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This commit is contained in:
Stan Gerald Moore
2021-09-14 10:56:03 -06:00
parent 3badb14b5a
commit 51cfbaa2ef
1 changed files with 21 additions and 21 deletions
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42
src/KOKKOS/fix_acks2_reaxff_kokkos.cpp
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@ -258,35 +258,35 @@ void FixACKS2ReaxFFKokkos<DeviceType>::pre_force(int vflag)
MPI_Request request;
if (comm->me == last_rows_rank)
MPI_Irecv(buf,2*nprev,MPI_DOUBLE,
prev_last_rows_rank,0,world,&request);
MPI_Irecv(buf,2*nprev,MPI_DOUBLE,
prev_last_rows_rank,0,world,&request);
if (comm->me == prev_last_rows_rank) {
// pack buffer
k_s_hist_last.template sync<LMPHostType>();
auto h_s_hist_last = k_s_hist_last.h_view;
int n = 0;
for (int k = 0; k < nprev; k++) {
buf[n++] = h_s_hist_last(0,k);
buf[n++] = h_s_hist_last(1,k);
}
// pack buffer
k_s_hist_last.template sync<LMPHostType>();
auto h_s_hist_last = k_s_hist_last.h_view;
int n = 0;
for (int k = 0; k < nprev; k++) {
buf[n++] = h_s_hist_last(0,k);
buf[n++] = h_s_hist_last(1,k);
}
MPI_Send(buf,2*nprev,MPI_DOUBLE,last_rows_rank,0,world);
MPI_Send(buf,2*nprev,MPI_DOUBLE,last_rows_rank,0,world);
}
if (comm->me == last_rows_rank) {
MPI_Wait(&request,MPI_STATUS_IGNORE);
MPI_Wait(&request,MPI_STATUS_IGNORE);
// unpack buffer
k_s_hist_last.template sync<LMPHostType>();
auto h_s_hist_last = k_s_hist_last.h_view;
int n = 0;
for (int k = 0; k < nprev; k++) {
h_s_hist_last(0,k) = buf[n++];
h_s_hist_last(1,k) = buf[n++];
}
k_s_hist_last.template modify<LMPHostType>();
// unpack buffer
k_s_hist_last.template sync<LMPHostType>();
auto h_s_hist_last = k_s_hist_last.h_view;
int n = 0;
for (int k = 0; k < nprev; k++) {
h_s_hist_last(0,k) = buf[n++];
h_s_hist_last(1,k) = buf[n++];
}
k_s_hist_last.template modify<LMPHostType>();
}
}