mic is not needed

thorben-frank · Aug 22, 2024 · bc901cb · bc901cb
1 parent 9e825f2
commit bc901cb
Showing 1 changed file with 1 addition and 1 deletion.
diff --git a/mlff/cAPI/mlff_structure_relaxation.py b/mlff/cAPI/mlff_structure_relaxation.py
@@ -226,7 +226,7 @@ def load_start_geometry(f: str) -> Atoms:
                               capacity_multiplier=1.25,
                               F_to_eV_Ang=default_access(conversion_table, key=F_key, default=eV),
                               E_to_eV=default_access(conversion_table, key=E_key, default=eV),
-                              mic=mic)
+                              )
 
         molecule.set_calculator(calc)