On Vacancy and Solute Co-Segregated η1 Interface in Over-Aged Al-Zn-Mg Alloys

Y. Ou, Yong-zheng Jiang, Yiren Wang, Zhengqing Liu, A. Lervik, R. Holmestad
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引用次数: 3

Abstract

We represent a combined first-principles and scanning transmission electron microscopy (STEM) study of the η1A1 interfaces in an over-aged Al-Zn-Mg alloy. As one of the major η-MgZn2 precipitate phase variants, η1A1 tends to form highly coherent interfaces with Al matrix, along with various unique solute segregation patterns on its interfacial layers. The interface phase diagram suggests either an Mg-rich or a Zn-rich interface, depending on the chemical potential range of Zn. Further segregation calculations, however, strongly suggest the STEM Z-contrast imaged interface to be a vacancy and solute co-stabilized Mg-rich structure that is favored at relatively low Zn chemical potentials. Based on our experimental and calculation results, the profound thermodynamics origin of the η1A1 interface and its intricate segregation behavior were clarified and described using a generalized structure model. The η1A1l interface structure and segregation at higher Zn chemical potentials were also predicted for future experimental validation.
过时效Al-Zn-Mg合金中空位和溶质共偏析η - 1界面的研究
我们采用第一性原理和扫描透射电镜(STEM)相结合的方法研究了过时效Al-Zn-Mg合金的η1A1界面。作为主要的η-MgZn2相变体之一,η1A1倾向于与Al基体形成高度共融的界面,并在其界面层上形成各种独特的溶质偏析模式。根据锌的化学势范围,界面相图显示为富镁界面或富锌界面。然而,进一步的偏析计算强烈表明,STEM z对比成像的界面是一个空位和溶质共稳定的富镁结构,在相对较低的Zn化学势下更受青睐。基于实验和计算结果,阐明了η1A1界面的深层热力学起源及其复杂的偏析行为,并用广义结构模型对其进行了描述。对高Zn化学势下的η - 1a1l界面结构和偏析进行了预测,以备将来的实验验证。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
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