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lammps/lib/cuda/fix_temp_rescale_limit_cuda.cu
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fix_temp_rescale_limit_cuda.cu
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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 <stdio.h>
#define MY_PREFIX fix_temp_rescale_limit_cuda
#include "cuda_shared.h"
#include "cuda_common.h"
#include "crm_cuda_utils.cu"
#include "fix_temp_rescale_limit_cuda_cu.h"
#include "fix_temp_rescale_limit_cuda_kernel.cu"
void Cuda_FixTempRescaleLimitCuda_UpdateNmax(cuda_shared_data* sdata)
{
cudaMemcpyToSymbol(MY_CONST(mask) , & sdata->atom.mask .dev_data, sizeof(int*) );
cudaMemcpyToSymbol(MY_CONST(nlocal) , & sdata->atom.nlocal , sizeof(int) );
cudaMemcpyToSymbol(MY_CONST(nmax) , & sdata->atom.nmax , sizeof(int) );
cudaMemcpyToSymbol(MY_CONST(v) , & sdata->atom.v .dev_data, sizeof(X_FLOAT*) );
}
void Cuda_FixTempRescaleLimitCuda_Init(cuda_shared_data* sdata)
{
Cuda_FixTempRescaleLimitCuda_UpdateNmax(sdata);
}
void Cuda_FixTempRescaleLimitCuda_EndOfStep(cuda_shared_data* sdata, int groupbit,double afactor,double limit)
{
V_FLOAT factor=afactor;
//if(sdata->atom.update_nmax) //fix temp rescale is usually not called every timestep so it might miss an update step
Cuda_FixTempRescaleLimitCuda_UpdateNmax(sdata);
//if(sdata->atom.update_nlocal)
//cudaMemcpyToSymbol(MY_CONST(nlocal) , & sdata->atom.nlocal , sizeof(int) );
int3 layout=getgrid(sdata->atom.nlocal);
dim3 threads(layout.z, 1, 1);
dim3 grid(layout.x, layout.y, 1);
Cuda_FixTempRescaleLimitCuda_EndOfStep_Kernel<<<grid, threads,0>>> (groupbit,factor,limit);
cudaThreadSynchronize();
CUT_CHECK_ERROR("Cuda_Cuda_FixTempRescaleLimitCuda_PostForce: fix add_force post_force compute Kernel execution failed");
}
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