*POPULATION ANALYSIS  

Purpose:

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

.ALL  

Do all options

.DIPMOM  

Calculate dipole moments 

.GROSSALL  

Do all gross population analysis 

.GROSSMO  

Do gross MO population analysis 

.MULLIKEN  

Do Mulliken population analysis s 

.NETALL  

Do all net population analysis 

.NETMO  

Do net MO population analysis 

.PRINT  

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

.QUADRP  

Calculate quadrupole moments 

.VIRIAL  

  Do virial analysis