Set angle_tolerance explicitly

materialsproject · Sep 28, 2024 · e461bbe · e461bbe
1 parent 047463c
commit e461bbe
Showing 1 changed file with 1 addition and 1 deletion.
diff --git a/emmet-core/emmet/core/symmetry.py b/emmet-core/emmet/core/symmetry.py
@@ -171,7 +171,7 @@ def from_structure(cls, structure: Structure) -> "SymmetryData":
             try:
                 symmetry["symprec"] = 1e-3
                 symmetry["angle_tolerance"] = 1
-                sg = SpacegroupAnalyzer(structure, symmetry["symprec"], 1)
+                sg = SpacegroupAnalyzer(structure, symprec=symmetry["symprec"], angle_tolerance=symmetry["angle_tolerance"])
             except SymmetryUndeterminedError:
                 return SymmetryData(**symmetry)