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Principles and Applications of Density Functional Theory in Inorganic Chemistry I

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Principles and Applications of Density Functional Theory in Inorganic Chemistry I
Bag om Principles and Applications of Density Functional Theory in Inorganic Chemistry I

J. Autschbach: The Calculation of NMR Parameters in Transition Metal Complexes.- A. Rosa, G. Ricciardi, O. Gritsenko, E.J. Baerends: Excitation Energies of Metal Complexes with Time-dependent Density Functional Theory.- G. Ujaque, F. Maseras: Applications of Hybrid DFT/Molecular Mechanics to Homogeneous Catalysis.- J.N. Harvey: DFT Computation of Relative Spin-State Energetics of Transition Metal Compounds.

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  • Sprog:
  • Engelsk
  • ISBN:
  • 9783540218609
  • Indbinding:
  • Hardback
  • Sideantal:
  • 194
  • Udgivet:
  • 14. september 2004
  • Udgave:
  • 2004
  • Størrelse:
  • 234x156x12 mm.
  • Vægt:
  • 420 g.
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Leveringstid: 8-11 hverdage
Forventet levering: 18. januar 2025

Beskrivelse af Principles and Applications of Density Functional Theory in Inorganic Chemistry I

J. Autschbach: The Calculation of NMR Parameters in Transition Metal Complexes.- A. Rosa, G. Ricciardi, O. Gritsenko, E.J. Baerends: Excitation Energies of Metal Complexes with Time-dependent Density Functional Theory.- G. Ujaque, F. Maseras: Applications of Hybrid DFT/Molecular Mechanics to Homogeneous Catalysis.- J.N. Harvey: DFT Computation of Relative Spin-State Energetics of Transition Metal Compounds.

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