Numerical simulation for β/α transformation of Ti–6Al–4V alloy using a lattice Boltzmann - Cellular automata method

Wonjoo Lee, Yong-Taek Hyun, Jong Woo Won, Jonghun Yoon
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Abstract

This paper considers the beta/alpha transformation of Ti–6Al–4V alloy using a lattice Boltzmann method (LBM) – cellular automata (CA) coupled method in terms of microstructural evolution during phase transformation. Particularly, the effects of the cooling rate on microstructures such as beta grain size, alpha colony size, and alpha lath thickness were examined as well as the overall morphologies. The LBM and CA were used to implement the diffusion of alloy components and phase transformation, respectively. Additionally, the thermodynamic and kinetic data for simulating the ternary alloy system were obtained from CALPHAD software to utilize the equilibrium phase diagram calculations. The initial states of the beta grain and its composition fields affect the processing of beta/alpha phase transformation and the final alpha + beta phase morphologies. Validation of the proposed method was conducted to compare the simulation results with experimental trends for microstructures of Ti–6Al–4V from the literature. The error in prediction of microstructural morphologies were 20% in the average alpha thickness with deviation of up to 5 μm.
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使用晶格玻尔兹曼-细胞自动机方法对 Ti-6Al-4V 合金的 β/α 转变进行数值模拟
本文采用晶格玻尔兹曼法(LBM)-细胞自动机(CA)耦合方法,从相变过程中的微观结构演变角度研究了 Ti-6Al-4V 合金的 beta/α 转变。特别是,研究了冷却速率对β晶粒大小、α菌落大小和α板条厚度等微观结构以及整体形态的影响。LBM 和 CA 分别用于实现合金成分的扩散和相变。此外,还从 CALPHAD 软件中获得了模拟三元合金体系的热力学和动力学数据,以利用平衡相图进行计算。贝塔晶粒的初始状态及其成分场会影响贝塔/阿尔法相变的过程以及最终的阿尔法+贝塔相形态。对提出的方法进行了验证,将模拟结果与文献中有关 Ti-6Al-4V 显微结构的实验趋势进行了比较。微观结构形态的预测误差为平均α厚度的 20%,偏差达 5 μm。
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