Package etomica.virial

Class ClusterWheatleySoftMixBD

java.lang.Object

etomica.virial.ClusterWheatleySoftBD

etomica.virial.ClusterWheatleySoftMixBD

All Implemented Interfaces:

ClusterAbstract

public class ClusterWheatleySoftMixBD
extends ClusterWheatleySoftBD

Cluster class using Whealtey's recursion with BigDecimal to handle mixtures.

Field Summary

Fields

Modifier and Type	Field	Description
protected MayerFunction[][]	fMap
protected MayerFunction[][]	mixF
protected int[]	nTypes

Fields inherited from class etomica.virial.ClusterWheatleySoftBD

BDONE, BDZERO, beta, cPairID, doCaching, f, fA, fB, fC, fQ, lastCPairID, lastValue, mc, n, pushme, tol, value

Constructor Summary

Constructors

Constructor	Description
ClusterWheatleySoftMixBD(int nPoints, int[] nTypes, MayerFunction[][] f, int precision)

Method Summary

Modifier and Type	Method	Description
ClusterAbstract	makeCopy()	Returns another instance of an identical cluster (shallow copy).
protected void	updateF(BoxCluster box)

Methods inherited from class etomica.virial.ClusterWheatleySoftBD

calcFullFQ, calcValue, pointCount, setDoCaching, setTemperature, value

Methods inherited from class java.lang.Object

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

Field Detail

mixF

protected final MayerFunction[][] mixF

nTypes

protected final int[] nTypes

fMap

protected final MayerFunction[][] fMap

Constructor Detail

ClusterWheatleySoftMixBD

public ClusterWheatleySoftMixBD(int nPoints,
                                int[] nTypes,
                                MayerFunction[][] f,
                                int precision)

Method Detail

makeCopy

public ClusterAbstract makeCopy()

Description copied from interface: ClusterAbstract

Returns another instance of an identical cluster (shallow copy).

Specified by:

makeCopy in interface ClusterAbstract

Overrides:

makeCopy in class ClusterWheatleySoftBD

updateF

protected void updateF(BoxCluster box)

Overrides:

updateF in class ClusterWheatleySoftBD