A validated phase-field model for spinodal decomposition in the ternary Fe–Cr–Co system under an external magnetic field

IF 1.9 3区 材料科学 Q4 CHEMISTRY, PHYSICAL
Trevor Robertson , Ashkan Farazin , Jon Flores , Mahmood Mamivand
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引用次数: 0

Abstract

Magnetic-assisted manufacturing is a processing technique that enables controlled microstructure evolution through the application of external magnetic fields. This approach holds promise for producing rare-earth-free permanent magnets with tailored properties from common alloy systems such as Fe-Cr-Co. In this work, we develop and validate a thermodynamically consistent phase-field model to simulate spinodal decomposition in the Fe-Cr-Co system under combined thermal and magnetic driving forces. The model incorporates CALPHAD-based Gibbs energy functions and magnetic contributions including Zeeman and demagnetization energies. The governing Cahn–Hilliard equations are solved using a finite-element framework, enabling simulation of microstructure evolution in both two and three dimensions. Model predictions are validated against experimental transmission electron microscopy (TEM) data, demonstrating good agreement in phase morphology, feature size, and compositional distribution. The simulations capture key features of field-assisted processing, including anisotropic domain growth and magnetic biasing effects. Three-dimensional simulations further illustrate the elongation and alignment of magnetic phases along the field direction, providing mechanistic insight into morphology control during thermomagnetic treatment. This validated modeling framework offers a predictive tool for designing magnetically processed alloys and optimizing the microstructural basis of their functional properties.
外加磁场作用下Fe-Cr-Co三元体系独立分解相场模型的验证
磁辅助制造是一种通过施加外部磁场来控制微结构演变的加工技术。这种方法有望生产出不含稀土的永磁体,这些永磁体具有Fe-Cr-Co等普通合金系统的定制性能。在这项工作中,我们开发并验证了一个热力学一致的相场模型来模拟Fe-Cr-Co体系在热和磁联合驱动下的旋量分解。该模型结合了基于calphad的吉布斯能量函数和磁贡献,包括塞曼能和退磁能。使用有限元框架求解控制Cahn-Hilliard方程,从而可以在二维和三维上模拟微观结构的演变。模型预测与实验透射电子显微镜(TEM)数据相一致,在相形态、特征尺寸和成分分布方面表现出良好的一致性。模拟捕获了场辅助处理的关键特征,包括各向异性畴生长和磁偏置效应。三维模拟进一步说明了磁相沿磁场方向的延伸和排列,为热磁处理过程中的形态控制提供了机制见解。该验证的建模框架为设计磁加工合金和优化其功能特性的微观结构基础提供了预测工具。
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来源期刊
CiteScore
4.00
自引率
16.70%
发文量
94
审稿时长
2.5 months
期刊介绍: The design of industrial processes requires reliable thermodynamic data. CALPHAD (Computer Coupling of Phase Diagrams and Thermochemistry) aims to promote computational thermodynamics through development of models to represent thermodynamic properties for various phases which permit prediction of properties of multicomponent systems from those of binary and ternary subsystems, critical assessment of data and their incorporation into self-consistent databases, development of software to optimize and derive thermodynamic parameters and the development and use of databanks for calculations to improve understanding of various industrial and technological processes. This work is disseminated through the CALPHAD journal and its annual conference.
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