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Numerical modelling of multilayered coatings : latest developments and applications

机译:多层涂层的数值模拟:最新进展和应用

摘要

The remarkable mechanical properties of multilayered coatings, such as super-hardness, excellent resistance against cracking, low wear-rate and high thermal-stability, are due to their unique interfacial structures and deformation mechanisms at the nanometer scale. The multilayered coating process itself is a typical multi-scale phenomenon. The modelling of multilayered coatings has become an important topic in research recently, largely due to the recent progress that has been made in the numerical modelling of materials and structures at different length-scales as well as the improved effectiveness achieved in linking such progress in numerical modelling to enable multi-scale modelling. In this paper, numerical modelling for the analysis of multilayered coatings at individual length-scales: Continuum, Molecular and Nano-scale, is reviewed, along with that at multi-scale modelling. Examples are presented showing numerical models obtained using: the Finite Element Method (FEM), Molecular Dynamics (MD), First-principles calculations and Multi-scale modelling, are presented. Their relative limitations are discussed and challenges to their future work highlighted.
机译:多层涂层的卓越机械性能,例如超硬性,出色的抗开裂性,低磨损率和高热稳定性,是由于其独特的界面结构和纳米级的变形机理所致。多层涂覆过程本身是典型的多尺度现象。多层涂层的建模已成为最近研究中的重要课题,这主要是由于在不同长度尺度的材料和结构的数值建模方面取得了最新进展,以及将这些数值联系起来所取得的更高的有效性。建模以实现多尺度建模。在本文中,对多层涂层在各个长度尺度上的数值建模:连续谱,分子尺度和纳米尺度进行了综述,并进行了多尺度建模。给出了示例,显示了使用以下方法获得的数值模型:有限元方法(FEM),分子动力学(MD),第一性原理计算和多尺度建模。讨论了他们的相对局限性,并强调了他们未来工作的挑战。

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