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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7141 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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sjplimp
2011-10-20 14:32:57 +00:00
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lib/cuda/pair_sw_cuda_cu.h Normal file
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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.
------------------------------------------------------------------------- */
#include "cuda_shared.h"
struct ParamSW_Float {
F_FLOAT epsilon,sigma;
F_FLOAT littlea,lambda,gamma,costheta;
F_FLOAT biga,bigb;
F_FLOAT powerp,powerq;
F_FLOAT tol;
F_FLOAT cut,cutsq;
F_FLOAT sigma_gamma,lambda_epsilon,lambda_epsilon2;
F_FLOAT c1,c2,c3,c4,c5,c6;
int ielement,jelement,kelement;
};
extern "C" void Cuda_PairSWCuda_Init(cuda_shared_data* sdata,ParamSW_Float* params_host,void* map_host, void* elem2param_host,int nelements_h);
extern "C" void Cuda_PairSWCuda(cuda_shared_data* sdata, cuda_shared_neighlist* sneighlist, int eflag, int vflag,int eflag_atom,int vflag_atom);