Share Email Print
cover

Proceedings Paper

Partial structure factors of alloys by molecular dynamics: influence of the size rate for three systems of alkali metals
Author(s): J.-F. Wax; N. Jakse; J.-L. Bretonnet
Format Member Price Non-Member Price
PDF $14.40 $18.00

Paper Abstract

Molecular dynamics simulation is used to predict the structure factor of metallic alloys in the liquid state. Whereas the experiment does not easily and cheaply allow one to determine the partial structure factors, numerical simulation is able to get them provided the interaction potentials are known. The effective ion-ion forces are deduced from the electron-ion interaction. Then, the partial structure factors of Na-K, Na-Rb and Na-Cs are calculated, at equiatomic composition, and the influence of the size rate between the atoms of each component is studied.

Paper Details

Date Published: 1 January 1998
PDF: 5 pages
Proc. SPIE 3345, International Workshop on New Approaches to High-Tech Materials: Nondestructive Testing and Computer Simulations in Materials Science and Engineering, (1 January 1998); doi: 10.1117/12.299603
Show Author Affiliations
J.-F. Wax, Univ. de Metz (France)
N. Jakse, Univ. de Metz (France)
J.-L. Bretonnet, Univ. de Metz (France)


Published in SPIE Proceedings Vol. 3345:
International Workshop on New Approaches to High-Tech Materials: Nondestructive Testing and Computer Simulations in Materials Science and Engineering
Alexander I. Melker, Editor(s)

© SPIE. Terms of Use
Back to Top