Machine learning identifies scale-free properties in disordered materials

Sunkyu Yu, Xianji Piao and Namkyoo Park ()
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Sunkyu Yu: Seoul National University
Xianji Piao: Seoul National University
Namkyoo Park: Seoul National University

Nature Communications, 2020, vol. 11, issue 1, 1-11

Abstract: Abstract The vast amount of design freedom in disordered systems expands the parameter space for signal processing. However, this large degree of freedom has hindered the deterministic design of disordered systems for target functionalities. Here, we employ a machine learning approach for predicting and designing wave-matter interactions in disordered structures, thereby identifying scale-free properties for waves. To abstract and map the features of wave behaviors and disordered structures, we develop disorder-to-localization and localization-to-disorder convolutional neural networks, each of which enables the instantaneous prediction of wave localization in disordered structures and the instantaneous generation of disordered structures from given localizations. We demonstrate that the structural properties of the network architectures lead to the identification of scale-free disordered structures having heavy-tailed distributions, thus achieving multiple orders of magnitude improvement in robustness to accidental defects. Our results verify the critical role of neural network structures in determining machine-learning-generated real-space structures and their defect immunity.

Date: 2020
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DOI: 10.1038/s41467-020-18653-9

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