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Octree-search Kinetic Monte Carlo

✍ Scribed by M.A. Gosálvez; Y. Xing; K. Sato; R.M. Nieminen


Publisher
Elsevier Science
Year
2010
Tongue
English
Weight
837 KB
Volume
159
Category
Article
ISSN
0924-4247

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✦ Synopsis


We present a Kinetic Monte Carlo (KMC) method based on an octree data representation and search algorithm for the simulation of complex Micro Electro Mechanical Systems (MEMS) structures and, in general, complex, multi-valued surfaces propagating in 3D space. The experimental etch rate distribution for a wet etched spherical sample is correctly described and the propagation of the surface is in good agreement with the experiments for various applications. The algorithm leads to a faster tree-based search, efficient updating and good modeling ability for dynamic surfaces. Speedup factors of 3-4 over similar methods are obtained while the use of memory is reduced by 50-80% with respect to standard practice, with the factor increasing for larger simulations.


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Efficient kinetic Monte Carlo simulation
✍ Tim P. Schulze 📂 Article 📅 2008 🏛 Elsevier Science 🌐 English ⚖ 160 KB

This paper concerns kinetic Monte Carlo (KMC) algorithms that have a single-event execution time independent of the system size. Two methods are presented-one that combines the use of inverted-list data structures with rejection Monte Carlo and a second that combines inverted lists with the Marsagli