sc_Orbital man page
sc::Orbital
Synopsis
Inherits sc::Volume.
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_
Additional Inherited Members
Member Function Documentation
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.
Author
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Info
Fri Aug 4 2017 Version 2.3.1 MPQC