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Modelling of Oxygen Diffusion and Segregation at Interfaces in Ag-MgO Composites

机译:Ag-MgO复合材料界面的氧扩散和偏析模型

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摘要

The presence of atomic oxygen at internal metal-ceramic oxide interfaces significantly affects the physical properties of the interfaces which in turn affects the bulk properties of the material. This problem is addressed for the model composite system Ag-MgO from a phenomenological point of view using a lattice-based Monte Carlo method and a finite element method extended with special user-subroutines. We simulate the time dependence of oxygen depth and contour profiles. We are able to show very good agreement between these two methods.
机译:内部金属-陶瓷氧化物界面处原子氧的存在会显着影响界面的物理性质,进而影响材料的整体性质。从现象学的角度出发,使用基于网格的蒙特卡洛方法和扩展了特殊用户子程序的有限元方法从模型学角度解决了Ag-MgO模型复合系统的问题。我们模拟了氧气深度和轮廓曲线的时间依赖性。我们能够在这两种方法之间显示出很好的一致性。

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