Merge pull request #34 from evenmn/evenmn-patch-1

Update computer.py
evenmn · Aug 23, 2023 · e7bc6d0 · e7bc6d0
2 parents 822f36f + 8e0e166
commit e7bc6d0
Showing 1 changed file with 0 additions and 1 deletion.
diff --git a/lammps_simulator/computer.py b/lammps_simulator/computer.py
@@ -201,7 +201,6 @@ def __init__(self, gpu_per_node=1, lmp_exec="lmp", lmp_args={},
                                 "-sf": "kk"}
         elif mode == "gpu":
             default_lmp_args = {"-pk": "gpu newton on neigh full",
-                                "-k": f"on g {self.gpu_per_node}",
                                 "-sf": "gpu"}
         else:
             raise NotImplementedError