Please use this identifier to cite or link to this item: http://hdl.handle.net/2445/18805
Title: Static structure and dynamics of the liquid Li-Na and Li-Mg alloys
Author: Canales Gabriel, Manel
González Fernández, David José
González Tesedo, Luis Enrique
Padró i Cárdenas, Joan Àngel
Keywords: Líquids
Física de l'estat sòlid
Dinàmica de fluids
Cristal·lografia
Liquids
Solid state physics
Fluid dynamics
Crystallography
Issue Date: 1998
Publisher: The American Physical Society
Abstract: We present calculations for the static structure and ordering properties of two lithium-based s-p bonded liquid alloys, Li-Na and Li-Mg. Our theoretical approach is based on the neutral pseudoatom method to derive the interatomic pair potentials, and on the modified-hypernetted-chain theory of liquids to obtain the liquid static structure, leading to a whole combination that is free of adjustable parameters. The study is complemented by performing molecular dynamics simulations which, besides checking the theoretical static structural results, also allow a calculation of some dynamical properties. The obtained results are compared with the available experimental data.
Note: Reproducció del document publicat a: http://dx.doi.org/10.1103/PhysRevE.58.4747
It is part of: Physical Review E, 1998, vol. 58, núm 4, p. 4747-4757
URI: http://hdl.handle.net/2445/18805
ISSN: 1063-651X
Appears in Collections:Articles publicats en revistes (Física de la Matèria Condensada)

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