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minor fix
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Kisung Kang committed Jun 19, 2024
1 parent e34bf3b commit 5da8bd7
Showing 1 changed file with 1 addition and 1 deletion.
2 changes: 1 addition & 1 deletion libs/lib_load_model.py
Original file line number Diff line number Diff line change
Expand Up @@ -37,7 +37,7 @@ def load_model(inputs):
from glp import instantiate
from glp.ase import Calculator
potential_dict = {"mlff": {"folder": f"{workpath}/deployed-model_{index_nmodel}_{index_nstep}"}}
get_calculator = instantiate.get_calculator(potential_dict, {"heat_fulx_unfolded": {"skin": 1.0}})
get_calculator = instantiate.get_calculator(potential_dict, {"heat_flux_unfolded": {"skin": 1.0}})
inputs.calc_MLIP.append(Calculator(get_calculator))

# Check the termination signal
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