xtpdft.h File Reference

#include <string>
#include "votca/xtp/dftengine.h"
#include "votca/xtp/orbitals.h"
#include "votca/xtp/orbreorder.h"
#include "votca/xtp/polarsite.h"
#include "votca/xtp/qmpackage.h"

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Classes
class	votca::xtp::XTPDFT
	Wrapper for the internal XTP DFT engine. More...

Namespaces
namespace	votca
	Provides a means for comparing floating point numbers.
namespace	votca::xtp
	Charge transport classes.

Macros
#define	VOTCA_XTP_XTPDFT_H

Macro Definition Documentation

VOTCA_XTP_XTPDFT_H

#define VOTCA_XTP_XTPDFT_H

Definition at line 22 of file xtpdft.h.