Hartree-fock-slater Method for Materials Science: the Dv-x Alpha Method for Design and Characterization of Materials - Springer Series in Materials Science - Hirohiko Adachi - Libros - Springer-Verlag Berlin and Heidelberg Gm - 9783642063848 - 12 de febrero de 2010
En caso de que portada y título no coincidan, el título será el correcto

Hirohiko Adachi
Hartree-fock-slater Method for Materials Science: the Dv-x Alpha Method for Design and Characterization of Materials - Springer Series in Materials Science 1st Ed. Softcover of Orig. Ed. 2006 edition

Precio
$ 157,99
sin IVA

Pedido desde almacén remoto

Entrega prevista 14 - 27 de jul.

Nuestros clientes opinan:

Política de devolución de 14 días conforme a la legislación europea de protección de los consumidores
Mejor valorado en Trustpilot
Añadir a tu lista de deseos de iMusic

Jacket Description/Back: 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. Table of Contents: 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. Marc Notes: 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.

240 pages, black & white illustrations

Medios de comunicación Libros     Paperback Book   (Libro con tapa blanda y lomo encolado)
Publicado 12 de febrero de 2010
ISBN13 9783642063848
Editores Springer-Verlag Berlin and Heidelberg Gm
Páginas 240
Dimensiones 156 × 234 × 13 mm   ·   367 g
Lengua Alemán  
Editor Adachi, Hirohiko
Editor Kawai, Jun
Editor Mukoyama, Takashi

Mere med samme udgiver

Ver todo de Hirohiko Adachi ( Ej. Paperback Book )