材料科学
非线性系统
缩进
振幅
机械
剪切(地质)
剪切模量
陶瓷
接触力学
模数
接触面积
人工神经网络
弹性模量
刚度
还原(数学)
摩擦系数
抗剪强度(土壤)
常量(计算机编程)
表面力仪
势能
曲面(拓扑)
剪应力
摩擦系数
经典力学
法向力
复合材料
统计物理学
接触动力学
作者
Zhenyu Bu,Xiaoqin Zhao,Yiyang Wei,Lili Dong,Yulong An,Huidi Zhou
标识
DOI:10.1021/acs.jpcc.5c04118
摘要
This study constructs and validates a deep neural network potential with quantum-level accuracy for γ-Al 2 O 3, achieving root-mean-square errors of 1.2 meV/atom for energy and 19 meV/Å for force. Based on this potential, nanoindentation-scratch simulations at three indentation depths are performed to investigate the evolution of elasticity, creep, and viscoplasticity. Hertzian fitting yields an elastic modulus of 317.4–322.4 GPa, which closely agrees with experimental measurements. Frictional analysis reveals that the normal force stabilizes into a plateau, while the friction coefficient exhibits a nonlinear increase, governed respectively by the real contact area and the atomic-scale shear strength spectrum. The normalized load Π = F f / N c indicates that the mean interfacial shear strength remains nearly constant with depth, whereas the amplitude of its fluctuations increases by a factor of 3. These findings elucidate the synergistic roles of contact area control and shear spectrum broadening in ceramic interfacial friction, providing quantitative guidance for friction reduction strategies that integrate surface texturing and interfacial chemistry, and establishing a computational foundation for large-scale data-driven materials design.
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