Unverified Commit 177044cd authored by Stan Moore's avatar Stan Moore Committed by GitHub
Browse files

Merge pull request #1142 from stanmoore1/kk_eam 

Fix bug in Kokkos EAM
parents dba8f9c6 57b2f605

src/KOKKOS/pair_eam_alloy_kokkos.cpp

+3 −0
Original line number Diff line number Diff line
@@ -165,6 +165,9 @@ void PairEAMAlloyKokkos<DeviceType>::compute(int eflag_in, int vflag_in) 
      }

    }



    if (need_dup)

      Kokkos::Experimental::contribute(d_rho, dup_rho);



    // communicate and sum densities (on the host)



    if (newton_pair) {

src/KOKKOS/pair_eam_fs_kokkos.cpp

+3 −0
Original line number Diff line number Diff line
@@ -165,6 +165,9 @@ void PairEAMFSKokkos<DeviceType>::compute(int eflag_in, int vflag_in) 
      }

    }



    if (need_dup)

      Kokkos::Experimental::contribute(d_rho, dup_rho);



    // communicate and sum densities (on the host)



    if (newton_pair) {

src/KOKKOS/pair_eam_kokkos.cpp

+3 −0
Original line number Diff line number Diff line
@@ -159,6 +159,9 @@ void PairEAMKokkos<DeviceType>::compute(int eflag_in, int vflag_in) 
      }

    }



    if (need_dup)

      Kokkos::Experimental::contribute(d_rho, dup_rho);



    // communicate and sum densities (on the host)



    if (newton_pair) {

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