An introduction to kinetic Monte Carlo simulations of surface reactions.

DOI10.1007/978-3-642-29488-4zbMath1272.74002OpenAlexW643878296MaRDI QIDQ413787

A. P. J. Jansen

Publication date: 7 May 2012

Published in: Lecture Notes in Physics (Search for Journal in Brave)

Full work available at URL: http://cds.cern.ch/record/1631390

zbMATH Keywords

phase transitionpotential energy surfaceminimumstochastic jumprandom number algorithm

Mathematics Subject Classification ID

Dynamics of phase boundaries in solids (74N20) Research exposition (monographs, survey articles) pertaining to mechanics of deformable solids (74-02) Chemical and reactive effects in solid mechanics (74F25) Stochastic and other probabilistic methods applied to problems in solid mechanics (74S60)

Related Items (6)

Solving the master equation without kinetic Monte Carlo: tensor train approximations for a CO oxidation model ⋮ Efficient simulation of Markov chains using segmentation ⋮ A derivation and scalable implementation of the synchronous parallel kinetic Monte Carlo method for simulating long-time dynamics ⋮ Massively parallel kinetic Monte Carlo simulations of charge carrier transport in organic semiconductors ⋮ Kinetic theory of chemical reactions on crystal surfaces ⋮ A General Framework for Consistent Estimation of Charge Transport Properties via Random Walks in Random Environments

This page was built for publication: An introduction to kinetic Monte Carlo simulations of surface reactions.