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CALCULATED ELECTRONIC PROPERTIES OF ORDERED ALLOYS: A HANDBOOK
The Elements and Their 3d/3d and 4d/4d Alloys
by V L Moruzzi (Florida Atlantic University, USA) & C B Sommers (Université de Paris-Sud, France)
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.
Contents:
- Preface
- bcc and fcc Elements
- 3d Transition-Metal Alloys (CsCl)
- 3d
Tansition-Metal Alloys (CuAu)
- 3d Transition-Metal Alloys (Cu3Au)
- 3d Transition-Metal Alloys (AuCu3)
- 4d Transition-Metal Alloys (CsCl)
- 4d Transition-Metal Alloys (CuAu)
- 4d Transition-Metal Alloys (Cu3Au)
- 4d Transition-Metal Alloys (AuCu3)
- Index
Readership: Experimental and theoretical physicists, metallurgists and
materials scientists.
| 448pp |
Pub. date: Apr 1995 |
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