DYNAMICAL PROPERTIES OF THE ARGON-KRYPTON CLUSTERS - MOLECULAR-DYNAMICS CALCULATIONS

Authors
DAWID A GBURSKI Z
Citation
A. Dawid et Z. Gburski, DYNAMICAL PROPERTIES OF THE ARGON-KRYPTON CLUSTERS - MOLECULAR-DYNAMICS CALCULATIONS, Journal of molecular structure, 410, 1997, pp. 507-511
Citations number
3
Categorie Soggetti
Chemistry Physical
Journal title
Journal of molecular structure → ACNP
ISSN journal
00222860
Volume
410
Year of publication
1997
Pages
507 - 511
Database
ISI
SICI code
0022-2860(1997)410:<507:DPOTAC>2.0.ZU;2-S
Abstract
Studies are presented of dynamical behavior in the ArnKrm (n + m = 13) clusters. We model argon-krypton mixtures classically and use molecul ar dynamics simulations to investigate several dynamical quantities (v elocity correlation functions and their power spectra, the Lindemann i ndex). Both solid and liquid state phases of Ar-n Kr-m mixture have be en studied at various temperatures and compared with the results of th e monatomic Ar-13 cluster. (C) 1997 Elsevier Science B.V.