Cantitate/Preț
Produs

Hartree-Fock-Slater Method for Materials Science: The DV-X Alpha Method for Design and Characterization of Materials: Springer Series in Materials Science, cartea 84

Editat de Hirohiko Adachi, Takeshi Mukoyama, Jun Kawai
en Limba Engleză Hardback – 8 dec 2005
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-orbital calculation method for these purpose is the DV-Xa method, which is robust in such a way that the calculation converges to a result even if the structure of the molecule or solid is impossible in the pressure and temperature ranges on earth. This book specially addresses the methods to design novel materials and to predict the spectralline shape of unknown materials using the DV-Xa molecular-orbital method, but is also useful for those who want to calculate electronic structures of materials using any kind of method.
Citește tot Restrânge

Toate formatele și edițiile

Toate formatele și edițiile Preț Express
Paperback (1) 89291 lei  6-8 săpt.
  Springer Berlin, Heidelberg – 12 feb 2010 89291 lei  6-8 săpt.
Hardback (1) 89709 lei  6-8 săpt.
  Springer Berlin, Heidelberg – 8 dec 2005 89709 lei  6-8 săpt.

Din seria Springer Series in Materials Science

Preț: 89709 lei

Preț vechi: 109402 lei
-18% Nou

Puncte Express: 1346

Preț estimativ în valută:
17175 18608$ 14342£

Carte tipărită la comandă

Livrare economică 12-26 decembrie

Preluare comenzi: 021 569.72.76

Specificații

ISBN-13: 9783540245087
ISBN-10: 3540245081
Pagini: 256
Ilustrații: XVI, 240 p. 130 illus.
Dimensiuni: 155 x 235 x 22 mm
Greutate: 0.49 kg
Ediția:2006
Editura: Springer Berlin, Heidelberg
Colecția Springer
Seria Springer Series in Materials Science

Locul publicării:Berlin, Heidelberg, Germany

Public țintă

Research

Cuprins

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.

Textul de pe ultima copertă

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-orbital calculation method for these purpose is the DV-Xa method, which is robust in such a way that the calculation converges to a result even if the structure of the molecule or solid is impossible in the pressure and temperature ranges on earth. This book specially addresses the methods to design novel materials and to predict the spectrallline shape of unknown materials using the DV-Xa molecular-orbital method, but is also useful for those who want to calculate electronic structures of materials using any kind of method.

Caracteristici

Basic book on Hartree-Fock-Slater Method Most comprehensive presentation of its applications in Materials Science