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Merge pull request #1608 from wmbrownIntel/intel-eam-eatom-fix 

Bug fix for eam/intel per-atom energy calculation.
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Axel Kohlmeyer 2019-08-02 10:42:54 -04:00 committed by GitHub
parent 9c691ddd0f 074ae06b36
commit a857e7f790
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src/USER-INTEL/pair_eam_intel.cpp
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@ -451,7 +451,6 @@ void PairEAMIntel::eval(const int offload, const int vflag,
if (tid == 0)
comm->forward_comm_pair(this);
if (NEWTON_PAIR) memset(f + minlocal, 0, f_stride * sizeof(FORCE_T));
#if defined(_OPENMP)
#pragma omp barrier