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Feb2021 GPU Package Update - GPU Package Files

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This commit is contained in:
Michael Brown
2021-02-15 08:20:50 -08:00
parent 16004e8f45
commit e7e2d2323b
345 changed files with 13424 additions and 7708 deletions
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14
lib/gpu/lal_vashishta_ext.cpp
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@ -32,7 +32,7 @@ int vashishta_gpu_init(const int ntypes, const int inum, const int nall, const i
const double* gamma, const double* eta,
const double* lam1inv, const double* lam4inv,
const double* zizj, const double* mbigd,
const double* dvrc, const double* big6w,
const double* dvrc, const double* big6w,
const double* heta, const double* bigh,
const double* bigw, const double* c0,
const double* costheta, const double* bigb,
@ -63,10 +63,10 @@ int vashishta_gpu_init(const int ntypes, const int inum, const int nall, const i
int init_ok=0;
if (world_me==0)
init_ok=VashishtaMF.init(ntypes, inum, nall, 500, cell_size, gpu_split, screen,
init_ok=VashishtaMF.init(ntypes, inum, nall, max_nbors, cell_size, gpu_split, screen,
host_map, nelements, host_elem2param, nparams,
cutsq, r0, gamma, eta, lam1inv,
lam4inv, zizj, mbigd, dvrc, big6w, heta, bigh, bigw,
cutsq, r0, gamma, eta, lam1inv,
lam4inv, zizj, mbigd, dvrc, big6w, heta, bigh, bigw,
c0, costheta, bigb, big2b, bigc);
VashishtaMF.device->world_barrier();
@ -83,10 +83,10 @@ int vashishta_gpu_init(const int ntypes, const int inum, const int nall, const i
fflush(screen);
}
if (gpu_rank==i && world_me!=0)
init_ok=VashishtaMF.init(ntypes, inum, nall, 500, cell_size, gpu_split, screen,
init_ok=VashishtaMF.init(ntypes, inum, nall, max_nbors, cell_size, gpu_split, screen,
host_map, nelements, host_elem2param, nparams,
cutsq, r0, gamma, eta, lam1inv,
lam4inv, zizj, mbigd, dvrc, big6w, heta, bigh, bigw,
cutsq, r0, gamma, eta, lam1inv,
lam4inv, zizj, mbigd, dvrc, big6w, heta, bigh, bigw,
c0, costheta, bigb, big2b, bigc);
VashishtaMF.device->gpu_barrier();