votca::xtp::Symmetric_Matrix Class Reference

#include <symmetric_matrix.h>

Collaboration diagram for votca::xtp::Symmetric_Matrix:

Public Member Functions
	Symmetric_Matrix ()=default
	Symmetric_Matrix (Index dim)
	Symmetric_Matrix (const Eigen::MatrixXd &full)
Index	size () const
double	TraceofProd (const Symmetric_Matrix &a) const
void	AddtoEigenMatrix (Eigen::MatrixXd &full, double factor=1.0) const
void	AddtoEigenUpperMatrix (Eigen::SelfAdjointView< Eigen::MatrixXd, Eigen::Upper > &upper, double factor=1.0) const
Eigen::MatrixXd	FullMatrix () const
Eigen::MatrixXd	UpperMatrix () const
double &	operator() (Index i, Index j)
const double &	operator() (Index i, Index j) const

Private Member Functions
Index	index (Index i, Index j) const

Private Attributes
std::vector< double >	data
Index	dimension

Friends
std::ostream &	operator<< (std::ostream &out, const Symmetric_Matrix &a)

Detailed Description

Definition at line 37 of file symmetric_matrix.h.

Constructor & Destructor Documentation

Symmetric_Matrix() [1/3]

votca::xtp::Symmetric_Matrix::Symmetric_Matrix ( )

default

Symmetric_Matrix() [2/3]

votca::xtp::Symmetric_Matrix::Symmetric_Matrix ( Index dim )

inline

Definition at line 40 of file symmetric_matrix.h.

Symmetric_Matrix() [3/3]

votca::xtp::Symmetric_Matrix::Symmetric_Matrix

(

const Eigen::MatrixXd &

full

)

Definition at line 30 of file symmetric_matrix.cc.

Member Function Documentation

AddtoEigenMatrix()

void votca::xtp::Symmetric_Matrix::AddtoEigenMatrix	(	Eigen::MatrixXd &	full,
		double	factor = 1.0 ) const

Definition at line 74 of file symmetric_matrix.cc.

AddtoEigenUpperMatrix()

void votca::xtp::Symmetric_Matrix::AddtoEigenUpperMatrix	(	Eigen::SelfAdjointView< Eigen::MatrixXd, Eigen::Upper > &	upper,
		double	factor = 1.0 ) const

Definition at line 90 of file symmetric_matrix.cc.

FullMatrix()

Eigen::MatrixXd votca::xtp::Symmetric_Matrix::FullMatrix

(

)

const

Definition at line 102 of file symmetric_matrix.cc.

index()

Index votca::xtp::Symmetric_Matrix::index ( Index i, Index j ) const

private

Definition at line 129 of file symmetric_matrix.cc.

operator()() [1/2]

double & votca::xtp::Symmetric_Matrix::operator() ( Index i, Index j )

inline

Definition at line 62 of file symmetric_matrix.h.

operator()() [2/2]

const double & votca::xtp::Symmetric_Matrix::operator() ( Index i, Index j ) const

inline

Definition at line 64 of file symmetric_matrix.h.

size()

Index votca::xtp::Symmetric_Matrix::size ( ) const

inline

Definition at line 47 of file symmetric_matrix.h.

TraceofProd()

double votca::xtp::Symmetric_Matrix::TraceofProd

(

const Symmetric_Matrix &

a

)

const

Definition at line 57 of file symmetric_matrix.cc.

UpperMatrix()

Eigen::MatrixXd votca::xtp::Symmetric_Matrix::UpperMatrix

(

)

const

Definition at line 118 of file symmetric_matrix.cc.

Friends And Related Symbol Documentation

operator<<

std::ostream & operator<< ( std::ostream & out, const Symmetric_Matrix & a )

friend

Definition at line 41 of file symmetric_matrix.cc.

Member Data Documentation

data

std::vector<double> votca::xtp::Symmetric_Matrix::data

private

Definition at line 73 of file symmetric_matrix.h.

dimension

Index votca::xtp::Symmetric_Matrix::dimension

private

Definition at line 74 of file symmetric_matrix.h.

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

• xtp/include/votca/xtp/symmetric_matrix.h
• xtp/src/libxtp/symmetric_matrix.cc