sc::onebodyintv3(3)
NAME
sc::OneBodyIntV3 - This implements most one body integrals in the IntV3
library.
SYNOPSIS
#include <obintv3.h> Inherits sc::OneBodyInt. Public Member Functions OneBodyIntV3 (Integral *, const Ref< GaussianBasisSet > &, const Ref< GaussianBasisSet > &, IntegralFunction) void compute_shell (int, int) Computes the integrals between basis functions in the given shell pair. bool cloneable () Return true if the clone member can be called. Ref< OneBodyInt > clone () Returns a clone of this. Protected Types typedef void(Int1eV3::* IntegralFunction )(int, int) Protected Attributes Ref< Int1eV3 > int1ev3_ IntegralFunction intfunc_
Detailed Description
This implements most one body integrals in the IntV3 library.
It is given a function pointer to the Int1eV3 member that computes the
particular integral of interest.
Member Function Documentation
- void sc::OneBodyIntV3::compute_shell (int, int) [virtual]
- Computes the integrals between basis functions in the given shell pair.
- Implements sc::OneBodyInt.
- bool sc::OneBodyIntV3::cloneable () [virtual]
- Return true if the clone member can be called.
- The default implementation returns false.
- Reimplemented from sc::OneBodyInt.
- Ref<OneBodyInt> sc::OneBodyIntV3::clone () [virtual]
- Returns a clone of this.
- The default implementation throws an exception.
- Reimplemented from sc::OneBodyInt.
Author
- Generated automatically by Doxygen for MPQC from the source code.