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arxiv: 1905.11715 · v1 · pith:FR3IX5DOnew · submitted 2019-05-28 · ❄️ cond-mat.mtrl-sci · physics.comp-ph

Towards the computational experiment

classification ❄️ cond-mat.mtrl-sci physics.comp-ph
keywords computationalfieldaccountaffectbriefcurrenteffectemergence
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We give a brief account of the current limitations and possibilities in the field of computational simulation of materials. We then focus on the effect that the emergence of machine learning interatomic potentials is having on the field and how it will affect its evolution in the near future.

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