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  • Book
  • © 2004

Computational Materials Science

From Basic Principles to Material Properties

  • Materials science of mesoscopic systems is becoming more and more important in nanotechnology.
  • This is the first book available on this topic
  • Includes supplementary material: sn.pub/extras

Part of the book series: Lecture Notes in Physics (LNP, volume 642)

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Softcover Book USD 109.99
Price excludes VAT (USA)
  • Compact, lightweight edition
  • Dispatched in 3 to 5 business days
  • Free shipping worldwide - see info
Hardcover Book USD 109.99
Price excludes VAT (USA)
  • Durable hardcover edition
  • Dispatched in 3 to 5 business days
  • Free shipping worldwide - see info

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Table of contents (14 chapters)

  1. Front Matter

  2. 1. Introduction

    • The Editors
    Pages 1-3
  3. 4. A Solid-State Theoretical Approach to the Optical Properties of Photonic Crystals

    • K. Busch, F. Hagmann, D. Hermann, S.F. Mingaleev, M. Schillinger
    Pages 55-74
  4. 6. Symmetry Properties of Electronic and Photonic Band Structures

    • W. Hergert, M. Däne, D. Ködderitzsch
    Pages 103-125
  5. 8. Magnetism, Structure and Interactions at the Atomic Scale

    • V.S. Stepanyuk, W. Hergert
    Pages 159-176
  6. 9. Molecular Dynamics Simulations in Biology, Chemistry and Physics

    • P. Entel, W.A. Adeagbo, M. Sugihara, G. Rollmann, A.T. Zayak, M. Kreth et al.
    Pages 177-206
  7. 11. Integration of Modelling at Various Length and Time Scales

    • S. McGrother, G. Goldbeck-Wood, Y.M. Lam
    Pages 223-233
  8. Back Matter

About this book

Computational Physics is now a discipline in its own right, comparable with theoretical and experimental physics. Computational Materials Science concentrates on the calculation of materials properties starting from microscopic theories. It has become a powerful tool in industrial research for designing new materials, modifying materials properties and optimizing chemical processes. This book focusses on the application of computational methods in new fields of research, such as nanotechnology, spintronics and photonics, which will provide the foundation for important technological advances in the future. Methods such as electronic structure calculations, molecular dynamics simulations and beyond are presented, the discussion extending from the basics to the latest applications.

Bibliographic Information

Buy it now

Buying options

Softcover Book USD 109.99
Price excludes VAT (USA)
  • Compact, lightweight edition
  • Dispatched in 3 to 5 business days
  • Free shipping worldwide - see info
Hardcover Book USD 109.99
Price excludes VAT (USA)
  • Durable hardcover edition
  • Dispatched in 3 to 5 business days
  • Free shipping worldwide - see info

Tax calculation will be finalised at checkout

Other ways to access