晶粒结构演变如何影响固态反应动力学:铱和碳化锆相互作用的一个例子

IF 2.9 3区 化学 Q3 CHEMISTRY, PHYSICAL Physical Chemistry Chemical Physics Pub Date : 2025-01-09 DOI:10.1039/D4CP04302B
Yaroslav A. Nikiforov, Victoria A. Danilovsky and Natalya I. Baklanova
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引用次数: 0

摘要

这项工作研究了铱和碳化锆之间的固态反应,导致碳和zrir3 -一种对现代高温材料科学非常感兴趣的金属间化合物的形成。我们发现该反应的动力学机制发生了转变:从1500和1550℃的线性动力学(当化学反应是一个极限阶段时)到1600℃的“非抛物线动力学”。非抛物线动力学的特征是产物层的厚度与小于1/2的时间幂成正比。非抛物动力学的性质仍然是一个悬而未决的问题,这促使我们建立了这种动力学体系的模型。所提出的模型解释了产物阶段的晶粒生长及其如何导致相互扩散系数的时间依赖性。我们得到了该模型的完全解析解,以及连接晶粒生长指数和非抛物动力学幂律指数的方程。产品层厚度和金属间相平均晶粒尺寸的测量证实了理论解的结果。
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How grain structure evolution affects the kinetics of a solid-state reaction: a case of interaction between iridium and zirconium carbide†

This work investigates the solid-state reaction between iridium and zirconium carbide, resulting in the formation of carbon and ZrIr3—an intermetallic compound of great interest for modern high-temperature materials science. We have found a transition of kinetic regimes in this reaction: from linear kinetics (when the chemical reaction is a limiting stage) at 1500 and 1550 °C to ‘non-parabolic kinetics’ at 1600 °C. Non-parabolic kinetics is characterized by the thickness of the product layer being proportional to a power of time less than 1/2. The nature of non-parabolic kinetics is still an open question, which motivated us to develop a model of this kinetic regime. The proposed model accounts for the grain growth in the product phase and how it leads to the time dependence of the interdiffusion coefficient. We have obtained a complete analytical solution for this model and an equation that connects the grain-growth exponent and the power-law exponent of non-parabolic kinetics. The measurements of the thickness of the product layer and the average grain size of the intermetallic phase confirm the results of the theoretical solution.

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来源期刊
Physical Chemistry Chemical Physics
Physical Chemistry Chemical Physics 化学-物理:原子、分子和化学物理
CiteScore
5.50
自引率
9.10%
发文量
2675
审稿时长
2.0 months
期刊介绍: Physical Chemistry Chemical Physics (PCCP) is an international journal co-owned by 19 physical chemistry and physics societies from around the world. This journal publishes original, cutting-edge research in physical chemistry, chemical physics and biophysical chemistry. To be suitable for publication in PCCP, articles must include significant innovation and/or insight into physical chemistry; this is the most important criterion that reviewers and Editors will judge against when evaluating submissions. The journal has a broad scope and welcomes contributions spanning experiment, theory, computation and data science. Topical coverage includes spectroscopy, dynamics, kinetics, statistical mechanics, thermodynamics, electrochemistry, catalysis, surface science, quantum mechanics, quantum computing and machine learning. Interdisciplinary research areas such as polymers and soft matter, materials, nanoscience, energy, surfaces/interfaces, and biophysical chemistry are welcomed if they demonstrate significant innovation and/or insight into physical chemistry. Joined experimental/theoretical studies are particularly appreciated when complementary and based on up-to-date approaches.
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