MDynamic1D Class Reference

#include <md1d.h>

List of all members.

Public Member Functions
void	addAtoms ()
	MDynamic1D (int natomes, double r0, double rcut, char *name)
void	printAtoms ()
void	printDatainOverlap (const double &R1, const double &R2)
int	UpdateAtomeAcceleration ()
void	UpdateAtomeAccelerationNew ()
	~MDynamic1D ()
Public Attributes
double *	sigma
Private Member Functions
int	UpdateAtomeAcceleration (int i)
Private Attributes
int	_nbSurfaceAtoms
double	r0

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Detailed Description

Definition at line 45 of file md1d.h.

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Constructor & Destructor Documentation

MDynamic1D::MDynamic1D	(	int	natomes,
		double	r0,
		double	rcut,
		char *	name
	)

MDynamic1D::~MDynamic1D

(

)

[inline]

Definition at line 49 of file md1d.h.

{};

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Member Function Documentation

void MDynamic1D::addAtoms

(

)

void MDynamic1D::printAtoms

(

)

void MDynamic1D::printDatainOverlap	(	const double &	R1,
		const double &	R2
	)

int MDynamic1D::UpdateAtomeAcceleration

(

int

i

)

[private]

int MDynamic1D::UpdateAtomeAcceleration

(

)

void MDynamic1D::UpdateAtomeAccelerationNew

(

)

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Member Data Documentation

int MDynamic1D::_nbSurfaceAtoms [private]

Definition at line 63 of file md1d.h.

double MDynamic1D::r0 [private]

Definition at line 64 of file md1d.h.

double* MDynamic1D::sigma

Definition at line 57 of file md1d.h.

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

• md/1d/md1d.h

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