sc::Int2eCCA Class Reference

Int2eCCA adapts CCA integrals components for use within SC. More...

#include <int2e.h>

Inheritance diagram for sc::Int2eCCA:

List of all members.

Public Member Functions
	Int2eCCA (Integral *integral, const Ref< GaussianBasisSet > &b1, const Ref< GaussianBasisSet > &b2, const Ref< GaussianBasisSet > &b3, const Ref< GaussianBasisSet > &b4, int order, size_t storage, IntegralEvaluatorFactory, bool, string)
double *	buffer ()
void	compute_erep (int is, int js, int ks, int ls)
void	compute_erep_1der (int is, int js, int ks, int ls, Chemistry::QC::GaussianBasis::DerivCenters &dc)
int	redundant () const
void	set_redundant (int i)
Protected Attributes
Integral *	integral_

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Detailed Description

Int2eCCA adapts CCA integrals components for use within SC.

It is used by TwoBodyIntCCA and TwoBodyDerivIntCCA to implement the IntegralCCA class.

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

• intcca/int2e.h