sisi4s::EomOneBodyReducedDensityMatrix< F > Class Template Reference

This implements one body rdm for eom ccsd In principle it calculates p T <0| L \rho R e |0> q For L and R being singles doubles vectors without 0-th components. More...

#include <OneBodyReducedDensityMatrix.hpp>

Inheritance diagram for sisi4s::EomOneBodyReducedDensityMatrix< F >:

Collaboration diagram for sisi4s::EomOneBodyReducedDensityMatrix< F >:

Public Member Functions
	EomOneBodyReducedDensityMatrix (Tensor< F > *Tai_, Tensor< F > *Tabij_, const SDFockVector< F > *L_, const SDFockVector< F > *R_)
std::shared_ptr< Tensor< F > >	getAI () override
std::shared_ptr< Tensor< F > >	getIJ () override
std::shared_ptr< Tensor< F > >	getAB () override
std::shared_ptr< Tensor< F > >	getIA () override
Public Member Functions inherited from sisi4s::OneBodyReducedDensityMatrix< F >
	~OneBodyReducedDensityMatrix ()
virtual std::shared_ptr< Tensor< F > >	getIA ()=0
virtual std::shared_ptr< Tensor< F > >	getAI ()=0
virtual std::shared_ptr< Tensor< F > >	getIJ ()=0
virtual std::shared_ptr< Tensor< F > >	getAB ()=0

Detailed Description

template<typename F>
class sisi4s::EomOneBodyReducedDensityMatrix< F >

This implements one body rdm for eom ccsd In principle it calculates p T <0| L \rho R e |0> q For L and R being singles doubles vectors without 0-th components.

Constructor & Destructor Documentation

EomOneBodyReducedDensityMatrix()

template<typename F >

sisi4s::EomOneBodyReducedDensityMatrix< F >::EomOneBodyReducedDensityMatrix ( Tensor< F > *  Tai_, Tensor< F > *  Tabij_, const SDFockVector< F > *  L_, const SDFockVector< F > *  R_  )

inline

Member Function Documentation

getAB()

template<typename F >

std::shared_ptr< Tensor< F > > sisi4s::EomOneBodyReducedDensityMatrix< F >::getAB ( )

inlineoverridevirtual

Implements sisi4s::OneBodyReducedDensityMatrix< F >.

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getAI()

template<typename F >

std::shared_ptr< Tensor< F > > sisi4s::EomOneBodyReducedDensityMatrix< F >::getAI ( )

inlineoverridevirtual

Implements sisi4s::OneBodyReducedDensityMatrix< F >.

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getIA()

template<typename F >

std::shared_ptr< Tensor< F > > sisi4s::EomOneBodyReducedDensityMatrix< F >::getIA ( )

inlineoverridevirtual

Implements sisi4s::OneBodyReducedDensityMatrix< F >.

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getIJ()

template<typename F >

std::shared_ptr< Tensor< F > > sisi4s::EomOneBodyReducedDensityMatrix< F >::getIJ ( )

inlineoverridevirtual

Implements sisi4s::OneBodyReducedDensityMatrix< F >.

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

• OneBodyReducedDensityMatrix.hpp