#include <obintcints.h>
Inheritance diagram for sc::OneBodyIntCints:
Public Member Functions | |
OneBodyIntCints (Integral *, const Ref< GaussianBasisSet > &, const Ref< GaussianBasisSet > &, IntegralFunction) | |
void | set_multipole_origin (const Ref< DipoleData > &) |
void | set_EdotV_origin (const Ref< EfieldDotVectorData > &) |
void | set_Q_origin (const Ref< PointChargeData > &) |
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. |
It is given a function pointer to the Int1e member that computes the particular integral of interest.
void sc::OneBodyIntCints::compute_shell | ( | int | , | |
int | ||||
) | [virtual] |
bool sc::OneBodyIntCints::cloneable | ( | ) | [virtual] |
Return true if the clone member can be called.
The default implementation returns false.
Reimplemented from sc::OneBodyInt.
Ref<OneBodyInt> sc::OneBodyIntCints::clone | ( | ) | [virtual] |
Returns a clone of this.
The default implementation throws an exception.
Reimplemented from sc::OneBodyInt.