Molecular dynamic simulation of the influence of vibration effects on scratching processes in Varied crystal orientations

IF 1.9 4区 材料科学 Q3 MATERIALS SCIENCE, MULTIDISCIPLINARY
Zheng Qiu-Yang, Zhou Zhen-Yu, Li Yu, Chen Jianhao, Ye Sen-Bin, Piao Zhong-Yu
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Abstract

Abstract The research delves into the uncharted terrain of crystal orientation’s effect on high-frequency vibration-assisted processing of single-crystal copper, employing molecular dynamics to devise non-vibration, one-dimensional (1D), and two-dimensional (2D) vibration-assisted scratching models. The innovative discovery is the ‘peak-shaving’ effect, invoked by high-frequency vibration, which significantly mitigates surface irregularities on single-crystal copper, enhancing surface quality and material plasticity, thereby facilitating machinability. A key revelation is the superior efficacy of 2D vibration in material fortification relative to 1D vibration. Another novel finding is the amplified plasticity of single-crystal copper with a (111) crystal orientation under vibration-assisted excitation, linked to the varying directions of dislocation slip contingent upon crystal orientations. The pioneering observation that the induction of vibration during scratching dynamically propels dislocation defect structures, leading to the generation of a significant volume of vacant and interstitial atomic sites, underscores the pronounced influence of 2D vibration. This research contributes invaluable microscopic perspectives into the operative mechanism of crystal orientation’s impact on high-frequency vibration-assisted processing.
不同晶体取向下振动对划痕过程影响的分子动力学模拟
摘要:本研究探讨了晶体取向对单晶铜高频振动辅助加工的影响,采用分子动力学方法建立了非振动、一维(1D)和二维(2D)振动辅助刮擦模型。创新的发现是“削峰”效应,由高频振动引起,可以显著减轻单晶铜的表面不规则性,提高表面质量和材料塑性,从而促进可加工性。一个关键的启示是,相对于一维振动,二维振动在材料强化方面的效果更好。另一个新发现是(111)晶体取向的单晶铜在振动辅助激发下的塑性增强,这与晶体取向不同的位错滑移方向有关。划痕过程中振动的诱导动态推动了位错缺陷结构,导致大量空位和间隙原子位的产生,这一开创性的观察强调了二维振动的显著影响。该研究为晶体取向对高频振动辅助加工的影响提供了宝贵的微观视角。
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来源期刊
CiteScore
3.30
自引率
5.60%
发文量
96
审稿时长
1.7 months
期刊介绍: Serving the multidisciplinary materials community, the journal aims to publish new research work that advances the understanding and prediction of material behaviour at scales from atomistic to macroscopic through modelling and simulation. Subject coverage: Modelling and/or simulation across materials science that emphasizes fundamental materials issues advancing the understanding and prediction of material behaviour. Interdisciplinary research that tackles challenging and complex materials problems where the governing phenomena may span different scales of materials behaviour, with an emphasis on the development of quantitative approaches to explain and predict experimental observations. Material processing that advances the fundamental materials science and engineering underpinning the connection between processing and properties. Covering all classes of materials, and mechanical, microstructural, electronic, chemical, biological, and optical properties.
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