sc::Int1eCCA(3) MPQC sc::Int1eCCA(3)NAME
sc::Int1eCCA - Int1eCCA adapts CCA integrals components for use within
SC.
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.
Version 2.3.1 Fri Feb 19 2016 sc::Int1eCCA(3)
