Fixed wrong number of threadblock being launched
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7e8fd96fa4
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@ -125,7 +125,7 @@ void updatePbc_cuda(Atom *atom, Parameter *param, Atom *c_atom, bool doReneighbo
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MD_FLOAT yprd = param->yprd;
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MD_FLOAT zprd = param->zprd;
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const int num_blocks = ceil((float)atom->Nlocal / (float)num_threads_per_block);
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const int num_blocks = ceil((float)atom->Nghost / (float)num_threads_per_block);
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/*__global__ void computePbcUpdate(Atom a, int* PBCx, int* PBCy, int* PBCz,
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* MD_FLOAT xprd, MD_FLOAT yprd, MD_FLOAT zprd)
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@ -241,4 +241,4 @@ void growPbc(Atom *atom) {
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PBCy = (int *) reallocate(PBCy, ALIGNMENT, NmaxGhost * sizeof(int), nold * sizeof(int));
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PBCz = (int *) reallocate(PBCz, ALIGNMENT, NmaxGhost * sizeof(int), nold * sizeof(int));
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}
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}
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}
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