An Introduction to Kinetic Monte Carlo Simulations of Surface Reactions: 856 (Lecture Notes in Physics, 856) - Softcover

Book 78 of 241: Lecture Notes in Physics

Jansen, A.P.J.

 
9783642294877: An Introduction to Kinetic Monte Carlo Simulations of Surface Reactions: 856 (Lecture Notes in Physics, 856)
Softcover
ISBN 10: 3642294871 ISBN 13: 9783642294877
Publisher: Springer, 2012

Synopsis

Kinetic Monte Carlo (kMC) simulations still represent a quite new area of research, with a rapidly growing number of publications. Broadly speaking, kMC can be applied to any system describable as a set of minima of a potential-energy surface, the evolution of which will then be regarded as hops from one minimum to a neighboring one. The hops in kMC are modeled as stochastic processes and the algorithms use random numbers to determine at which times the hops occur and to which neighboring minimum they go.
Sometimes this approach is also called dynamic MC or Stochastic Simulation Algorithm, in particular when it is applied to solving macroscopic rate equations.

This book has two objectives. 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.

With these goals in mind, the present text is conceived as a self-contained introduction for students and non-specialist researchers alike who are interested in entering the field and learning about the topic from scratch.

"synopsis" may belong to another edition of this title.

From the Back Cover

Kinetic Monte Carlo (kMC) simulations still represent a quite new area of research, with a rapidly growing number of publications. Broadly speaking, kMC can be applied to any system describable as a set of minima of a potential-energy surface, the evolution of which will then be regarded as hops from one minimum to a neighboring one. The hops in kMC are modeled as stochastic processes and the algorithms use random numbers to determine at which times the hops occur and to which neighboring minimum they go.
Sometimes this approach is also called dynamic MC or Stochastic Simulation Algorithm, in particular when it is applied to solving macroscopic rate equations.

This book has two objectives. 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.

With these goals in mind, the present text is conceived as a self-contained introduction for students and non-specialist researchers alike who are interested in entering the field and learning about the topic from scratch.

"About this title" may belong to another edition of this title.

Publisher
Springer
Publication date
2012
Language
English
ISBN 10 
3642294871
ISBN 13 
9783642294877
Binding
Paperback
Number of pages
271

Other Popular Editions of the Same Title

9783642294891: An Introduction to Kinetic Monte Carlo Simulations of Surface Reactions

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ISBN 10:  3642294898 ISBN 13:  9783642294891
Publisher: Springer, 2012
Softcover