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  • © 2010

Trends in Computational Nanomechanics

Transcending Length and Time Scales

  • Presents recent developments in theoretical and computational methods for studying problems in which multiple length and/or time scales must be simultaneously resolved
  • Includes example applications in nanomechanics
  • The only review volume to summarize important research efforts involving multi-scale methods and the solution of mutli-scale problems

Part of the book series: Challenges and Advances in Computational Chemistry and Physics (COCH, volume 9)

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Table of contents (19 chapters)

  1. Front Matter

    Pages i-xviii
  2. Hybrid Quantum/Classical Modeling of Material Systems: The “Learn on the Fly” Molecular Dynamics Scheme

    • Gianpietro Moras, Rathin Choudhury, James R. Kermode, Gabor CsÁnyi, Michael C. Payne, Alessandro De Vita
    Pages 1-23
  3. Multiscale Molecular Dynamics and the Reverse Mapping Problem

    • Bernd Ensing, Steven O. Nielsen
    Pages 25-59
  4. A Multiscale Methodology to Approach Nanoscale Thermal Transport

    • Ishwar K. Puri, Sohrail Murad
    Pages 135-150
  5. Silicon Nanowires: From Empirical to First Principles Modeling

    • Ricardo W. Nunes, JoÃo F. Justo
    Pages 173-191
  6. Potentials for van der Waals Interaction in Nano-Scale Computation

    • J. Xiao, W. Zhou, Y. Huang, J.M. Zuo, K.C. Hwang
    Pages 323-333
  7. Multiscale Modeling of Carbon Nanotubes

    • Yuzhou Sun, K.M. Liew
    Pages 367-388
  8. Quasicontinuum Simulations of Deformations of Carbon Nanotubes

    • Seyoung Im, Sungjin Kwon, Jong Youn Park
    Pages 389-419
  9. Electronic Properties and Reactivities of Perfect, Defected, and Doped Single-Walled Carbon Nanotubes

    • Wei Quan Tian, Lei Vincent Liu, Ya Kun Chen, Yan Alexander Wang
    Pages 421-471
  10. Multiscale Modeling of Biological Protein Materials – Deformation and Failure

    • Sinan Keten, Jeremie Bertaud, Dipanjan Sen, Zhiping Xu, Theodor Ackbarow, Markus J. Buehler
    Pages 473-533
  11. Out of Many, One: Modeling Schemes for Biopolymer and Biofibril Networks

    • E.A. Sander, A.M. Stein, M.J. Swickrath, V.H. Barocas
    Pages 557-602

About this book

Trends in Computational Nanomechanics reviews recent advances in analytical and computational modeling frameworks to describe the mechanics of materials on scales ranging from the atomistic, through the microstructure or transitional, and up to the continuum. The book presents new approaches in the theory of nanosystems, recent developments in theoretical and computational methods for studying problems in which multiple length and/or time scales must be simultaneously resolved, as well as example applications in nanomechanics.

This title will be a useful tool of reference for professionals, graduates and undergraduates interested in Computational Chemistry and Physics, Materials Science, Nanotechnology.

Editors and Affiliations

  • Dept. Mechanical Engineering, University of Minnesota, Minneapolis, U.S.A.

    Traian Dumitrica

About the editor

Dr. Traian Dumitrica received a doctorate in physics from Texas A&M University in 2000. Since then he has worked at Rice University, Freie Universitaet Berlin, and Universitaet Kassel. He joined the University of Minnesota faculty in 2005. His research focuses in understanding the mechanical properties of materials using atomistic computational methods. System of interest include carbon nanotubes, silicon nanoparticles, and coherent phonons in semiconductors.

Bibliographic Information

Buy it now

Buying options

eBook USD 259.00
Price excludes VAT (USA)
  • Available as EPUB and PDF
  • Read on any device
  • Instant download
  • Own it forever
Softcover Book USD 329.99
Price excludes VAT (USA)
  • Compact, lightweight edition
  • Dispatched in 3 to 5 business days
  • Free shipping worldwide - see info
Hardcover Book USD 329.99
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