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Excess-entropy-based anomalies for a waterlike fluid

  • University of Texas at Austin

Research output: Contribution to journalArticlepeer-review

154 Scopus citations

Abstract

Many thermodynamic and dynamic properties of water display unusual behavior at low enough temperatures. In a recent study, Yan [Phys. Rev. Lett. 95, 130604 (2005)] identified a spherically symmetric two-scale potential that displays many of the same anomalous properties as water. More specifically, for select parametrizations of the potential, one finds that the regions where isothermal compression anomalously (i) decreases the fluid's structural order, (ii) increases its translational self-diffusivity, and (iii) increases its entropy form nested domes in the temperature-density plane. These property relationships are similar to those found for more realistic models of water. In this work, the authors provide evidence that suggests that the anomalous regions specified above can all be linked through knowledge of the excess entropy. Specifically, the authors show how entropy scaling relationships developed by Rosenfeld [Phys. Rev. A 15, 2545 (1977)] can be used to describe the region of diffusivity anomalies and to predict the state conditions for which anomalous viscosity and thermal conductivity behavior might be found.

Original languageEnglish
Article number244502
JournalJournal of Chemical Physics
Volume125
Issue number24
DOIs
StatePublished - 2006

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