From ab1e090e0e5aff5c943e25e64bc6e320d58c70a1 Mon Sep 17 00:00:00 2001 From: Axel Kohlmeyer Date: Thu, 29 Jun 2023 21:32:04 -0400 Subject: [PATCH] neighbor list skin is added to custom cutoff automatically --- src/KIM/pair_kim.cpp | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/src/KIM/pair_kim.cpp b/src/KIM/pair_kim.cpp index ae2e6e6ea0..8ac6fe1f75 100644 --- a/src/KIM/pair_kim.cpp +++ b/src/KIM/pair_kim.cpp @@ -596,7 +596,7 @@ void PairKIM::init_style() if (kim_cutoff_values[i] <= neighbor->skin) error->all(FLERR,"Illegal neighbor request (force cutoff {:.3} <= skin {:.3})", kim_cutoff_values[i], neighbor->skin); - req->set_cutoff(kim_cutoff_values[i] + neighbor->skin); + req->set_cutoff(kim_cutoff_values[i]); } // increment instance_me in case of need to change the neighbor list // request settings