diff --git a/mlptrain/potentials/_base.py b/mlptrain/potentials/_base.py index 6e97fe34..fa05177a 100644 --- a/mlptrain/potentials/_base.py +++ b/mlptrain/potentials/_base.py @@ -358,4 +358,5 @@ def copy(self) -> 'MLPotential': 'Br': 2, 'Kr': 1, 'I': 2, + 'Pd': 1, }