A Volume is a Function of three variables. More...
#include <volume.h>
Inheritance diagram for sc::Volume:
Public Member Functions | |
| Volume (const Ref< KeyVal > &) | |
| void | set_gradient (const SCVector3 &g) |
| void | set_gradient (RefSCVector &g) |
| void | get_gradient (SCVector3 &g) |
| void | set_x (const SCVector3 &x) |
| void | set_x (const RefSCVector &x) |
| Set and retrieve the coordinate values. | |
| void | get_x (SCVector3 &x) |
| virtual void | boundingbox (double valuemin, double valuemax, SCVector3 &p1, SCVector3 &p2)=0 |
| virtual void | interpolate (const SCVector3 &p1, const SCVector3 &p2, double value, SCVector3 &result) |
| virtual void | solve (const SCVector3 &p, const SCVector3 &grad, double value, SCVector3 &result) |
Protected Member Functions | |
| double & | interpolation_accuracy () |
| virtual void | compute ()=0 |
| Recompute at least the results that have compute true and are not already computed. | |
| virtual void | failure (const char *) |
Detailed Description
Member Function Documentation
| virtual void sc::Volume::compute | ( | ) | [protected, pure 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::Compute.
Implemented in sc::BatchElectronDensity, sc::Shape, sc::ElectronDensity, and sc::Orbital.
The documentation for this class was generated from the following files: