带有不稳定堆积断层的埃谢尔比包涵体产生 T1 沉淀的意外成核机制

Shuo Wang, Junsheng Wang, Chengpeng Xue, Xinghai Yang, Guangyuan Tian, Hui Su, Yisheng Miao, Quan Li, Xingxing Li
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引用次数: 0

摘要

铝锂(Al-Li)合金是航空航天工业中最有前途的轻质结构材料之一。实现其优异机械性能的关键在于定制 T1 强化析出物;然而,这种纳米粒子的成核过程仍不为人知。通过将原子分辨率 HAADF-STEM 与基于密度泛函理论 (DFT) 的第一原理计算相结合,我们在此报告了一种反直觉的 T1 成核机制,它是由具有不稳定堆积断层的 Eshelby 包合物演变而来的。银镁簇加速了这种前驱体的形成,从而降低了障碍,形成了结构框架。此外,这些银镁簇还能捕获游离的铜和锂,为 T1 准备化学成分。我们的发现从几何结构和化学键功能的角度,通过溶质团簇为复杂沉淀物的相变提供了一个新的视角。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

Unexpected nucleation mechanism of T1 precipitates by Eshelby inclusion with unstable stacking faults

Unexpected nucleation mechanism of T1 precipitates by Eshelby inclusion with unstable stacking faults

Aluminum-lithium (Al-Li) alloy is one of the most promising lightweight structural materials in the aeronautic and aerospace industries. The key to achieving their excellent mechanical properties lies in tailoring T1 strengthening precipitates; however, the nucleation of such nanoparticles remains unknown. Combining atomic resolution HAADF-STEM with first-principles calculations based on the density functional theory (DFT), here, we report a counterintuitive nucleation mechanism of the T1 that evolves from an Eshelby inclusion with unstable stacking faults. This precursor is accelerated by Ag-Mg clusters to reduce the barrier, forming the structural framework. In addition, these Ag-Mg clusters trap the free Cu and Li to prepare the chemical compositions for T1. Our findings provide a new perspective on the phase transformations of complex precipitates through solute clusters in terms of geometric structure and chemical bonding functions.

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