Fix LMAXTAU

materialsproject · Jun 4, 2023 · 6d69c76 · 6d69c76
1 parent 0c5284a
commit 6d69c76
Showing 1 changed file with 1 addition and 1 deletion.
diff --git a/src/atomate2/vasp/sets/base.py b/src/atomate2/vasp/sets/base.py
@@ -936,7 +936,7 @@ def _set_lmaxtau(incar, incar_settings, structure):
     # See VASP manual for more details.
     blocks = [site.specie.block for site in structure]
     if (
-        "LMAXMIX" not in incar_settings
+        "LMAXTAU" not in incar_settings
         and incar_settings.get("LASPH", False)
         and "f" in blocks
     ):