Package etomica.data.meter

Class PotentialCalculationRDF

java.lang.Object

etomica.data.meter.PotentialCalculationRDF

All Implemented Interfaces:

PotentialCalculation

public class PotentialCalculationRDF
extends java.lang.Object
implements PotentialCalculation

PotentialCalculation that simply does the work of collecting an RDF.

Field Summary

Fields

Modifier and Type	Field	Description
protected Boundary	boundary
protected Vector	dr
protected long[]	gSum
protected DataSourceUniform	xDataSource
protected double	xMax

Constructor Summary

Constructors

Constructor	Description
PotentialCalculationRDF(Space space, Box box)

Method Summary

Modifier and Type	Method	Description
void	doCalculation(IAtomList atoms, IPotentialAtomic potential)	Method giving the specific calculation performed by this class.
long[]	getGSum()
DataSourceUniform	getXDataSource()
void	reset()	Zero's out the RDF sum tracked by this meter.
void	setBox(Box box)

Methods inherited from class java.lang.Object

clone, equals, finalize, getClass, hashCode, notify, notifyAll, toString, wait, wait, wait

Field Detail

dr

protected final Vector dr

gSum

protected long[] gSum

boundary

protected Boundary boundary

xDataSource

protected final DataSourceUniform xDataSource

xMax

protected double xMax

Constructor Detail

PotentialCalculationRDF

public PotentialCalculationRDF(Space space,
                               Box box)

Method Detail

getXDataSource

public DataSourceUniform getXDataSource()

setBox

public void setBox(Box box)

reset

public void reset()

Zero's out the RDF sum tracked by this meter.

doCalculation

public void doCalculation(IAtomList atoms,
                          IPotentialAtomic potential)

Description copied from interface: PotentialCalculation

Method giving the specific calculation performed by this class.

Specified by:

doCalculation in interface PotentialCalculation

Parameters:

atoms - IAtomSet the atom sets for which the calculation is performed.

potential - The potential used to apply the action defined by this class.

getGSum

public long[] getGSum()