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An entropy scaling demarcation of gas- and liquid-like fluid behaviors.
- Source :
-
The Journal of chemical physics [J Chem Phys] 2020 May 21; Vol. 152 (19), pp. 191102. - Publication Year :
- 2020
-
Abstract
- In this work, we propose a generic and simple definition of a line separating gas-like and liquid-like fluid behaviors from the standpoint of shear viscosity. This definition is valid even for fluids such as the hard sphere and the inverse power law that exhibit a unique fluid phase. We argue that this line is defined by the location of the minimum of the macroscopically scaled viscosity when plotted as a function of the excess entropy, which differs from the popular Widom lines. For hard sphere, Lennard-Jones, and inverse-power-law fluids, such a line is located at an excess entropy approximately equal to -2/3 times Boltzmann's constant and corresponds to points in the thermodynamic phase diagram for which the kinetic contribution to viscosity is approximately half of the total viscosity. For flexible Lennard-Jones chains, the excess entropy at the minimum is a linear function of the chain length. This definition opens a straightforward route to classify the dynamical behavior of fluids from a single thermodynamic quantity obtainable from high-accuracy thermodynamic models.
Details
- Language :
- English
- ISSN :
- 1089-7690
- Volume :
- 152
- Issue :
- 19
- Database :
- MEDLINE
- Journal :
- The Journal of chemical physics
- Publication Type :
- Academic Journal
- Accession number :
- 33687260
- Full Text :
- https://doi.org/10.1063/1.5143854