From 2b3a9ec9f1d03723d3ed9586d565fe532e275a0f Mon Sep 17 00:00:00 2001 From: Jan Janssen Date: Sat, 24 Aug 2024 06:20:46 +0200 Subject: [PATCH] Update calculator.py --- atomistics/calculators/lammps/calculator.py | 4 ++-- 1 file changed, 2 insertions(+), 2 deletions(-) diff --git a/atomistics/calculators/lammps/calculator.py b/atomistics/calculators/lammps/calculator.py index 719cff70..ffa3c4c0 100644 --- a/atomistics/calculators/lammps/calculator.py +++ b/atomistics/calculators/lammps/calculator.py @@ -477,7 +477,7 @@ def evaluate_with_lammps( logger=None, log_file=None, library=None, - diable_log_file: bool = True, + disable_log_file: bool = True, lmp_optimizer_kwargs={}, ) -> dict: lmp = LammpsASELibrary( @@ -487,7 +487,7 @@ def evaluate_with_lammps( logger=logger, log_file=log_file, library=library, - diable_log_file=diable_log_file, + disable_log_file=disable_log_file, ) results_dict = evaluate_with_lammps_library( task_dict=task_dict,