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通过分子动力学模拟对碳化硅纳米切削过程中延性变形的数值分析

A Numerical Analysis of Ductile Deformation during Nanocutting of Silicon Carbide via Molecular Dynamics Simulation.

作者信息

Liu Bing, Li Xiaolin, Kong Ruijie, Yang Haijie, Jiang Lili

机构信息

School of Mechanical Engineering, Tianjin University of Commerce, Tianjin 300134, China.

School of Mechanical Engineering, Tianjin University, Tianjin 300072, China.

出版信息

Materials (Basel). 2022 Mar 21;15(6):2325. doi: 10.3390/ma15062325.

Abstract

As a typical third-generation semiconductor material, silicon carbide (SiC) has been increasingly used in recent years. However, the outstanding performance of SiC component can only be obtained when it has a high-quality surface and low-damage subsurface. Due to the hard-brittle property of SiC, it remains a challenge to investigate the ductile machining mechanism, especially at the nano scale. In this study, a three-dimensional molecular dynamics (MD) simulation model of nanometric cutting on monocrystalline 3C-SiC was established based on the ABOP Tersoff potential. Multi-group MD simulations were performed to study the removal mechanism of SiC at the nano scale. The effects of both cutting speed and undeformed cutting thickness on the material removal mechanism were considered. The ductile machining mechanism, cutting force, hydrostatic pressure, and tool wear was analyzed in depth. It was determined that the chip formation was dominated by the extrusion action rather than the shear theory during the nanocutting process. The performance and service life of the diamond tool can be effectively improved by properly increasing the cutting speed and reducing the undeformed cutting thickness. Additionally, the nanometric cutting at a higher cutting speed was able to improve the material removal rate but reduced the quality of machined surface and enlarged the subsurface damage of SiC. It is believed that the results can promote the level of ultraprecision machining technology.

摘要

作为一种典型的第三代半导体材料,碳化硅(SiC)近年来得到了越来越广泛的应用。然而,只有当碳化硅部件具有高质量的表面和低损伤的亚表面时,才能获得其优异的性能。由于碳化硅的硬脆特性,研究其延性加工机理仍然是一个挑战,尤其是在纳米尺度上。在本研究中,基于ABOP Tersoff势建立了单晶3C-SiC纳米切削的三维分子动力学(MD)模拟模型。进行了多组分子动力学模拟,以研究纳米尺度下碳化硅的去除机理。考虑了切削速度和未变形切削厚度对材料去除机理的影响。对延性加工机理、切削力、静水压力和刀具磨损进行了深入分析。结果表明,在纳米切削过程中,切屑形成主要由挤压作用主导,而非剪切理论。适当提高切削速度和减小未变形切削厚度,可以有效提高金刚石刀具的性能和使用寿命。此外,较高切削速度下的纳米切削能够提高材料去除率,但降低了加工表面质量,并扩大了碳化硅的亚表面损伤。相信这些结果能够推动超精密加工技术水平的提升。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f1f5/8952004/7cfa0fafb2d2/materials-15-02325-g001.jpg

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