This implements one body integrals through the CCA interface. More...
#include <obintcca.h>
Public Member Functions | |
| OneBodyIntCCA (Integral *, const Ref< GaussianBasisSet > &, const Ref< GaussianBasisSet > &, IntegralEvaluatorFactory, IntegralFunction, bool) | |
| 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(sc::Int1eCCA::* | IntegralFunction )(int, int) |
Protected Attributes | |
| Ref< sc::Int1eCCA > | int1ecca_ |
| IntegralFunction | intfunc_ |
This implements one body integrals through the CCA interface.
It is given a function pointer to the IntCCA member that computes the particular integral of interest.
| Ref<OneBodyInt> sc::OneBodyIntCCA::clone | ( | ) | [virtual] |
Returns a clone of this.
The default implementation throws an exception.
Reimplemented from sc::OneBodyInt.
| bool sc::OneBodyIntCCA::cloneable | ( | ) | [virtual] |
Return true if the clone member can be called.
The default implementation returns false.
Reimplemented from sc::OneBodyInt.
| void sc::OneBodyIntCCA::compute_shell | ( | int | , | |
| int | ||||
| ) | [virtual] |
Computes the integrals between basis functions in the given shell pair.
Implements sc::OneBodyInt.