Package etomica.virial

Class MayerPTAtt

java.lang.Object

etomica.virial.MayerPTAtt

All Implemented Interfaces:

MayerFunction

public class MayerPTAtt
extends java.lang.Object
implements MayerFunction

Mayer function class that returns temperature expansion bond of the desired order using molecular potentials.

Field Summary

Fields

Modifier and Type	Field	Description
protected long	factOrder
protected int	order
protected IPotentialMolecular	potentialAtt
protected IPotentialMolecular	potentialRef

Constructor Summary

Constructors

Constructor	Description
MayerPTAtt(IPotentialMolecular potentialRef, IPotentialMolecular potentialAtt, int order)	Constructor takes reference potential, attractive component and order in temperature.

Method Summary

Modifier and Type	Method	Description
double	f(IMoleculeList pair, double r2, double beta)	returns Mayer function between atoms in the pair at temperature 1/beta
IPotential	getPotential()
void	setBox(Box newBox)

Methods inherited from class java.lang.Object

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

Field Detail

potentialRef

protected final IPotentialMolecular potentialRef

potentialAtt

protected final IPotentialMolecular potentialAtt

order

protected final int order

factOrder

protected final long factOrder

Constructor Detail

MayerPTAtt

public MayerPTAtt(IPotentialMolecular potentialRef,
                  IPotentialMolecular potentialAtt,
                  int order)

Constructor takes reference potential, attractive component and order in temperature.

Method Detail

f

public double f(IMoleculeList pair,
                double r2,
                double beta)

Description copied from interface: MayerFunction

returns Mayer function between atoms in the pair at temperature 1/beta

Specified by:

f in interface MayerFunction

r2 - TODO

setBox

public void setBox(Box newBox)

Specified by:

setBox in interface MayerFunction

getPotential

public IPotential getPotential()

Specified by:

getPotential in interface MayerFunction

Returns: