*POPULATION ANALYSIS

Purpose:

To direct population analysis of the wave function. Requires a set of natural orbitals and their occupation.

.ALL

Do all options.

.GROSSALL

Do all gross population analysis. Note that this requires that the dipole length integrals are available on the file AOPROPER

.GROSSMO

Do gross MO population analysis.

.MULLIKEN

Do Mulliken population analysis

.NETALL

Do all net population analysis.

.NETMO

Do net MO population analysis.

.PRINT

Default = 1
READ (LUINP,*) IPRMUL
Print level for population analysis.

.VIRIAL

Do virial analysis.