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This review article is intended as a practical guide for newcomers to the field of kinetic Monte Carlo (KMC) simulations, and specifically to lattice KMC simulations as prevalently used for surface and interface applications.
The kinetic Monte Carlo (KMC) method is a Monte Carlo method computer simulation intended to simulate the time evolution of some processes occurring in nature. Typically these are processes that occur with known transition rates among states.
INTRODUCTION TO THE KINETIC MONTE CARLO METHOD. Conference paper. pp 1–23. Cite this conference paper. Download book PDF. Arthur F. Voter. Part of the book series: NATO Science Series ( (NAII,volume 235)) 9190 Accesses. 166 Citations. Abstract. Monte Carlo refers to a broad class of algorithms that solve problems through the use of random numbers.
First, it is a primer on the kMC method (predominantly using the lattice-gas model) and thus much of the book will also be useful for applications other than to surface reactions. Second, it is intended to teach the reader what can be learned from kMC simulations of surface reaction kinetics.
5 Απρ 2019 · This review article is intended as a practical guide for newcomers to the eld of kinetic Monte Carlo (KMC) simulations, and speci cally to lattice KMC simulations as prevalently used for surface and interface applications.
The premiere tool in this class of atomistic simulation methods is molecular dynamics (MD), in which one propagates the classical equations of motion forward in time. This requires first choosing an interatomic potential for the atoms and a set of boundary conditions.
position to understand (and assess) papers that use KMC, whether for simulations of radiation damage evolution or any other application, and allow him/her to write a basic KMC program of their own if they so desire.
