From 8b1013919a759bce84ecbb7e4a163a50760ab976 Mon Sep 17 00:00:00 2001 From: Matt Johnson Date: Thu, 21 Nov 2024 12:30:59 -0800 Subject: [PATCH] clean up --- pynta/tasks.py | 2 -- 1 file changed, 2 deletions(-) diff --git a/pynta/tasks.py b/pynta/tasks.py index b44b6ebd..2885bd5a 100644 --- a/pynta/tasks.py +++ b/pynta/tasks.py @@ -1249,10 +1249,8 @@ def run_task(self, fw_spec): break else: raise ValueError - assert config.atoms[1].site == "bridge" partial_admol = admol_name_structure_dict[adname] - assert partial_admol.atoms[1].site == "bridge" admol_path = admol_name_path_dict[adname] partial_atoms = read(admol_path) init_atoms = mol_to_atoms(config,slab,sites,metal,partial_atoms=partial_atoms,partial_admol=partial_admol)