Dynamical properties of the argon-krypton clusters: Molecular dynamics calculations

被引：25

作者：

Dawid, A ^{[1
]}

Gburski, Z ^{[1
]}

机构：

[1] SILESIAN UNIV, DEPT PHYS, PL-40007 KATOWICE, POLAND

来源：

JOURNAL OF MOLECULAR STRUCTURE | 1997年 / 410卷

关键词：

MD simulations; multicomponent cluster; self- and mutual-diffusion processes;

D O I：

10.1016/S0022-2860(96)09512-9

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

Studies are presented of dynamical behavior in the ArnKrm (n + m = 13) clusters. We model argon-krypton mixtures classically and use molecular dynamics simulations to investigate several dynamical quantities (velocity correlation functions and their power spectra, the Lindemann index). Both solid and liquid state phases of Ar-n Kr-m mixture have been studied at various temperatures and compared with the results of the monatomic Ar-13 cluster. (C) 1997 Elsevier Science B.V.

引用

页码：507 / 511

页数：5