OpenMD  2.5
Molecular Dynamics in the Open
OpenMD::MetallicInteraction Class Referenceabstract

#include <NonBondedInteraction.hpp>

Inheritance diagram for OpenMD::MetallicInteraction:
OpenMD::NonBondedInteraction OpenMD::EAM OpenMD::SC

Public Member Functions

 MetallicInteraction ()
 
virtual ~MetallicInteraction ()
 
virtual void calcDensity (InteractionData &idat)=0
 
virtual void calcFunctional (SelfData &sdat)=0
 
virtual InteractionFamily getFamily ()
 
- Public Member Functions inherited from OpenMD::NonBondedInteraction
 NonBondedInteraction ()
 
virtual ~NonBondedInteraction ()
 
virtual void calcForce (InteractionData &idat)=0
 
virtual int getHash ()=0
 
virtual RealType getSuggestedCutoffRadius (pair< AtomType *, AtomType *> atypes)=0
 
virtual string getName ()=0
 

Detailed Description

The basic interface for metallic interactions.

Definition at line 222 of file NonBondedInteraction.hpp.

Constructor & Destructor Documentation

◆ MetallicInteraction()

OpenMD::MetallicInteraction::MetallicInteraction ( )
inline

Definition at line 224 of file NonBondedInteraction.hpp.

◆ ~MetallicInteraction()

virtual OpenMD::MetallicInteraction::~MetallicInteraction ( )
inlinevirtual

Definition at line 225 of file NonBondedInteraction.hpp.

Member Function Documentation

◆ calcDensity()

virtual void OpenMD::MetallicInteraction::calcDensity ( InteractionData idat)
pure virtual

Implemented in OpenMD::EAM, and OpenMD::SC.

◆ calcFunctional()

virtual void OpenMD::MetallicInteraction::calcFunctional ( SelfData sdat)
pure virtual

Implemented in OpenMD::EAM, and OpenMD::SC.

◆ getFamily()

virtual InteractionFamily OpenMD::MetallicInteraction::getFamily ( )
inlinevirtual

Implements OpenMD::NonBondedInteraction.

Definition at line 228 of file NonBondedInteraction.hpp.

References OpenMD::METALLIC_FAMILY.


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