Package etomica.association.AceticAcid

Class Wertheim2SiteAceticAcid

java.lang.Object

etomica.association.AceticAcid.Wertheim2SiteAceticAcid

public class Wertheim2SiteAceticAcid
extends java.lang.Object

Wertheim coefficients calculation for acetic acid using IMPROVED OPLS united-atom model. For the calculation of diagrams having fR only, Hard-Sphere system is used as reference. For the calculation of diagrams having F, Hard-Chain system is used as reference.

Nested Class Summary

Nested Classes

Modifier and Type	Class	Description
static class	Wertheim2SiteAceticAcid.WertheimParam	Inner class for parameters

Constructor Summary

Constructors

Constructor	Description
Wertheim2SiteAceticAcid()

Method Summary

Modifier and Type	Method	Description
static void	main(java.lang.String[] args)

Methods inherited from class java.lang.Object

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

Constructor Detail

Wertheim2SiteAceticAcid

public Wertheim2SiteAceticAcid()

Method Detail

main

public static void main(java.lang.String[] args)