Structure of molecular liquids: Closure relations for hard spheroids

David L. Cheung; Lucian Anton; Michael P. Allen; Andrew J. Masters

doi:10.1103/PhysRevE.76.041201

Structure of molecular liquids: Closure relations for hard spheroids

David L. Cheung
, Lucian Anton
, Michael P. Allen
, Andrew J. Masters

Research output: Contribution to a Journal (Peer & Non Peer) › Article › peer-review

11 Citations (Scopus)

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.

Original language	English
Article number	041201
Journal	Physical Review E - Statistical Physics, Plasmas, Fluids, and Related Interdisciplinary Topics
Volume	76
Issue number	4
DOIs	https://doi.org/10.1103/PhysRevE.76.041201
Publication status	Published - 8 Oct 2007
Externally published	Yes

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10.1103/PhysRevE.76.041201

Cite this

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ER -

Structure of molecular liquids: Closure relations for hard spheroids

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