Article
The Slater–Pauling curve: First principles calculations of the moments of Fe1 − c Ni c and V1 − c Fe c
Journal of Applied Physics
(1991)
Abstract
We have performed calculations of the electronic structure of the random substitutional alloys Fe1−c Ni c and V1−c Fe c using the spin‐polarized, self‐consistent Korringa–Kohn–Rostoker coherent‐potential approximation (KKR‐CPA) method. This is a first principles method based on spin density functionaltheory and a local spin density approximation for the exchange and correlation functional. For fcc Fe1−c Ni c , a range of volumes were considered for 0.25
Keywords
- Nickel,
- Vanadium,
- Correlation functions,
- Density functional theory,
- Electron densities of states
Disciplines
Publication Date
1991
Publisher Statement
The following article appeared in J. Appl. Phys. 61, 3715 (1987) and may be found at http://dx.doi.org/10.1063/1.338670.
Copyright 1987 American Institute of Physics. This article may be downloaded for personal use only. Any other use requires prior permission of the author and the American Institute of Physics.
Citation Information
Duane D. Johnson, F. J. Pinski and J. B. Staunton. "The Slater–Pauling curve: First principles calculations of the moments of Fe1 − c Ni c and V1 − c Fe c" Journal of Applied Physics Vol. 61 Iss. 8 (1991) Available at: http://works.bepress.com/duane_johnson/93/