Phys. Rev. Lett. 84, 4272 - 4275 (2000)

Predicting the Liquid-Vapor Critical Point from the Crystal Anharmonicity

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Yaakov Rosenfeld
Nuclear Research Center Negev, P.O. Box 9001, Beer-Sheva 84190, Israel

Received 29 November 1999

A “universal” dependence is predicted of the reduced critical parameters, kBTc / E0(γ), Vc / V0(γ), and PcVc/kBTc  =  Zc(γ), on the crystal anharmonicity γ (closely related to the Grüneisen parameter ΓG). It is based on a simplified embedded-atom type approach which enables one to utilize the universal zero-temperature equation of state in a version of fluid perturbation theory. This model's critical temperature and density agree with the experimental results for both the heavy rare gases ( γ≃2.85) and heavy alkali metals ( γ≃1.35). Predicted critical parameters for many other liquid metals are consistent with previous estimates, but the model is not applicable when directional bonding is important.


©2000 The American Physical Society

URL: http://link.aps.org/abstract/PRL/v84/p4272
DOI: 10.1103/PhysRevLett.84.4272
PACS: 05.70.Ce, 05.70.Jk, 61.25.Mv, 64.70.Fx

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