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....
Main Authors: | , , |
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Format: | Article |
Language: | English |
Published: |
IOP Publishing
2023-01-01
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Series: | Machine Learning: Science and Technology |
Subjects: | |
Online Access: | https://doi.org/10.1088/2632-2153/accd45 |