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机械超材料中的深度学习:从预测与生成到逆向设计

Deep Learning in Mechanical Metamaterials: From Prediction and Generation to Inverse Design.

作者信息

Zheng Xiaoyang, Zhang Xubo, Chen Ta-Te, Watanabe Ikumu

机构信息

Center for Basic Research on Materials, National Institute for Materials Science, 1-2-1 Sengen, Tsukuba, 305-0047, Japan.

Graduate School of Pure and Applied Sciences, University of Tsukuba, 1-1-1 Tennodai, Tsukuba, 305-8573, Japan.

出版信息

Adv Mater. 2023 Nov;35(45):e2302530. doi: 10.1002/adma.202302530. Epub 2023 Sep 29.

DOI:10.1002/adma.202302530
PMID:37332101
Abstract

Mechanical metamaterials are meticulously designed structures with exceptional mechanical properties determined by their microstructures and constituent materials. Tailoring their material and geometric distribution unlocks the potential to achieve unprecedented bulk properties and functions. However, current mechanical metamaterial design considerably relies on experienced designers' inspiration through trial and error, while investigating their mechanical properties and responses entails time-consuming mechanical testing or computationally expensive simulations. Nevertheless, recent advancements in deep learning have revolutionized the design process of mechanical metamaterials, enabling property prediction and geometry generation without prior knowledge. Furthermore, deep generative models can transform conventional forward design into inverse design. Many recent studies on the implementation of deep learning in mechanical metamaterials are highly specialized, and their pros and cons may not be immediately evident. This critical review provides a comprehensive overview of the capabilities of deep learning in property prediction, geometry generation, and inverse design of mechanical metamaterials. Additionally, this review highlights the potential of leveraging deep learning to create universally applicable datasets, intelligently designed metamaterials, and material intelligence. This article is expected to be valuable not only to researchers working on mechanical metamaterials but also those in the field of materials informatics.

摘要

机械超材料是经过精心设计的结构,其卓越的机械性能由微观结构和组成材料决定。调整其材料和几何分布能够挖掘实现前所未有的整体性能和功能的潜力。然而,当前机械超材料的设计在很大程度上依赖于经验丰富的设计师通过反复试验获得的灵感,而研究它们的机械性能和响应需要耗时的机械测试或计算成本高昂的模拟。尽管如此,深度学习的最新进展彻底改变了机械超材料的设计过程,无需先验知识就能实现性能预测和几何形状生成。此外,深度生成模型可以将传统的正向设计转变为逆向设计。最近许多关于深度学习在机械超材料中应用的研究都非常专业化,其优缺点可能并不立即明显。这篇批判性综述全面概述了深度学习在机械超材料的性能预测、几何形状生成和逆向设计方面的能力。此外,本综述强调了利用深度学习创建通用数据集、智能设计的超材料和材料智能的潜力。预计本文不仅对从事机械超材料研究的人员有价值,对材料信息学领域的研究人员也有价值。

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