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Hartree-Fock-Slater Method for Materials Science The DV-X Alpha Method for Design and Characterization of Materials /

Molecular-orbital calculations for materials design such as alloys, ceramics, and coordination compounds are now possible for experimentalists. Molecuar-orbital calculations for the interpretation of chemical effect of spectra are also possible for experimentalists. The most suitable molecular-orbit...

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Detalles Bibliográficos
Clasificación:Libro Electrónico
Autor Corporativo: SpringerLink (Online service)
Otros Autores: Adachi, Hirohiko (Editor ), Mukoyama, Takeshi (Editor ), Kawai, Jun (Editor )
Formato: Electrónico eBook
Idioma:Inglés
Publicado: Berlin, Heidelberg : Springer Berlin Heidelberg : Imprint: Springer, 2006.
Edición:1st ed. 2006.
Colección:Springer Series in Materials Science, 84
Temas:
Acceso en línea:Texto Completo
Tabla de Contenidos:
  • Fundamental
  • DV-X? Method and Molecular Structure
  • Materials Science
  • Alloy Design Based on the DV-X? Cluster Method
  • Chemical Bonding Around Lattice Imperfections in 3d-Transition Metal Compounds
  • Ceramics
  • Magnetic Properties
  • Optical Materials
  • Heavy Elements
  • Spectroscopy
  • Radiative Transitions
  • Response to the Creation of a Core Hole in Transition-Metal Compounds
  • Determining Electronic Structure from Auger Spectra in the Cluster Approximation.