etomica.virial

Class ConformationAnthraceneTraPPE

java.lang.Object

etomica.virial.ConformationAnthraceneTraPPE

All Implemented Interfaces:

IConformation, java.io.Serializable

public class ConformationAnthraceneTraPPE
extends java.lang.Object
implements IConformation, java.io.Serializable

Conformation for Anthracene Reference paper: TraPPE: 4 UA description of linear and branched alkanes and alkylbenzenes, Siepmann et al modified from naphthalene conformation

See Also:

Serialized Form

Field Summary

Fields

Modifier and Type	Field and Description
protected static double	a
protected static double	bond
protected static double	foursqrt3a
protected ISpace	space
protected static double	sqrt3a
protected static double	threesqrt3a
protected static double	twosqrt3a
protected IVectorMutable	vector

Constructor Summary

Constructors

Constructor and Description
ConformationAnthraceneTraPPE(ISpace space)

Method Summary

Modifier and Type	Method and Description
void	initializePositions(IAtomList atomList) Defined by subclass to assign coordinates to the atoms in the given list.

Methods inherited from class java.lang.Object

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

Field Detail

space

protected final ISpace space

a

protected static final double a

See Also:

Constant Field Values

bond

protected static final double bond

See Also:

Constant Field Values

sqrt3a

protected static final double sqrt3a

twosqrt3a

protected static final double twosqrt3a

threesqrt3a

protected static final double threesqrt3a

foursqrt3a

protected static final double foursqrt3a

vector

protected IVectorMutable vector

Constructor Detail

ConformationAnthraceneTraPPE

public ConformationAnthraceneTraPPE(ISpace space)

Method Detail

initializePositions

public void initializePositions(IAtomList atomList)

Description copied from interface: etomica.config.IConformation

Defined by subclass to assign coordinates to the atoms in the given list.

Specified by:

initializePositions in interface IConformation