Machine-learning potentials for crystal defects

Abstract Decades of advancements in strategies for the calculation of atomic interactions have culminated in a class of methods known as machine-learning interatomic potentials (MLIAPs). MLIAPs dramatically widen the spectrum of materials systems that can be simulated with high physical...

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Bibliographic Details
Main Authors: Freitas, Rodrigo, Cao, Yifan
Other Authors: Massachusetts Institute of Technology. Department of Materials Science and Engineering
Format: Article
Language:English
Published: Springer International Publishing 2022
Online Access:https://hdl.handle.net/1721.1/144364