From dd4f79e2b8db1db894e65602e07548aa78df35ee Mon Sep 17 00:00:00 2001 From: athomps Date: Wed, 8 Oct 2014 21:16:40 +0000 Subject: [PATCH] Added rhomax assignment git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12624 f3b2605a-c512-4ea7-a41b-209d697bcdaa --- src/USER-OMP/pair_eam_alloy_omp.cpp | 1 + src/USER-OMP/pair_eam_fs_omp.cpp | 1 + 2 files changed, 2 insertions(+) diff --git a/src/USER-OMP/pair_eam_alloy_omp.cpp b/src/USER-OMP/pair_eam_alloy_omp.cpp index bee33d9f44..40a93c143e 100644 --- a/src/USER-OMP/pair_eam_alloy_omp.cpp +++ b/src/USER-OMP/pair_eam_alloy_omp.cpp @@ -220,6 +220,7 @@ void PairEAMAlloyOMP::file2array() nr = setfl->nr; drho = setfl->drho; dr = setfl->dr; + rhomax = (nrho-1) * drho; // ------------------------------------------------------------------ // setup frho arrays diff --git a/src/USER-OMP/pair_eam_fs_omp.cpp b/src/USER-OMP/pair_eam_fs_omp.cpp index d602ff0215..ec12bcefad 100644 --- a/src/USER-OMP/pair_eam_fs_omp.cpp +++ b/src/USER-OMP/pair_eam_fs_omp.cpp @@ -225,6 +225,7 @@ void PairEAMFSOMP::file2array() nr = fs->nr; drho = fs->drho; dr = fs->dr; + rhomax = (nrho-1) * drho; // ------------------------------------------------------------------ // setup frho arrays