tblite
Light-weight tight-binding framework
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molmom.f90 File Reference

Provides model for the calculation of molecular multipole moments for the converged singlepoint. More...

Data Types

type  tblite_param_molecular_moments::molecular_multipole_record
 Parametrization record specifying the dispersion model. More...
 
type  tblite_param_molecular_moments::molmom_mask
 Masking for the dispersion model. More...
 
interface  tblite_param_molecular_moments::count
 

Detailed Description

Provides model for the calculation of molecular multipole moments for the converged singlepoint.