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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10492 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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sjplimp
2013-07-30 20:40:02 +00:00
parent 059eb04e39
commit c612b724df
12 changed files with 169 additions and 15 deletions
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24
src/GPU/fix_gpu.cpp
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@ -19,7 +19,6 @@
#include "pair.h"
#include "respa.h"
#include "input.h"
#include "error.h"
#include "timer.h"
#include "modify.h"
#include "update.h"
@ -27,6 +26,8 @@
#include "universe.h"
#include "gpu_extra.h"
#include "neighbor.h"
#include "citeme.h"
#include "error.h"
using namespace LAMMPS_NS;
using namespace FixConst;
@ -42,11 +43,32 @@ extern void lmp_clear_device();
extern double lmp_gpu_forces(double **f, double **tor, double *eatom,
double **vatom, double *virial, double &ecoul);
static const char cite_gpu_package[] =
"GPU package (short-range and long-range):\n\n"
"@Article{Brown11,\n"
" author = {W. M. Brown, P. Wang, S. J. Plimpton, A. N. Tharrington},\n"
" title = {Implementing Molecular Dynamics on Hybrid High Performance Computers - Short Range Forces},\n"
" journal = {Comp.~Phys.~Comm.},\n"
" year = 2011,\n"
" volume = 182,\n"
" pages = {898--911}\n"
"}\n\n"
"@Article{Brown12,\n"
" author = {W. M. Brown, A. Kohlmeyer, S. J. Plimpton, A. N. Tharrington},\n"
" title = {Implementing Molecular Dynamics on Hybrid High Performance Computers - Particle-Particle Particle-Mesh},\n"
" journal = {Comp.~Phys.~Comm.},\n"
" year = 2012,\n"
" volume = 183,\n"
" pages = {449--459}\n"
"}\n\n"
/* ---------------------------------------------------------------------- */
FixGPU::FixGPU(LAMMPS *lmp, int narg, char **arg) :
Fix(lmp, narg, arg)
{
if (lmp->citeme) lmp->citeme->add(cite_gpu_package);
if (lmp->cuda)
error->all(FLERR,"Cannot use fix GPU with USER-CUDA mode enabled");