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Machine learning interatomic potentials for Machine learning interatomic potentials for

Machine learning interatomic potentials for - PowerPoint Presentation

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Uploaded On 2018-11-04

Machine learning interatomic potentials for - PPT Presentation

multicomponent systems Konstantin Gubaev Skolkovo Institute of Science and Technology Skoltech Russia Motivation What MD simulation is capable of doing Empirical potentials 10 ID: 713562

potentials learning applications interatomic learning potentials interatomic applications training tensor model machine prediction structure set active accuracy data cheminformatics

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