charge Directory Reference

Contains the implementation of the isotropic second-order electrostatics.

More...

Files
	effective.f90
	Provides an effective Coulomb operator for isotropic electrostatic interactions.
	gamma.f90
	Provides the DFTB Coulomb functional for isotropic electrostatic interactions.
	type.f90
	Provides a general base class for electrostatic interactions.

Detailed Description

Contains the implementation of the isotropic second-order electrostatics.