Your browser doesn't support javascript.
loading
Connecting entropy scaling and density scaling.
Bell, Ian H; Fingerhut, Robin; Vrabec, Jadran; Costigliola, Lorenzo.
  • Bell IH; Applied Chemicals and Materials Division, National Institute of Standards and Technology, Boulder, Colorado 80305, USA.
  • Fingerhut R; Thermodynamics and Process Engineering, Technische Universität Berlin, Ernst-Reuter-Platz 1, 10587 Berlin, Germany.
  • Vrabec J; Thermodynamics and Process Engineering, Technische Universität Berlin, Ernst-Reuter-Platz 1, 10587 Berlin, Germany.
  • Costigliola L; Department of Science and Environment, Roskilde University, P.O. BOX 260, DK-4000 Roskilde, Denmark.
J Chem Phys ; 157(7): 074501, 2022 Aug 21.
Article en En | MEDLINE | ID: mdl-35987579
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.

Texto completo: 1 Banco de datos: MEDLINE Tipo de estudio: Prognostic_studies Idioma: En Año: 2022 Tipo del documento: Article

Texto completo: 1 Banco de datos: MEDLINE Tipo de estudio: Prognostic_studies Idioma: En Año: 2022 Tipo del documento: Article