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_
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.