MPQC 2.3.1
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Public Member Functions | |
Orbital (const Ref< KeyVal > &) | |
Orbital (const Ref< OneBodyWavefunction > &, int orbital) | |
virtual void | boundingbox (double valuemin, double valuemax, SCVector3 &p1, SCVector3 &p2) |
Protected Member Functions | |
virtual void | compute () |
Recompute at least the results that have compute true and are not already computed. | |
Protected Attributes | |
Ref< OneBodyWavefunction > | wfn_ |
int | orbital_ |
virtual void sc::Orbital::compute | ( | ) | [protected, virtual] |
Recompute at least the results that have compute true and are not already computed.
This should only be called by Result's members.
Implements sc::Volume.