From da5632951d35014a55a06414898d87776eb42a89 Mon Sep 17 00:00:00 2001 From: yanghan-microsoft Date: Fri, 27 Dec 2024 14:21:56 +0800 Subject: [PATCH] fixed the return type of relax --- src/mattersim/applications/relax.py | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/src/mattersim/applications/relax.py b/src/mattersim/applications/relax.py index 271a7df..9a678ac 100644 --- a/src/mattersim/applications/relax.py +++ b/src/mattersim/applications/relax.py @@ -56,7 +56,7 @@ def relax( fmax: float = 0.01, params_filter: dict = {}, **kwargs, - ) -> Atoms: + ) -> Tuple[bool, Atoms]: """ Relax the atoms object.