#include <ParenthesisTriples.hpp>

Inheritance diagram for sisi4s::ParenthesisTriples:

Collaboration diagram for sisi4s::ParenthesisTriples:

Public Member Functions
virtual std::string	getName ()

	ParenthesisTriples (std::vector< Argument > const &argumentList)

virtual	~ParenthesisTriples ()

virtual void	run ()
	Calculates perturbative triples correction, third attemp.

virtual void	dryRun ()
	Dry run for perturbative triples correction, third attemp.

Public Member Functions inherited from sisi4s::Algorithm
	Algorithm (std::vector< Argument > const &argumentList)

virtual	~Algorithm ()

virtual std::string	getName ()=0

virtual void	run ()=0

virtual void	dryRun ()
	The dryRun estimates resource consumption, especially memory and processor time.

bool	isArgumentGiven (std::string const &argumentName)

std::string	getTextArgument (std::string const &argumentName)

std::string	getTextArgument (std::string const &argumentName, std::string const &defaultValue)

bool	getBooleanArgument (std::string const &name)

bool	getBooleanArgument (std::string const &name, bool const &defaultValue)

int64_t	getIntegerArgument (std::string const &argumentName)

int64_t	getIntegerArgument (std::string const &argumentName, int64_t const defaultValue)

real	getRealArgument (std::string const &argumentName)

real	getRealArgument (std::string const &argumentName, real const defaultValue)

template<typename F = real, typename T = Tensor<F>>
T *	getTensorArgument (std::string const &argumentName)

template<typename F = real, typename C = std::vector<F>>
C *	getContainerArgument (std::string const &argumentName)

template<typename F = real, typename C = std::vector<F>>
void	allocateContainerArgument (std::string const &argumentName, C *container)

std::vector< std::string >	getGivenArgumentNames () const

void	checkArgumentsOrDie (const std::vector< std::string > args) const

template<typename F = real, typename T = Tensor<F>>
void	allocatedTensorArgument (std::string const &argumentName, T *tensor)
	Specifies the location of an output tensor data.

void	setRealArgument (std::string const &argumentName, real const value)

void	setIntegerArgument (std::string const &argumentName, int const value)

real	getRealArgumentFromInteger (IntegerData *data)

real	getRealArgumentFromTensor (TensorData< real > *data)

template<typename F = real, typename T = Tensor<F>>
T *	getTensorArgumentFromReal (RealData *realData)
	Converts the given real data into a scalar tensor.

Data *	getArgumentData (std::string const &argumentName)

Static Public Attributes
static sisi4s::AlgorithmRegistrar< ParenthesisTriples >	registrar_

Protected Member Functions
double	getEnergy (const double epsijk, const double Tabc_, const double Zabc_)

void	doublesContribution (const std::array< int64_t, 3 > &ijk, IJKPointer integralContainer, double scratchV, double scratchO, double *output)

void	singlesContribution (const std::array< int64_t, 3 > &ijk, double scratchO, double output)

void	getVpppijkFromVertex (const std::array< int64_t, 3 > &ijk, double scratchO, double output)

IJKPointer	getVpppijkOnTheFly (const std::array< int64_t, 3 > &ijk, VectorTensor< double > &vtensor)

Protected Attributes
int64_t	No

int64_t	Nv

int64_t	NG

int64_t	NvCube

double *	Tabc

double *	Zabc

double *	scratch

double *	Tabij

double *	Tai

double *	epsi

double *	epsa

double *	Vabij

double *	Vhphh

double *	Vppph = nullptr

double *	Vpppijk = nullptr

double *	realGab = nullptr

double *	imagGab = nullptr

double *	realGai = nullptr

double *	imagGai = nullptr

bool	particleDiagram = true

bool	holeDiagram = true

Additional Inherited Members
Public Attributes inherited from sisi4s::Algorithm
std::string	note

bool	fallible = false

std::map< std::string, std::string >	arguments

Constructor & Destructor Documentation

◆ ParenthesisTriples()

ParenthesisTriples::ParenthesisTriples ( std::vector< Argument > const & argumentList )

◆ ~ParenthesisTriples()

ParenthesisTriples::~ParenthesisTriples ( )

virtual

Member Function Documentation

◆ doublesContribution()

void ParenthesisTriples::doublesContribution	(	const std::array< int64_t, 3 > &	ijk,
		IJKPointer	integralContainer,
		double *	scratchV,
		double *	scratchO,
		double *	output
	)

protected

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◆ dryRun()

void ParenthesisTriples::dryRun ( )

virtual

Dry run for perturbative triples correction, third attemp.

Reimplemented from sisi4s::Algorithm.

◆ getEnergy()

double ParenthesisTriples::getEnergy	(	const double	epsijk,
		const double *	Tabc_,
		const double *	Zabc_
	)

protected

◆ getName()

virtual std::string sisi4s::ParenthesisTriples::getName ( )

inlinevirtual

Implements sisi4s::Algorithm.

◆ getVpppijkFromVertex()

void ParenthesisTriples::getVpppijkFromVertex	(	const std::array< int64_t, 3 > &	ijk,
		double *	scratchO,
		double *	output
	)

protected

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◆ getVpppijkOnTheFly()

IJKPointer ParenthesisTriples::getVpppijkOnTheFly	(	const std::array< int64_t, 3 > &	ijk,
		VectorTensor< double > &	vtensor
	)

protected

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◆ run()

void ParenthesisTriples::run ( )

virtual

Calculates perturbative triples correction, third attemp.

Implements sisi4s::Algorithm.

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◆ singlesContribution()

void ParenthesisTriples::singlesContribution	(	const std::array< int64_t, 3 > &	ijk,
		double *	scratchO,
		double *	output
	)

protected

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Member Data Documentation

◆ epsa

double * sisi4s::ParenthesisTriples::epsa

protected

◆ epsi

double* sisi4s::ParenthesisTriples::epsi

protected

◆ holeDiagram

bool sisi4s::ParenthesisTriples::holeDiagram = true

protected

◆ imagGab

double * sisi4s::ParenthesisTriples::imagGab = nullptr

protected

◆ imagGai

double * sisi4s::ParenthesisTriples::imagGai = nullptr

protected

◆ NG

int64_t sisi4s::ParenthesisTriples::NG

protected

◆ No

int64_t sisi4s::ParenthesisTriples::No

protected

◆ Nv

int64_t sisi4s::ParenthesisTriples::Nv

protected

◆ NvCube

int64_t sisi4s::ParenthesisTriples::NvCube

protected

◆ particleDiagram

bool sisi4s::ParenthesisTriples::particleDiagram = true

protected

◆ realGab

double* sisi4s::ParenthesisTriples::realGab = nullptr

protected

◆ realGai

double * sisi4s::ParenthesisTriples::realGai = nullptr

protected

◆ registrar_

sisi4s::AlgorithmRegistrar< ParenthesisTriples > ParenthesisTriples::registrar_

static

◆ scratch

double* sisi4s::ParenthesisTriples::scratch

protected

◆ Tabc

double* sisi4s::ParenthesisTriples::Tabc

protected

◆ Tabij

double* sisi4s::ParenthesisTriples::Tabij

protected

◆ Tai

double * sisi4s::ParenthesisTriples::Tai

protected

◆ Vabij

double* sisi4s::ParenthesisTriples::Vabij

protected

◆ Vhphh

double * sisi4s::ParenthesisTriples::Vhphh

protected

◆ Vppph

double * sisi4s::ParenthesisTriples::Vppph = nullptr

protected

◆ Vpppijk

double* sisi4s::ParenthesisTriples::Vpppijk = nullptr

protected

◆ Zabc

double* sisi4s::ParenthesisTriples::Zabc

protected

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

Public Member Functions

Static Public Attributes

Protected Member Functions

Protected Attributes

Additional Inherited Members

Constructor & Destructor Documentation

◆ ParenthesisTriples()

◆ ~ParenthesisTriples()

Member Function Documentation

◆ doublesContribution()

◆ dryRun()

◆ getEnergy()

◆ getName()

◆ getVpppijkFromVertex()

◆ getVpppijkOnTheFly()

◆ run()

◆ singlesContribution()

Member Data Documentation

◆ epsa

◆ epsi

◆ holeDiagram

◆ imagGab

◆ imagGai

◆ NG

◆ No

◆ Nv

◆ NvCube

◆ particleDiagram

◆ realGab

◆ realGai

◆ registrar_

◆ scratch

◆ Tabc

◆ Tabij

◆ Tai

◆ Vabij

◆ Vhphh

◆ Vppph

◆ Vpppijk

◆ Zabc