Computational materials science : surfaces, interfaces, crystallization / A.M. Ovrutsky and A.S. Prokhoda, Department of Physics of Metals, Faculty of Physics, Electronics and Computer Systems, Oles Gonchar Dnipropetrovs'k National University, Dnipropetrovs'k, Ukraine ; M.S. Rasshchupkyna, Department of Low-Dimensional and Metastable Materials, Max Planck Institute for Intelligent Systems, Stuttgart, Germany.

By: Contributor(s): Material type: TextTextSeries: Elsevier insightsPublisher: Amsterdam ; Boston : Elsevier, [2014]Copyright date: ♭2014Description: xvii, 370 pages : illustrations ; 24 cmContent type:
  • text
Media type:
  • unmediated
Carrier type:
  • volume
ISBN:
  • 9780124201439 (hbk.)
  • 0124201431 (hbk.)
Subject(s): DDC classification:
  • 548.50113 23
LOC classification:
  • TA404.23 .O87 2014
Contents:
Computer modeling of physical phenomena and processes -- Basic concepts in theory of phase transformations -- Diffusion problems of crystal growth: methods of numerical solutions -- Structure of the boundary surfaces -- Adsorption. The Gibbs Adsoprtion Equation -- Simulation techniques for atomic systems -- The surface processes during crystalization -- Modern simulations by the molecular dynamics method -- Computational experiments in materials science.
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Includes bibliographical references.

Computer modeling of physical phenomena and processes -- Basic concepts in theory of phase transformations -- Diffusion problems of crystal growth: methods of numerical solutions -- Structure of the boundary surfaces -- Adsorption. The Gibbs Adsoprtion Equation -- Simulation techniques for atomic systems -- The surface processes during crystalization -- Modern simulations by the molecular dynamics method -- Computational experiments in materials science.

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