most citedMeasuring transferability issues in machine-learning force fields: The example of Gold-Iron interactions with linearized potentials

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physics.chem-ph2019★ 22 cited

Measuring transferability issues in machine-learning force fields: The example of Gold-Iron interactions with linearized potentials

Magali Benoit, Jonathan Amodeo, Ségolène Combettes +3

Machine-learning force fields have been increasingly employed in order to extend the possibility of current first-principles calculations. However, the transferability of the obtai…