Merge pull request #40 from pyiron/lmp_atom_modify

reordering of input items in Lammps
pyiron · Jan 26, 2021 · d9145e6 · d9145e6
2 parents a47a13b + b3990c3
commit d9145e6
Showing 1 changed file with 4 additions and 1 deletion.
diff --git a/pyiron_atomistics/lammps/control.py b/pyiron_atomistics/lammps/control.py
@@ -126,11 +126,14 @@ def dataset(self):
     def _init_block_dict(self):
         block_dict = OrderedDict()
         block_dict["read_restart"] = "read_restart"
-        block_dict["structure"] = (
+        block_dict["environment"] = (
             "units",
             "dimension",
             "boundary",
             "atom_style",
+            "atom_modify",
+        )
+        block_dict["structure"] = (
             "read_data",
             "include",
         )