diff --git a/calphy/utils.py b/calphy/utils.py index f9f5ff8..7b5584f 100644 --- a/calphy/utils.py +++ b/calphy/utils.py @@ -81,7 +81,7 @@ def create_job_from_inputfile(pr, inputfile, potential, kernel=None): print(f'could not find {basedir_path}, skipping') -def get_energy_free(job): +def get_free_energy(job): return job["output/energy_free"] def get_temperature(job):