psi::MatrixFactory Class Reference
[libmints: Integral library]

A class for creating Matrix, SimpleMatrix, Vector, and SimpleVector objects. More...

#include <factory.h>

List of all members.

Public Member Functions
	MatrixFactory ()
	Default constructor, does nothing.
	MatrixFactory (const MatrixFactory &copy)
	Copy constructor.
bool	init_with_chkpt (shared_ptr< psi::PSIO > psio)
	Initializes the matrix factory by creating a chkpt object with a psio reference.
bool	init_with_chkpt (shared_ptr< psi::Chkpt > chkpt)
	Initializes the matrix factory using the given chkpt object.
bool	init_with (int nirreps, int *rowspi, int *colspi)
	Manually initialize the matrix factory.
int	nirreps () const
	Returns number of irreps.
int *	rowspi () const
	Returns the rows per irrep array.
int	nrows (int h) const
	Returns the number of rows in irrep h.
int *	colspi () const
	Returns the columns per irrep array.
int	ncols (int h) const
	Returns the number of columns in irrep h.
int	nso () const
	Returns the number of orbitals.
Matrix *	create_matrix ()
	Returns a new Matrix object with default dimensions.
void	create_matrix (Matrix &mat)
Matrix *	create_matrix (std::string name)
	Returns a new Matrix object named name with default dimensions.
void	create_matrix (Matrix &mat, std::string name)
Vector *	create_vector ()
	Returns a new Vector object with default dimensions.
void	create_vector (Vector &vec)
SimpleMatrix *	create_simple_matrix ()
	Returns a new SimpleMatrix object with default dimensions.
void	create_simple_matrix (SimpleMatrix &mat)
SimpleMatrix *	create_simple_matrix (std::string name)
	Returns a new SimpleMatrix object named name with default dimensions.
void	create_simple_matrix (SimpleMatrix &mat, std::string name)
SimpleMatrix *	create_simple_matrix (std::string name, int m, int n)
	Returns a new SimpleMatrix object named name of size m x n.
void	create_simple_matrix (SimpleMatrix &mat, std::string name, int m, int n)
SimpleMatrix *	create_simple_matrix (int m, int n)
	Returns a new SimpleMatrix object with size m x n.
void	create_simple_matrix (SimpleMatrix &mat, int m, int n)
SimpleVector *	create_simple_vector ()
	Returns a new SimpleVector object with default dimension.
SimpleVector *	create_simple_vector (int m)
	Returns a new SimpleVector object with size m.

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Detailed Description

A class for creating Matrix, SimpleMatrix, Vector, and SimpleVector objects.

The objects this factory creates can automatically be sized based on information from checkpoint.

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

• factory.h
• factory.cc