Auxiliary Keylists
(Only in FILE47 Input for GENNBO)

Keylist Parms? Keylist Description Page
$BASIS Yes Atomic centers and angular symmetries of AOs B-67
$CONTRACT Yes Contaction coefficients and orbital exponents of AOs B-69
$COORD Yes Job title, atoms, Cartesian coordinates B-66
$DENSITY Yes Density matrix in AO basis B-71
$DIPOLE Yes Dipole matrix in AO basis B-71
$FOCK Yes Fock matrix in AO basis B-71
$GENNBO Yes Specify calculation model size, type and units B-65
$KINETIC Yes Kinetic energy matrix in AO basis B-71
$LCAOMO Yes Canonical MOs in AO basis B-71
$NUCLEAR Yes Nuclear-electron attraction matrix in AO basis B-71
$OVERLAP Yes Overlap matrix in AO basis B-71
These auxiliary keylists occur only in the GENNBO stand-alone input file (FILE47 archive file). They are prepared automatically by the program when the ARCHIVE keyword is specified, and should not be prepared by the user nor included in the standard NBO input stream.
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