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介观与多尺度材料建模。

Mesoscopic and multiscale modelling in materials.

机构信息

Columbia University, New York, NY, USA.

Northwestern University, Evanston, IL, USA.

出版信息

Nat Mater. 2021 Jun;20(6):774-786. doi: 10.1038/s41563-020-00913-0. Epub 2021 May 27.

Abstract

The concept of multiscale modelling has emerged over the last few decades to describe procedures that seek to simulate continuum-scale behaviour using information gleaned from computational models of finer scales in the system, rather than resorting to empirical constitutive models. A large number of such methods have been developed, taking a range of approaches to bridging across multiple length and time scales. Here we introduce some of the key concepts of multiscale modelling and present a sampling of methods from across several categories of models, including techniques developed in recent years that integrate new fields such as machine learning and material design.

摘要

多尺度建模的概念在过去几十年中逐渐兴起,用于描述使用从系统中更精细尺度的计算模型中获取的信息来模拟连续体尺度行为的方法,而不是诉诸经验本构模型。已经开发了大量此类方法,采用了多种方法来跨越多个长度和时间尺度。在这里,我们介绍了多尺度建模的一些关键概念,并展示了来自多个模型类别中的方法示例,包括近年来整合机器学习和材料设计等新领域的技术。

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