eam.h File Reference

Compute forces for the Embedded Atom Model (EAM). More...

#include "mytype.h"

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Data Structures
struct	ForceExchangeDataSt
	Pointers to the data that is needed in the load and unload functions for the force halo exchange. More...

Typedefs
typedef struct ForceExchangeDataSt	ForceExchangeData
	Pointers to the data that is needed in the load and unload functions for the force halo exchange. More...

Functions
struct BasePotentialSt *	initEamPot (const char *dir, const char *file, const char *type)
	Allocate and initialize the EAM potential data structure. More...

Detailed Description

Compute forces for the Embedded Atom Model (EAM).

Definition in file eam.h.

Typedef Documentation

typedef struct ForceExchangeDataSt ForceExchangeData

Pointers to the data that is needed in the load and unload functions for the force halo exchange.

See Also

loadForceBuffer

unloadForceBuffer

Function Documentation

struct BasePotentialSt* initEamPot ( const char *  dir, const char *  file, const char *  type  )

read

Allocate and initialize the EAM potential data structure.

Parameters

[in]	dir	The directory in which potential table files are found.
[in]	file	The name of the potential table file.
[in]	type	The file format of the potential file (setfl or funcfl).

Definition at line 171 of file eam.c.

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