Artificial neural network potentials for mechanics and fracture dynamics of two-dimensional crystals

Understanding the mechanics and failure of materials at the nanoscale is critical for their engineering and applications. The accurate atomistic modeling of brittle failure with crack propagation in covalent crystals requires a quantum mechanics-based description of individual bond-breaking events....

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Bibliographic Details
Main Authors: Gang Seob Jung, Hunjoo Myung, Stephan Irle
Format: Article
Language:English
Published: IOP Publishing 2023-01-01
Series:Machine Learning: Science and Technology
Subjects:
Online Access:https://doi.org/10.1088/2632-2153/accd45