ERIs.h File Reference

#include "threecenter.h"

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Classes
class	votca::xtp::ERIs
	Takes a density matrix and and an auxiliary basis set and calculates the electron repulsion integrals. More...

Namespaces
namespace	votca
	base class for all analysis tools
namespace	votca::xtp
	Charge transport classes.

Macros
#define	VOTCA_XTP_ERIS_H

Macro Definition Documentation

VOTCA_XTP_ERIS_H

#define VOTCA_XTP_ERIS_H

Definition at line 22 of file ERIs.h.