Package etomica.virial

Class ConformationPhenanthreneTraPPE

java.lang.Object

etomica.virial.ConformationPhenanthreneTraPPE

All Implemented Interfaces:

IConformation, java.io.Serializable

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

Conformation for Phenanthrene Reference paper: TraPPE: 4 UA description of linear and branched alkanes and alkylbenzenes, Siepmann et al modified from naphthalene kept the axis and coorinated unchanged

See Also:

Serialized Form

Field Summary

Fields

Modifier and Type	Field	Description
protected static double	a
protected static double	bond
protected static double	fivea
protected static double	foura
protected static double	foursqrt3a
protected Space	space
protected static double	sqrt3a
protected static double	threesqrt3a
protected static double	twosqrt3a
protected Vector	vector

Constructor Summary

Constructors

Constructor	Description
ConformationPhenanthreneTraPPE(Space space)

Method Summary

Modifier and Type	Method	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 Space space

a

protected static final double a

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Constant Field Values

bond

protected static final double bond

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Constant Field Values

foura

protected static final double foura

See Also:

Constant Field Values

fivea

protected static final double fivea

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 Vector vector

Constructor Detail

ConformationPhenanthreneTraPPE

public ConformationPhenanthreneTraPPE(Space space)

Method Detail

initializePositions

public void initializePositions(IAtomList atomList)

Description copied from interface: IConformation

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

Specified by:

initializePositions in interface IConformation