Package etomica.virial

Class MayerDFQFHDTSpherical

java.lang.Object

etomica.virial.MayerDFQFHDTSpherical

All Implemented Interfaces:

MayerFunction

public class MayerDFQFHDTSpherical
extends java.lang.Object
implements MayerFunction

Required for computing temperature derivatives of virial coefficients computed with quadratic Feynmann-Hibbs modification to the potential.

Constructor Summary

Constructors

Constructor	Description
MayerDFQFHDTSpherical(P2EffectiveFeynmanHibbs potential)	Constructor for MayerESpherical.

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

Constructor Detail

MayerDFQFHDTSpherical

public MayerDFQFHDTSpherical(P2EffectiveFeynmanHibbs potential)

Constructor for MayerESpherical.

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

See Also:

etomica.virial.MayerFunctionSpherical#f(etomica.AtomPair, double, double)

setBox

public void setBox(Box newBox)

Specified by:

setBox in interface MayerFunction

getPotential

public IPotential getPotential()

Specified by:

getPotential in interface MayerFunction

Returns: