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Man Pages


Manual Reference Pages  -  SC_INT1ECCA (3)

NAME

sc::Int1eCCA - Int1eCCA adapts CCA integrals components for use within SC.

CONTENTS

Synopsis

SYNOPSIS

#include <int1e.h>

Inherits sc::RefCount.

    Public Member Functions

    Int1eCCA (Integral *integral, const Ref< GaussianBasisSet > &b1, const Ref< GaussianBasisSet > &b2, int order, IntegralEvaluatorFactory, std::string, bool)    
double * buffer ()    
void overlap (int ish, int jsh)    
void overlap_1der (int ish, int jsh, Chemistry_QC_GaussianBasis_DerivCenters &dc)    
void kinetic (int ish, int jsh)    
void kinetic_1der (int ish, int jsh, Chemistry_QC_GaussianBasis_DerivCenters &dc)    
void nuclear (int ish, int jsh)    
void nuclear_1der (int ish, int jsh, Chemistry_QC_GaussianBasis_DerivCenters &dc)    
void hcore (int ish, int jsh)    
void hcore_1der (int ish, int jsh, Chemistry_QC_GaussianBasis_DerivCenters &dc)

    Protected Attributes

    Integral * integral_

    Additional Inherited Members

Detailed Description

Int1eCCA adapts CCA integrals components for use within SC.

It is used by OneBodyIntCCA and OneBodyDerivIntCCA to implement the IntegralCCA class.

Author

Generated automatically by Doxygen for MPQC from the source code.

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Version 2.3.1 SC::INT1ECCA (3) Sun Apr 3 2016

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