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Asymptotic behaviour of the radial distribution function in a quasi-crystalline model of liquids

 

作者: N.N. Medvedev,   Yu.I. Naberukhin,  

 

期刊: Physics and Chemistry of Liquids  (Taylor Available online 1977)
卷期: Volume 6, issue 2  

页码: 137-148

 

ISSN:0031-9104

 

年代: 1977

 

DOI:10.1080/00319107708084136

 

出版商: Taylor & Francis Group

 

数据来源: Taylor

 

摘要:

By a mathematical analysis of the formulae of a quasi-crystalline model of liquids, i.e. a crystal lattice with smeared out lattice sites, it is shown that this model leads to a nonphysical asymptotic behaviour of the radial distribution function. To remove this defect it is necessary to modify the initial lattice by changing either the coordination numbers or the radii of the coordination spheres. Some ways of such modification are given and illustrated by concrete calculations.

 

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