OpenMD  2.5
Molecular Dynamics in the Open
OpenMD::LennardJonesAdapter Class Reference

#include <LennardJonesAdapter.hpp>

Public Member Functions

 LennardJonesAdapter (AtomType *AT)
void makeLennardJones (RealType sigma, RealType epsilon, bool isSoft)
bool isLennardJones ()
RealType getSigma ()
RealType getEpsilon ()
bool isSoft ()

Private Member Functions

LJAtypeParametersgetLJParam ()

Private Attributes


Detailed Description

Definition at line 61 of file LennardJonesAdapter.hpp.

Constructor & Destructor Documentation

◆ LennardJonesAdapter()

OpenMD::LennardJonesAdapter::LennardJonesAdapter ( AtomType AT)

Definition at line 63 of file LennardJonesAdapter.hpp.

References OpenMD::epsilon.

Member Function Documentation

◆ getEpsilon()

RealType OpenMD::LennardJonesAdapter::getEpsilon ( )

◆ getLJParam()

◆ getSigma()

◆ isLennardJones()

◆ isSoft()

bool OpenMD::LennardJonesAdapter::isSoft ( )

Definition at line 99 of file LennardJonesAdapter.cpp.

References getLJParam(), and OpenMD::LJAtypeParameters::isSoft.

Referenced by makeLennardJones().

◆ makeLennardJones()

Member Data Documentation

◆ at_

AtomType* OpenMD::LennardJonesAdapter::at_

Definition at line 72 of file LennardJonesAdapter.hpp.

Referenced by getLJParam(), isLennardJones(), and makeLennardJones().

The documentation for this class was generated from the following files: