Data-driven quantification of orientation dependent damage caused by voids using Machine Learning

IF 7 2区 材料科学 Q1 MATERIALS SCIENCE, MULTIDISCIPLINARY Materials Science and Engineering: A Pub Date : 2025-03-18 DOI:10.1016/j.msea.2025.148186
David Montes de Oca Zapiain, Nicole K. Aragon, Hojun Lim
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Abstract

Voids have a significant impact on the structural safety and performance of polycrystalline metal alloys given their crucial role on the initiation and evolution of damage. Therefore, a fundamental understanding of the relationship between the internal crystalline structure of metal alloys and their corresponding damage behavior and properties is essential for the materials community. Crystal plasticity theories, in conjunction with finite element (CPFEM), are actively used to describe and characterize this behavior given the fact that they directly consider the orientation of the crystallographic plains, slip systems and other microstructural features. Nevertheless, despite its accuracy, CPFEM-based analysis protocols are often ill-suited for establishing a computationally efficient and accurate linkage between the microstructure and the resulting damage performance given their high computational cost and their need to iteratively solve complex, numerically stiff and highly non-linear equations. In this work, we address this challenge by establishing a machine learning (ML)-based linkage between the microstructure and the resulting damage performance. Specifically, we leverage AdaBoosted decision trees to connect crystal orientations, represented with Generalized Spherical Harmonics, to a measure of damage derived from the classical Lemaitre continuum damage model. The developed ML model accurately predicts the Lemaitre stress around a spherical void at a fraction of the computational cost compared to CPFEM simulations.
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利用机器学习对由空洞引起的方向相关损伤进行数据驱动量化
孔隙对多晶金属合金的结构安全性和性能有着重要的影响,对损伤的产生和发展起着至关重要的作用。因此,了解金属合金内部晶体结构与其相应的损伤行为和性能之间的关系对材料界至关重要。晶体塑性理论,结合有限单元(CPFEM),被积极地用于描述和表征这种行为,因为它们直接考虑了晶体平原的取向、滑移系统和其他微观结构特征。然而,尽管cpfem具有准确性,但基于cpfem的分析方案往往不适合在微观结构和由此产生的损伤性能之间建立计算高效和准确的联系,因为它们的计算成本高,并且需要迭代求解复杂的、数值刚性的和高度非线性的方程。在这项工作中,我们通过在微观结构和由此产生的损伤性能之间建立基于机器学习(ML)的联系来解决这一挑战。具体来说,我们利用AdaBoosted决策树将晶体取向(用广义球面谐波表示)与经典Lemaitre连续损伤模型导出的损伤度量联系起来。与CPFEM模拟相比,开发的ML模型可以准确地预测球形空隙周围的Lemaitre应力,而计算成本仅为CPFEM模拟的一小部分。
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来源期刊
Materials Science and Engineering: A
Materials Science and Engineering: A 工程技术-材料科学:综合
CiteScore
11.50
自引率
15.60%
发文量
1811
审稿时长
31 days
期刊介绍: Materials Science and Engineering A provides an international medium for the publication of theoretical and experimental studies related to the load-bearing capacity of materials as influenced by their basic properties, processing history, microstructure and operating environment. Appropriate submissions to Materials Science and Engineering A should include scientific and/or engineering factors which affect the microstructure - strength relationships of materials and report the changes to mechanical behavior.
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