AN ORDERED STRUCTURE FOR BINARY-MIXTURES OF RARE-GAS ATOMS FROM NUMERICAL-SIMULATION

Citation
Dw. Greig et Gs. Pawley, AN ORDERED STRUCTURE FOR BINARY-MIXTURES OF RARE-GAS ATOMS FROM NUMERICAL-SIMULATION, Molecular physics, 89(2), 1996, pp. 447-462
Citations number
12
Categorie Soggetti
Physics, Atomic, Molecular & Chemical
Journal title
ISSN journal
00268976
Volume
89
Issue
2
Year of publication
1996
Pages
447 - 462
Database
ISI
SICI code
0026-8976(1996)89:2<447:AOSFBO>2.0.ZU;2-4
Abstract
Simulations of clusters formed with equal proportions of Ar and Kr ato ms suggest that under certain conditions a regular CsCl structure will be formed on cooling. Comparison with similar studies of pure Kr syst ems, both as clusters and in the bulk, strengthens the reliability of these model calculations. Whether the proposed CsCl structure can actu ally form is presented as a challenge to the experimentalists, especia lly those doing molecular beam experiments. The formation of the CsCl structure by slow annealing has been the most successful, but consider able order is apparent even when the liquid cluster undergoes a very r apid quench.