Connecting entropy scaling and density scaling

Author:

Bell Ian H.1ORCID,Fingerhut Robin2,Vrabec Jadran2ORCID,Costigliola Lorenzo3ORCID

Affiliation:

1. Applied Chemicals and Materials Division, National Institute of Standards and Technology, Boulder, Colorado 80305, USA

2. Thermodynamics and Process Engineering, Technische Universität Berlin, Ernst-Reuter-Platz 1, 10587 Berlin, Germany

3. Department of Science and Environment, Roskilde University, P.O. BOX 260, DK-4000 Roskilde, Denmark

Abstract

It is shown that the residual entropy (entropy minus that of the ideal gas at the same temperature and density) is mostly synonymous with the independent variable of density scaling, identifying a direct link between these two approaches. The residual entropy and the effective hardness of interaction (itself a derivative at constant residual entropy) are studied for the Lennard-Jones monomer and dimer as well as a range of rigid molecular models for carbon dioxide. It is observed that the density scaling exponent appears to be related to the two-body interactions in the dilute-gas limit.

Funder

Villum Fonden

Deutsche Forschungsgemeinschaft

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Cited by 2 articles. 订阅此论文施引文献 订阅此论文施引文献,注册后可以免费订阅5篇论文的施引文献,订阅后可以查看论文全部施引文献

1. Invariant dynamics in a united-atom model of an ionic liquid;The Journal of Chemical Physics;2024-01-17

2. Fundamental Equation of State for Fluid Tetrahydrofuran;International Journal of Thermophysics;2023-10

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