Structure and Bonding

Principles and Applications of Density Functional Theory in Inorganic Chemistry I

Editors: Kaltsoyanis, Nik, McGrady, John E. (Eds.)

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Table of contents (4 chapters)

  • The Calculation of NMR Parameters in Transition Metal Complexes

    Autschbach, Jochen

    Pages 1-48

  • Excitation Energies of Metal Complexes with Time-dependent Density Functional Theory

    Rosa, Angela (et al.)

    Pages 49-116

  • Applications of Hybrid DFT/Molecular Mechanics to Homogeneous Catalysis

    Ujaque, Gregori (et al.)

    Pages 117-150

  • DFT Computation of Relative Spin-State Energetics of Transition Metal Compounds

    Harvey, Jeremy N.

    Pages 151-184

Buy this book

eBook $229.00
price for USA (gross)
  • ISBN 978-3-540-40924-3
  • Digitally watermarked, DRM-free
  • Included format:
  • ebooks can be used on all reading devices
  • Immediate eBook download after purchase
Hardcover $369.00
price for USA
  • ISBN 978-3-540-21860-9
  • Free shipping for individuals worldwide
  • Usually dispatched within 3 to 5 business days.
Softcover $299.00
price for USA
  • ISBN 978-3-662-14538-8
  • Free shipping for individuals worldwide
  • Usually dispatched within 3 to 5 business days.
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Bibliographic Information

Bibliographic Information
Book Title
Principles and Applications of Density Functional Theory in Inorganic Chemistry I
Editors
  • Nik Kaltsoyanis
  • John E. McGrady
Series Title
Structure and Bonding
Series Volume
112
Copyright
2004
Publisher
Springer-Verlag Berlin Heidelberg
Copyright Holder
Springer-Verlag Berlin Heidelberg
eBook ISBN
978-3-540-40924-3
DOI
10.1007/b12224
Hardcover ISBN
978-3-540-21860-9
Softcover ISBN
978-3-662-14538-8
Series ISSN
0081-5993
Edition Number
1
Number of Pages
X, 194
Topics