Correlating multicomponent physical property data with Padé approximants : Part II. Projecting pure component behaviour

dc.contributor.authorPretorius, Franco
dc.contributor.authorDzingai, Pethile
dc.contributor.authorDu Toit, Elizabeth Louisa
dc.contributor.authorFocke, Walter Wilhelm
dc.contributor.emailwalter.focke@up.ac.zaen_US
dc.date.accessioned2024-02-12T08:02:50Z
dc.date.available2024-02-12T08:02:50Z
dc.date.issued2024-03
dc.descriptionDATA AVAILABILITY : Data will be made available on request.en_US
dc.description.abstractPhysical property data obtained for binary mixtures are conventionally fitted in excess form using the Redlich-Kister equation. The ternary data is then estimated using projections of the binary behaviour on the basis of geometric arguments. It is shown that a more consistent approach entails projection of pure component behaviour onto the simplex region. This generates Padé-type expressions capable of presenting multicomponent data in terms of the pure component temperature dependence using temperature-independent binary parameters. The effectiveness of this concept, for correlating density, viscosity, refractive index and surface tension, was confirmed using ten ternary systems for which data at either three or four different temperatures were available.en_US
dc.description.departmentChemical Engineeringen_US
dc.description.librarianhj2024en_US
dc.description.sdgNoneen_US
dc.description.sponsorshipA scholarship grant from the German Academic Exchange Service (DAAD).en_US
dc.description.urihttp://www.elsevier.com/locate/molliqen_US
dc.identifier.citationPretorius, F., Dzingai, P., Du Toit, E.L. & Focke, W.W. 2024, 'Correlating multicomponent physical property data with Padé approximants: Part II. Projecting pure component behaviour', Journal of Molecular Liquids, vol. 397, art. 124205, pp. 1-14, doi : 10.1016/j.molliq.2024.124205.en_US
dc.identifier.issn0167-7322 (print)
dc.identifier.issn1873-3166 (online)
dc.identifier.issn10.1016/j.molliq.2024.124205
dc.identifier.urihttp://hdl.handle.net/2263/94453
dc.language.isoenen_US
dc.publisherElsevieren_US
dc.rights© 2023 The Authors. Published by Elsevier B.V. This is an open access article under the CC BY-NC-ND license.en_US
dc.subjectLiquiden_US
dc.subjectTernary mixtureen_US
dc.subjectPadé approximanten_US
dc.subjectMixture modelsen_US
dc.subjectSurface tensionen_US
dc.subjectRefractive indexen_US
dc.subjectViscosityen_US
dc.subjectDensityen_US
dc.titleCorrelating multicomponent physical property data with Padé approximants : Part II. Projecting pure component behaviouren_US
dc.typeArticleen_US

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