#include "Sacado_Random.hpp"
#include "Sacado_No_Kokkos.hpp"
#include "Fad/fad.h"
#include "TinyFadET/tfad.h"
#include "Teuchos_Time.hpp"
#include "Teuchos_CommandLineProcessor.hpp"

Include dependency graph for fad_lj_grad.cpp:

Functions
template<typename T >
T	vec3_distsq (const T xi[], const double xj[])

template<typename T >
T	vec3_distsq (const T xi[], const double xj[], T delr[])

template<typename T >
void	lj (const T xi[], const double xj[], T &energy)

void	lj_and_grad (const double xi[], const double xj[], double &energy, double f[])

template<typename FadType >
double	do_time (int nloop)

double	do_time_analytic (int nloop)

int	main (int argc, char *argv[])

Function Documentation

template<typename T >

T vec3_distsq	(	const T	xi[],
		const double	xj[]
	)

inline

Definition at line 32 of file fad_lj_grad.cpp.

template<typename T >

T vec3_distsq	(	const T	xi[],
		const double	xj[],
		T	delr[]
	)

inline

Definition at line 41 of file fad_lj_grad.cpp.

template<typename T >

void lj	(	const T	xi[],
		const double	xj[],
		T &	energy
	)

inline

Definition at line 50 of file fad_lj_grad.cpp.

void lj_and_grad	(	const double	xi[],
		const double	xj[],
		double &	energy,
		double	f[]
	)

inline

Definition at line 58 of file fad_lj_grad.cpp.

template<typename FadType >

double do_time ( int nloop )

Definition at line 72 of file fad_lj_grad.cpp.

double do_time_analytic ( int nloop )

Definition at line 95 of file fad_lj_grad.cpp.

int main	(	int	argc,
		char *	argv[]
	)

Definition at line 114 of file fad_lj_grad.cpp.

Functions

Function Documentation