fad_lj_grad.cpp File Reference

#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:

Go to the source code of this file.

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

vec3_distsq() [1/2]

template<typename T>

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

inline

Definition at line 54 of file fad_lj_grad.cpp.

vec3_distsq() [2/2]

template<typename T>

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

inline

Definition at line 63 of file fad_lj_grad.cpp.

lj()

template<typename T>

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

inline

Definition at line 72 of file fad_lj_grad.cpp.

lj_and_grad()

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

inline

Definition at line 80 of file fad_lj_grad.cpp.

do_time()

template<typename FadType>

double do_time

(

int

nloop

)

Definition at line 94 of file fad_lj_grad.cpp.

do_time_analytic()

double do_time_analytic

(

int

nloop

)

Definition at line 117 of file fad_lj_grad.cpp.

main()

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

Definition at line 136 of file fad_lj_grad.cpp.