Qiang Wan , Cai Lu , Yan Liu , Guodong Zhang , Jun Zhang , Bing Yang
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引用次数: 0
Abstract
High entropy alloys (HEAs) with nitriding process have been widely regarded as potential materials to manufacture machinery parts use in extremely environment such as high temperature, cryogenic temperatures, and corrosion conditions.
The multi-equal elements induced local chemical fluctuation (LCF) revealed significant effects in diffusion process which is the fundament for excellent thermal and chemical stability. However, the influence of LCF on the absorption stage of chemical surface process such as nitriding has remained uncertain so far, which greatly limited the application of chemical process in enhancing the surface hardness of HEAs. In this work, atomic-scale observations and first-principle calculations are combined to reveal that the presence of LCF determined the detailed effects of non-nitride forming element on nitrogen absorption and diffusion of nitride forming elements. In particular, Ni preferred locates closer with Cr while Co reveals equal space with Cr and Mn. This LCF promoted the absorption and diffusion of nitrogen in Cr lattice, arising from great decreased absorption energy and diffusion energy barrier (≈91.5 %). Thereby, the formation of nano CrN grains is enhanced via the co-contribution of accelerated absorption resulted from LCF and boundary diffusion via grain refinement. These findings provide profound understanding for HEA nitriding and promising strategy to improve the nitriding rate and hardness of HEAs.
采用氮化工艺的高熵合金(HEAs)已被广泛认为是制造高温、低温和腐蚀等极端环境下使用的机械零件的潜在材料。然而,迄今为止,LCF 对氮化等化学表面工艺吸收阶段的影响仍不确定,这极大地限制了化学工艺在提高 HEA 表面硬度方面的应用。在这项工作中,原子尺度观测和第一原理计算相结合,揭示了 LCF 的存在决定了非氮化物形成元素对氮化物形成元素的氮吸收和扩散的详细影响。特别是,镍与铬的位置更接近,而钴与铬和锰的空间相等。这种 LCF 促进了铬晶格中氮的吸收和扩散,因为吸收能和扩散能垒大大降低(≈91.5%)。因此,LCF 的加速吸收和晶粒细化的边界扩散共同促进了纳米 CrN 晶粒的形成。这些发现为 HEA 氮化提供了深刻的理解,并为提高 HEA 的氮化率和硬度提供了可行的策略。
期刊介绍:
This journal is a platform for publishing innovative research and overviews for advancing our understanding of the structure, property, and functionality of complex metallic alloys, including intermetallics, metallic glasses, and high entropy alloys.
The journal reports the science and engineering of metallic materials in the following aspects:
Theories and experiments which address the relationship between property and structure in all length scales.
Physical modeling and numerical simulations which provide a comprehensive understanding of experimental observations.
Stimulated methodologies to characterize the structure and chemistry of materials that correlate the properties.
Technological applications resulting from the understanding of property-structure relationship in materials.
Novel and cutting-edge results warranting rapid communication.
The journal also publishes special issues on selected topics and overviews by invitation only.