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# DETCI

Performs configuration interaction (CI) computations of various types, including restricted-active-space (RAS) CI, full CI, the CI component of multi-configuration self-consistent-field (MCSCF) and complete-active-space self-consistent-field (CASSCF) computations, and arbitrary-order perturbation theory and arbitrary-order coupled-cluster computations for small molecules.

- `CI CORRELATION ENERGY`
- `CI DIPOLE X`
- `CI DIPOLE Y`
- `CI DIPOLE Z`
- `CI QUADRUPOLE XX`
- `CI QUADRUPOLE XY`
- `CI QUADRUPOLE XZ`
- `CI QUADRUPOLE YY`
- `CI QUADRUPOLE YZ`
- `CI QUADRUPOLE ZZ`
- `CI ROOT n -> ROOT m DIPOLE X`
- `CI ROOT n -> ROOT m DIPOLE Y`
- `CI ROOT n -> ROOT m DIPOLE Z`
- `CI ROOT n -> ROOT m QUADRUPOLE XX`
- `CI ROOT n -> ROOT m QUADRUPOLE XY`
- `CI ROOT n -> ROOT m QUADRUPOLE XZ`
- `CI ROOT n -> ROOT m QUADRUPOLE YY`
- `CI ROOT n -> ROOT m QUADRUPOLE YZ`
- `CI ROOT n -> ROOT m QUADRUPOLE ZZ`
- `CI ROOT n CORRELATION ENERGY`
- `CI ROOT n DIPOLE X`
- `CI ROOT n DIPOLE Y`
- `CI ROOT n DIPOLE Z`
- `CI ROOT n QUADRUPOLE XX`
- `CI ROOT n QUADRUPOLE XY`
- `CI ROOT n QUADRUPOLE XZ`
- `CI ROOT n QUADRUPOLE YY`
- `CI ROOT n QUADRUPOLE YZ`
- `CI ROOT n QUADRUPOLE ZZ`
- `CI ROOT n TOTAL ENERGY`
- `CI STATE-AVERAGED CORRELATION ENERGY`
- `CI STATE-AVERAGED TOTAL ENERGY`
- `CI TOTAL ENERGY`
- `CISD CORRELATION ENERGY`
- `CISD TOTAL ENERGY`
- `CISDT CORRELATION ENERGY`
- `CISDT TOTAL ENERGY`
- `CISDTQ CORRELATION ENERGY`
- `CISDTQ TOTAL ENERGY`
- `CIn CORRELATION ENERGY`
- `CIn TOTAL ENERGY`
- `CURRENT CORRELATION ENERGY`
- `CURRENT ENERGY`
- `CURRENT REFERENCE ENERGY`
- `FCI CORRELATION ENERGY`
- `FCI TOTAL ENERGY`
- `MPn CORRELATION ENERGY`
- `MPn TOTAL ENERGY`
- `ZAPTn CORRELATION ENERGY`
- `ZAPTn TOTAL ENERGY`

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