CALCULATED ELECTRONIC PROPERTIES OF... (eBook)

The Elements and Their 3d/3d and 4d/4d Alloys

C B Sommers, V L Moruzzi (Autoren)

eBook Download: PDF

1995
448 Seiten
World Scientific Publishing Company (Verlag)
978-981-281-551-4 (ISBN)

Infos

This is a handbook of calculated electronic properties of elements and of 3d/3d and 4d/4d ordered alloys. The book derives the ground-state or equilibrium properties of the metallic elements in both bcc and fcc structures, and of existing and nonexisting ordered binary transition-metal alloys in CsCl, CuAu, and Cu3Au structures by the analysis of binding curves, or total energy vs. volume curves, calculated from first-principles augmented-spherical-wave methods. The calculated properties, energy bands along symmetry lines in the respective Brillouin zones, and the total and I-decomposed density-of-states for each constituent is presented in a convenient single-page format. The calculated quantities presented include lattice constants, total energies, bulk moduli, potential at the nucleus, and charge densities at the nucleus and in the interstitial regions.

Produkt-Details

• Erscheint lt. Verlag: 28.4.1995
• Verlagsort: Singapore
• Sprache: englisch
• Themenwelt: Naturwissenschaften ► Chemie ► Anorganische Chemie
• Themenwelt: Naturwissenschaften ► Chemie ► Physikalische Chemie
• Themenwelt: Naturwissenschaften ► Physik / Astronomie ► Festkörperphysik
• Themenwelt: Technik
• ISBN-10: 981-281-551-1 / 9812815511
• ISBN-13: 978-981-281-551-4 / 9789812815514