psi::mcscf::SBlockMatrix Class Reference

#include <sblock_matrix.h>

Public Member Functions
	SBlockMatrix ()
	SBlockMatrix (std::string label, int nirreps, size_t *&rows_size, size_t *&cols_size)
	SBlockMatrix (std::string label, int nirreps, int *&rows_size, int *&cols_size)
	SBlockMatrix (std::string label, int nirreps, vecint &rows_size, vecint &cols_size)
	~SBlockMatrix ()
void	allocate (std::string label, int nirreps, size_t *&rows_size, size_t *&cols_size)
void	allocate (std::string label, int nirreps, int *&rows_size, int *&cols_size)
void	allocate (std::string label, int nirreps, vecint &rows_size, vecint &cols_size)
void	subtract_reference ()
	SBlockMatrix (SBlockMatrix &src)
SBlockMatrix &	operator= (SBlockMatrix &src)
SBlockMatrix &	operator+= (SBlockMatrix &src)
SBlockMatrix &	operator-= (SBlockMatrix &src)
const BlockMatrix *	operator-> () const
BlockMatrix *	operator-> ()
BlockMatrix *	getBlockMatrix ()
void	multiply (bool transpose_A, bool transpose_B, SBlockMatrix &A, SBlockMatrix &B)
void	diagonalize (SBlockMatrix &eigenmatrix, SBlockVector &eigenvalues)
void	transpose ()
void	scale (double factor)
bool	is_allocated ()
void	check (const char *cstr)

Private Member Functions
	SBlockMatrix (BlockMatrix *block_matrix)

Private Attributes
BlockMatrix *	block_matrix_

Friends
double	dot (SBlockMatrix &A, SBlockMatrix &B)

Constructor & Destructor Documentation

psi::mcscf::SBlockMatrix::SBlockMatrix

(

)

psi::mcscf::SBlockMatrix::SBlockMatrix	(	std::string	label,
		int	nirreps,
		size_t *&	rows_size,
		size_t *&	cols_size
	)

psi::mcscf::SBlockMatrix::SBlockMatrix	(	std::string	label,
		int	nirreps,
		int *&	rows_size,
		int *&	cols_size
	)

psi::mcscf::SBlockMatrix::SBlockMatrix	(	std::string	label,
		int	nirreps,
		vecint &	rows_size,
		vecint &	cols_size
	)

psi::mcscf::SBlockMatrix::~SBlockMatrix ( )

inline

psi::mcscf::SBlockMatrix::SBlockMatrix

(

SBlockMatrix &

src

)

psi::mcscf::SBlockMatrix::SBlockMatrix ( BlockMatrix *  block_matrix )

private

Member Function Documentation

void psi::mcscf::SBlockMatrix::allocate	(	std::string	label,
		int	nirreps,
		size_t *&	rows_size,
		size_t *&	cols_size
	)

void psi::mcscf::SBlockMatrix::allocate	(	std::string	label,
		int	nirreps,
		int *&	rows_size,
		int *&	cols_size
	)

void psi::mcscf::SBlockMatrix::allocate	(	std::string	label,
		int	nirreps,
		vecint &	rows_size,
		vecint &	cols_size
	)

void psi::mcscf::SBlockMatrix::check

(

const char *

cstr

)

void psi::mcscf::SBlockMatrix::diagonalize	(	SBlockMatrix &	eigenmatrix,
		SBlockVector &	eigenvalues
	)

BlockMatrix* psi::mcscf::SBlockMatrix::getBlockMatrix ( )

inline

bool psi::mcscf::SBlockMatrix::is_allocated ( )

inline

void psi::mcscf::SBlockMatrix::multiply	(	bool	transpose_A,
		bool	transpose_B,
		SBlockMatrix &	A,
		SBlockMatrix &	B
	)

SBlockMatrix & psi::mcscf::SBlockMatrix::operator+=

(

SBlockMatrix &

src

)

SBlockMatrix & psi::mcscf::SBlockMatrix::operator-=

(

SBlockMatrix &

src

)

const BlockMatrix* psi::mcscf::SBlockMatrix::operator-> ( ) const

inline

BlockMatrix* psi::mcscf::SBlockMatrix::operator-> ( )

inline

SBlockMatrix & psi::mcscf::SBlockMatrix::operator=

(

SBlockMatrix &

src

)

void psi::mcscf::SBlockMatrix::scale ( double  factor )

inline

void psi::mcscf::SBlockMatrix::subtract_reference ( )

inline

void psi::mcscf::SBlockMatrix::transpose ( )

inline

Friends And Related Function Documentation

double dot ( SBlockMatrix &  A, SBlockMatrix &  B  )

friend

Member Data Documentation

BlockMatrix* psi::mcscf::SBlockMatrix::block_matrix_

private

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

• sblock_matrix.h
• sblock_matrix.cc