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Atomic-scale structure of alkali halide solid solutions

PERESSI, MARIA
•
BALDERESCHI, ALFONSO
1987
  • journal article

Periodico
SOLID STATE COMMUNICATIONS
Abstract
A simple model is proposed to explain the crystallographic properties of solid solutions of the alkali halides. The random system is simulated with a periodic superlattice whose energy is evaluated with the Born-Mayer model generalized to include ionic polarization. The resulting average lattice parameter and anioncation distances agree with recent EXAFS data on K1−xRbxBr, RbBr1−xIx, and KCl1−xBrx. The results show that ionic polarization plays a significant role in the determination of both interatomic distances and heats of formation.
DOI
10.1016/0038-1098(87)91172-0
Archivio
http://hdl.handle.net/11368/2335230
info:eu-repo/semantics/altIdentifier/scopus/2-s2.0-0023381693
doi:10.1016/0038-1098(87)91172-0
Diritti
metadata only access
Soggetti
  • pseudobinary ionic al...

  • solid solution

  • alkali halides

Visualizzazioni
4
Data di acquisizione
Apr 19, 2024
Vedi dettagli
google-scholar
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