Structure of molecular liquids : closure relations for hard spheroids

Cheung, David and Anton, L and Masters, A.J. (2007) Structure of molecular liquids : closure relations for hard spheroids. Physical Review E: Statistical Physics, Plasmas, Fluids, and Related Interdisciplinary Topics, 76 (4). 041201. ISSN 2470-0053

Abstract

We present the results of Monte Carlo simulations of hard spheroids of revolution of different elongations. Both prolate and oblate shapes are examined. A systematic study of the bridge function b(1,2), and direct comparison with the indirect correlation function γ(1,2)=h(1,2)−c(1,2) at densities spanning the isotropic fluid range, allow us to evaluate the accuracy of various proposed closure relations for integral equations.

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• Item metadata

  Item type:	Article
  ID code:	43754
  Dates:	Date Event 2007 Published
  Subjects:	Science > Chemistry
  Department:	Faculty of Science > Pure and Applied Chemistry
  Depositing user:	Pure Administrator
  Date deposited:	07 May 2013 15:06
  Last modified:	11 Nov 2024 10:24
  URI:	https://strathprints.strath.ac.uk/id/eprint/43754