From 16d73c86ba1d1345cb7f9a4f4edc67e68185a1a3 Mon Sep 17 00:00:00 2001 From: Steve Plimpton Date: Thu, 26 Aug 2021 13:37:00 -0600 Subject: [PATCH] adjust example TTM input scripts --- examples/ttm/in.ttm | 3 ++- examples/ttm/in.ttm.grid | 3 ++- examples/ttm/pot_iron.mod | 2 -- 3 files changed, 4 insertions(+), 4 deletions(-) delete mode 100644 examples/ttm/pot_iron.mod diff --git a/examples/ttm/in.ttm b/examples/ttm/in.ttm index 77bc09add2..1b259cfc19 100644 --- a/examples/ttm/in.ttm +++ b/examples/ttm/in.ttm @@ -20,7 +20,8 @@ create_atoms 1 region atom_box mass 1 55.845 -include pot_iron.mod +pair_style eam/fs +pair_coeff * * FeVoter-ChenRecheck.fs Fe neighbor 2.0 bin neigh_modify every 5 delay 0 check yes diff --git a/examples/ttm/in.ttm.grid b/examples/ttm/in.ttm.grid index 56d7a4d1ad..2e3c622823 100644 --- a/examples/ttm/in.ttm.grid +++ b/examples/ttm/in.ttm.grid @@ -20,7 +20,8 @@ create_atoms 1 region atom_box mass 1 55.845 -include pot_iron.mod +pair_style eam/fs +pair_coeff * * FeVoter-ChenRecheck.fs Fe neighbor 2.0 bin neigh_modify every 5 delay 0 check yes diff --git a/examples/ttm/pot_iron.mod b/examples/ttm/pot_iron.mod deleted file mode 100644 index 450cd00541..0000000000 --- a/examples/ttm/pot_iron.mod +++ /dev/null @@ -1,2 +0,0 @@ -pair_style eam/fs -pair_coeff * * FeVoter-ChenRecheck.fs Fe