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compute_temp_cuda.h
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Fri, Oct 4, 23:15
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Sun, Oct 6, 23:15 (1 d, 23 h)
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rLAMMPS lammps
compute_temp_cuda.h
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/* ----------------------------------------------------------------------
LAMMPS - Large-scale Atomic/Molecular Massively Parallel Simulator
Original Version:
http://lammps.sandia.gov, Sandia National Laboratories
Steve Plimpton, sjplimp@sandia.gov
See the README file in the top-level LAMMPS directory.
-----------------------------------------------------------------------
USER-CUDA Package and associated modifications:
https://sourceforge.net/projects/lammpscuda/
Christian Trott, christian.trott@tu-ilmenau.de
Lars Winterfeld, lars.winterfeld@tu-ilmenau.de
Theoretical Physics II, University of Technology Ilmenau, Germany
See the README file in the USER-CUDA directory.
This software is distributed under the GNU General Public License.
------------------------------------------------------------------------- */
/* ----------------------------------------------------------------------
LAMMPS - Large-scale Atomic/Molecular Massively Parallel Simulator
http://lammps.sandia.gov, Sandia National Laboratories
Steve Plimpton, sjplimp@sandia.gov
Copyright (2003) Sandia Corporation. Under the terms of Contract
DE-AC04-94AL85000 with Sandia Corporation, the U.S. Government retains
certain rights in this software. This software is distributed under
the GNU General Public License.
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#ifdef COMPUTE_CLASS
ComputeStyle
(
temp
/
cuda
,
ComputeTempCuda
)
#else
#ifndef LMP_COMPUTE_TEMP_CUDA_H
#define LMP_COMPUTE_TEMP_CUDA_H
#include "compute.h"
#include "cuda_data.h"
namespace
LAMMPS_NS
{
class
ComputeTempCuda
:
public
Compute
{
public:
ComputeTempCuda
(
class
LAMMPS
*
,
int
,
char
**
);
~
ComputeTempCuda
();
void
init
();
double
compute_scalar
();
void
compute_vector
();
private:
class
Cuda
*
cuda
;
int
fix_dof
;
double
tfactor
;
void
dof_compute
();
double
t_vector
[
6
];
double
t_scalar
;
cCudaData
<
double
,
ENERGY_FLOAT
,
x
>*
cu_t_scalar
;
cCudaData
<
double
,
ENERGY_FLOAT
,
x
>*
cu_t_vector
;
};
}
#endif
#endif
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