Man Linux: Main Page and Category List

NAME

       sc::OneBodyDerivIntCCA -

       This implements one body derivative integrals.

SYNOPSIS

       #include <obintcca.h>

       Inherits sc::OneBodyDerivInt.

   Public Member Functions
       OneBodyDerivIntCCA (Integral *, const Ref< GaussianBasisSet > &, const
           Ref< GaussianBasisSet > &, IntegralEvaluatorFactory, bool, string)
       void compute_shell (int, int, DerivCenters &)
           Compute the derivative integrals and place the result in the buffer
           returned by buffer().
       void compute_shell (int, int, int)
           Compute the derivative integrals with respect to the given center
           and place the result in the buffer returned by buffer().

   Protected Types
       typedef void(Int1eCCA::* IntegralFunction )(int, int, DerivCenters &)

   Protected Attributes
       Ref< Int1eCCA > int1ecca_

Detailed Description

       This implements one body derivative integrals.

       It is given a function pointer to the Int1eCCA member that computes the
       particular integral of interest.

Member Function Documentation

   void sc::OneBodyDerivIntCCA::compute_shell (int ish, int jsh, int center)
       [virtual]
       Compute the derivative integrals with respect to the given center and
       place the result in the buffer returned by buffer().

       Implements sc::OneBodyDerivInt.

   void sc::OneBodyDerivIntCCA::compute_shell (int ish, int jsh, DerivCenters
       &) [virtual]
       Compute the derivative integrals and place the result in the buffer
       returned by buffer().

       Implements sc::OneBodyDerivInt.

Author

       Generated automatically by Doxygen for MPQC from the source code.