Experimental investigations and thermodynamic assessment of the Al–Er–Sc system

IF 1.9 3区 材料科学 Q4 CHEMISTRY, PHYSICAL Calphad-computer Coupling of Phase Diagrams and Thermochemistry Pub Date : 2024-04-18 DOI:10.1016/j.calphad.2024.102689
Yanbin Kang , Zhao Lu , Haiqing Qin , Lin Zhao , Rui Zhang , Jinguo Ge , Qingrong Yao , Caimin Huang , Zhiwei Wei , Qianxin Long , Jiang Wang , Huaiying Zhou
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Abstract

The thermodynamic evaluation of the Er–Sc binary system was performed using the Calphad method, computing thermodynamic parameters for the Liquid phase, Hcp phase, and Bcc phase. The calculated results align well with existing experimental phase diagrams. Furthermore, by employing electron probe microanalysis and X-ray diffraction testing, the phase equilibria for the Al–Er-Sc ternary system at 600 °C were determined. Experimental findings indicated that both Al–Er and Al–Sc binary systems exhibit some solubility for the third component when extended to the ternary system. Leveraging thermodynamic parameters from the literature for Al–Er and Al–Sc binary system and those calculated for the Er–Sc binary system in this work, a comprehensive thermodynamic evaluation of the Al–Er-Sc ternary system is carried out. The computed results exhibit good agreement with the experimental data, providing consistent and reasonable thermodynamic parameters for the isothermal and vertical sections.

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Al-Er-Sc 系统的实验研究和热力学评估
使用 Calphad 方法对 Er-Sc 二元体系进行了热力学评估,计算了液相、Hcp 相和 Bcc 相的热力学参数。计算结果与现有的实验相图非常吻合。此外,通过电子探针显微分析和 X 射线衍射测试,确定了 600 °C 时 Al-Er-Sc 三元体系的相平衡。实验结果表明,当扩展到三元体系时,Al-Er 和 Al-Sc 二元体系对第三种成分都表现出一定的溶解性。利用文献中关于 Al-Er 和 Al-Sc 二元体系的热力学参数以及本研究中为 Er-Sc 二元体系计算的热力学参数,对 Al-Er-Sc 三元体系进行了全面的热力学评估。计算结果与实验数据显示出良好的一致性,为等温段和垂直段提供了一致且合理的热力学参数。
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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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