Title of article
Dynamics of orientationally ordered domains in a short chain-molecule system: Size dependence of domain oscillation Original Research Article
Author/Authors
Hiroaki Nakamura، نويسنده , , Susumu Fujiwara، نويسنده , , Tetsuya Sato، نويسنده ,
Issue Information
دوهفته نامه با شماره پیاپی سال 2002
Pages
4
From page
346
To page
349
Abstract
It was reported, in our previous works, that two orientationally ordered domains of short chain molecules move collectively as if they were rigid bodies in spite of the non-bonded short-range interaction potential (Lennard–Jones potential) among chain molecules. In this paper, in order to investigate the rigidity of the domain of short chain molecules in further detail, molecular dynamics simulations are performed for the following four case combinations of domains: the case I, II, III and IV are (61+29), (61+61), (124+61) and (124+124) chain molecule combinations, respectively. From these simulations, the size dependence of the domainsʹ motion is demonstrated. Estimating an oscillation period τ for each case, it is found that τ(61,29)≃τ(61,61)<τ(124,61)<τ(124,124). This relation is a peculiar property of orientationally ordered domains in a short chain-molecule system.
Keywords
molecular dynamics simulation , Hexagonally packed domain , Chain molecule , Rigid body , Polymer , Inertia
Journal title
Computer Physics Communications
Serial Year
2002
Journal title
Computer Physics Communications
Record number
1136025
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