TBTK::GaussianState Class Reference

Inheritance diagram for TBTK::GaussianState:

Public Member Functions
	GaussianState (const Index &index, const Vector3d &coordinates, unsigned int linearIndex, unsigned int basisSize)
virtual GaussianState *	clone () const
virtual std::complex< double >	getOverlap (const AbstractState &ket) const
virtual std::complex< double >	getMatrixElement (const AbstractState &ket, const AbstractOperator &o) const
void	setOverlap (const std::complex< double > &overlap, unsigned int linearKetIndex)
void	setKineticTerm (const std::complex< double > &kineticTerm, unsigned int linearKetIndex)
void	setNuclearTerm (const std::complex< double > &nuclearTerm, unsigned int linearKetIndex)
Public Member Functions inherited from TBTK::AbstractState
	AbstractState (StateID stateID)
virtual	~AbstractState ()
StateID	getStateID () const
void	setCoordinates (std::initializer_list< double > coordinates)
void	setCoordinates (const std::vector< double > &coordinates)
void	setSpecifiers (std::initializer_list< int > specifiers)
void	setSpecifiers (const std::vector< int > &specifiers)
void	setIndex (const Index &index)
void	setContainer (const Index &container)
void	setExtent (double extent)
const std::vector< double > &	getCoordinates () const
const std::vector< int > &	getSpecifiers () const
const Index &	getIndex () const
const Index &	getContainer () const
double	getExtent () const
bool	hasFiniteExtent () const
std::string	serialize (Mode mode) const
Public Member Functions inherited from TBTK::Serializable
template<>
std::string	serialize (const bool &data, Mode mode)
template<>
std::string	serialize (const double &data, Mode mode)
template<>
std::string	serialize (const std::complex< double > &data, Mode mode)
template<>
std::string	serialize (const int &data, Mode mode)
template<>
std::string	serialize (const unsigned int &data, Mode mode)
template<>
std::string	serialize (const SpinMatrix &data, Mode mode)
template<>
std::string	serialize (const Statistics &data, Mode mode)
template<>
std::string	serialize (const std::vector< std::complex< double >> &data, Mode mode)
template<>
int	deserialize (const std::string &serialization, Mode mode)
template<>
unsigned int	deserialize (const std::string &serialization, Mode mode)
template<>
double	deserialize (const std::string &serialization, Mode mode)
template<>
std::complex< double >	deserialize (const std::string &serialization, Mode mode)
template<>
SpinMatrix	deserialize (const std::string &serialization, Mode mode)
template<>
Statistics	deserialize (const std::string &serialization, Mode mode)
template<>
std::vector< std::complex< double > >	deserialize (const std::string &serialization, Mode mode)

Additional Inherited Members
Public Types inherited from TBTK::AbstractState
enum	StateID { Basic = 0, STO3G = 1, Gaussian = 2 }
Public Types inherited from TBTK::Serializable
enum	Mode { Debug, Binary, XML, JSON }
Static Public Member Functions inherited from TBTK::Serializable
static bool	hasID (const std::string &serialization, Mode mode)
static std::string	getID (const std::string &serialization, Mode mode)
static std::string	extractComponent (const std::string &serialization, const std::string &containerID, const std::string &componentID, const std::string &componentName, Mode mode)
Static Protected Member Functions inherited from TBTK::Serializable
static bool	validate (const std::string &serialization, const std::string &id, Mode mode)
static std::string	getContent (const std::string &serialization, Mode mode)
static std::vector< std::string >	split (const std::string &content, Mode mode)
template<typename DataType >
static std::enable_if<!std::is_pointer< DataType >::value, std::string >::type	serialize (const DataType &data, Mode mode)
template<typename DataType >
static std::enable_if< std::is_pointer< DataType >::value, std::string >::type	serialize (const DataType &data, Mode mode)
template<typename DataType >
static DataType	deserialize (const std::string &serialization, Mode mode)
static std::string	extract (const std::string &serialization, Mode mode, std::string component)

Constructor & Destructor Documentation

GaussianState()

TBTK::GaussianState::GaussianState	(	const Index &	index,
		const Vector3d &	coordinates,
		unsigned int	linearIndex,
		unsigned int	basisSize
	)

Constructor.

Member Function Documentation

clone()

GaussianState * TBTK::GaussianState::clone ( ) const

inlinevirtual

Implements AbstracState::clone().

Implements TBTK::AbstractState.

getMatrixElement()

virtual std::complex<double> TBTK::GaussianState::getMatrixElement ( const AbstractState &  ket, const AbstractOperator &  o  ) const

virtual

Implements AbstractState::getMatrixElement().

Implements TBTK::AbstractState.

getOverlap()

virtual std::complex<double> TBTK::GaussianState::getOverlap ( const AbstractState &  ket ) const

virtual

Implements AbstractState::getOverlap().

Implements TBTK::AbstractState.

setKineticTerm()

void TBTK::GaussianState::setKineticTerm ( const std::complex< double > &  kineticTerm, unsigned int  linearKetIndex  )

inline

Set kinetic term.

Parameters

kineticTerm	The value of the kinetic term.
linearKetIndex	The linear index of the ket that the kinetic term corresponds to.

setNuclearTerm()

void TBTK::GaussianState::setNuclearTerm ( const std::complex< double > &  nuclearTerm, unsigned int  linearKetIndex  )

inline

Set nuclear term.

Parameters

nuclearTerm	The value of the nuclear term.
linearKetIndex	The linear index of the ket that the nuclear term corresponds to.

setOverlap()

void TBTK::GaussianState::setOverlap ( const std::complex< double > &  overlap, unsigned int  linearKetIndex  )

inline

Set overlap.

Parameters

overlap	The value of the overlap.
linearKetIndex	The linear index of the ket that the overlap corresponds to.

---

The documentation for this class was generated from the following file:

• /home/kristofer.bjornson/SecondQuantizationCom/TBTK/Lib/include/StatesAndOperators/TBTK/GaussianState.h