Continuous Cellular Automaton for the simulation of the surface morphology on any silicon orientation Si{HKL} in anisotropic etching

Y. Xing, M. Gosálvez, K. Sato
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Abstract

A Continuous Cellular Automaton (CCA) is modified to incorporate a micromasking model and a removal rate restriction function in order to address the formation of morphological instabilities during anisotropic wet etching. As an example, the etching of crystalline silicon in KOH with isopropanol is considered (12% KOH+IPA). By combining the micromasking model with site-specific atomistic removal rate values previously calibrated by matching the macroscopic orientation-dependence of the etch rate, a good agreement with the experimental surface morphologies for a wide range of crystalline orientations {h k l} is obtained. This is in contrast to traditional Kinetic Monte Carlo (KMC) studies where the site-specific rates are calibrated by matching the surface morphologies but the orientation-dependence of the etch rate is not described correctly. The modified CCA makes possible the realization of accurate simulations of anisotropic etching in realistic engineering applications.
各向异性蚀刻中任意硅取向Si{HKL}表面形貌模拟的连续元胞自动机
为了解决各向异性湿刻蚀过程中形态不稳定性的形成问题,对连续元胞自动机(CCA)进行了改进,加入了微掩蔽模型和去除速率限制函数。作为一个例子,考虑了用异丙醇(12% KOH+IPA)在KOH中蚀刻晶体硅。通过将微掩蔽模型与先前通过匹配蚀刻速率的宏观取向依赖校准的位点特异性原子去除率值相结合,获得了与实验表面形貌在大范围晶体取向{hkl}的良好一致性。这与传统的动力学蒙特卡罗(KMC)研究相反,后者通过匹配表面形貌来校准特定位置的速率,但没有正确描述蚀刻速率的方向依赖性。修正后的CCA可以在实际工程应用中实现对各向异性刻蚀过程的精确模拟。
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