Changed AtomicFunction's default pbc value to True

RedesignScience · Jan 20, 2024 · 915bce2 · 915bce2
1 parent b051dbf
commit 915bce2
Showing 1 changed file with 1 addition and 1 deletion.
diff --git a/cvpack/atomic_function.py b/cvpack/atomic_function.py
@@ -138,7 +138,7 @@ def __init__(  # pylint: disable=too-many-arguments
         function: str,
         unit: mmunit.Unit,
         groups: ArrayLike,
-        pbc: bool = False,
+        pbc: bool = True,
         **parameters: t.Union[mmunit.ScalarQuantity, t.Sequence[mmunit.ScalarQuantity]],
     ) -> None:
         groups = np.atleast_2d(groups)