ Write | Read | None ] interface: ezfio,provider,ocaml default: None