Statistical Mechanics of Hard Ellipsoids. I. Overlap Algorithm and the Contact Function

作者: John W. Perram , M.S. Wertheim

DOI: 10.1016/0021-9991(85)90171-8

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摘要: Abstract A contact function for two arbitrary ellipsoids is derived. The numerical value of the less than 1 if they overlap, and greater do not. This extends previous work by Vieillard-Baron, who derived an overlap criterion spheroids without use a function. equivalence criteria has been checked extensive test with spheroids. It shown that greatly facilitates calculation pressure in Monte Carlo simulations.

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