Practical Aspects of Computational Chemistry III

Editors: Leszczynski, Jerzy, Shukla, Manoj K. (Eds.)

  • Third volume of selected contributions from annual computational chemistry conference
  • Defines key concepts required to grasp the basics
  • Features current themes in modern computational chemistry
  • Aimed at individuals in the physical sciences, biological sciences and materials science
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eBook $139.00
price for USA (gross)
  • ISBN 978-1-4899-7445-7
  • Digitally watermarked, DRM-free
  • Included format: PDF, EPUB
  • ebooks can be used on all reading devices
  • Immediate eBook download after purchase
Hardcover $179.00
price for USA
  • ISBN 978-1-4899-7444-0
  • Free shipping for individuals worldwide
  • Usually dispatched within 3 to 5 business days.
Softcover $179.00
price for USA
  • ISBN 978-1-4899-7864-6
  • Free shipping for individuals worldwide
  • Usually dispatched within 3 to 5 business days.
About this book

Theoretical and Computational Chemistry research has made unparalleled advancements in understanding every expanding area of science and technology. This volume presents the state-of-the-art research and progress made by eminent researchers in the area of theoretical computational chemistry and physics. The title mirrors the name of the annual international conference “Conference on Current Trends on Computational Chemistry” (CCTCC) which has become a popular discussion ground for eminent Theoretical and Computational Chemists and has been honored by the presence of several Nobel Laureates. Practical Aspects of Computational Chemistry III is aimed at theoretical and computational chemists, physical chemists, material scientists and those who are eager to apply computational chemistry methods to problems of chemical and physical importance. The book is a valuable resource for undergraduate, graduate and PhD students as well as established researchers.

Table of contents (12 chapters)

  • The Scanning Tunneling Microscopy of Adsorbed Molecules on Semiconductors: Some Theoretical Answers to the Experimental Observations

    Sonnet, Ph. (et al.)

    Pages 1-44

  • Models of the Interfaces in Superhard TiN-Based Heterostructures and Nanocomposites from First-Principles

    Ivashchenko, Volodymyr (et al.)

    Pages 45-91

  • Investigating Complex Surface Phenomena Using Density Functional Theory

    Pushpa, Raghani

    Pages 93-106

  • Growth Mechanism, Energetics and CO Affinities of Vanadium Doped Gold Clusters, AunV with n = 1−20

    Nhat, Pham Vu (et al.)

    Pages 107-149

  • Structure and Energetics of Polyhedral Oligomeric Silsesquioxane (T8,T10,T12-POSS) Cages with Atomic and Ionic Lithium Species

    Rehman, Habib U. (et al.)

    Pages 151-165

Buy this book

eBook $139.00
price for USA (gross)
  • ISBN 978-1-4899-7445-7
  • Digitally watermarked, DRM-free
  • Included format: PDF, EPUB
  • ebooks can be used on all reading devices
  • Immediate eBook download after purchase
Hardcover $179.00
price for USA
  • ISBN 978-1-4899-7444-0
  • Free shipping for individuals worldwide
  • Usually dispatched within 3 to 5 business days.
Softcover $179.00
price for USA
  • ISBN 978-1-4899-7864-6
  • Free shipping for individuals worldwide
  • Usually dispatched within 3 to 5 business days.
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Bibliographic Information

Bibliographic Information
Book Title
Practical Aspects of Computational Chemistry III
Editors
  • Jerzy Leszczynski
  • Manoj K. Shukla
Copyright
2014
Publisher
Springer US
Copyright Holder
Springer Science+Business Media New York
eBook ISBN
978-1-4899-7445-7
DOI
10.1007/978-1-4899-7445-7
Hardcover ISBN
978-1-4899-7444-0
Softcover ISBN
978-1-4899-7864-6
Edition Number
1
Number of Pages
VIII, 436
Number of Illustrations and Tables
71 b/w illustrations, 131 illustrations in colour
Topics