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Connecting entropy scaling and density scaling.

Authors :
Bell, Ian H.
Fingerhut, Robin
Vrabec, Jadran
Costigliola, Lorenzo
Source :
Journal of Chemical Physics. 8/21/2022, Vol. 157 Issue 7, p1-11. 11p.
Publication Year :
2022

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. [ABSTRACT FROM AUTHOR]

Details

Language :
English
ISSN :
00219606
Volume :
157
Issue :
7
Database :
Academic Search Index
Journal :
Journal of Chemical Physics
Publication Type :
Academic Journal
Accession number :
158625182
Full Text :
https://doi.org/10.1063/5.0097088