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The Journal of Chemical Thermodynamics
Article . 2012 . Peer-reviewed
License: Elsevier TDM
Data sources: Crossref
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Application of the mass-based UNIQUAC model to membrane systems: A critical revision

Authors: Chovau, Simon; Van der Bruggen, Bart; Luis, Patricia;

Application of the mass-based UNIQUAC model to membrane systems: A critical revision

Abstract

The UNIQUAC model is very suitable in describing (liquid + liquid) as well as (vapor + liquid) equilibrium for a wide range of systems. It can be extended to (solvent + polymer) systems for describing sorption equilibria. The original model is expressed in molar-based terms, but requires knowledge of structural parameters and molar masses of all components. Since these cannot always be easily determined for membranes, a conversion to mass-based terms is often performed, which eliminates this issue. Many studies use this model to calculate sorption equilibria in (solvent + polymer) systems. Nevertheless, in this work the conversion from molar to mass-based parameters is postulated to be erroneous. This even leads to an incorrect description of simple (vapor + liquid) equilibrium of pure liquid mixtures and hence it is advised not to use this model for further modeling of sorption equilibrium in (solvent + polymer) systems. In this paper, the errors in the conversion are pinpointed, and the effects it can have on the description of (vapor + liquid) equilibrium, if used improvident, are demonstrated. Furthermore, it is shown that in fact a simple and straightforward conversion can be performed. Finally, in the case when polymers are involved, an adaption and simplification to the model was successfully applied.

Country
Belgium
Related Organizations
Keywords

3402 Inorganic chemistry, SORPTION, TOLUENE, 0915 Interdisciplinary Engineering, 4004 Chemical engineering, (Vapor plus liquid) equilibrium, 0307 Theoretical and Computational Chemistry, 0306 Physical Chemistry (incl. Structural), 3406 Physical chemistry, Science & Technology, Chemistry, Physical, Sorption equilibrium, Membrane, MIXTURES, Mass-based UNIQUAC, PERFORMANCE, Chemical Engineering, Chemistry, PERVAPORATION, Physical Sciences, Mass-based UNIQUAC; (Vapor + liquid) equilibrium; Sorption equilibrium; Membrane, Thermodynamics, SOLUTION-DIFFUSION-MODEL, POLYMER-SOLUTIONS

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selected citations
These citations are derived from selected sources.
This is an alternative to the "Influence" indicator, which also reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Citations provided by BIP!
popularity
This indicator reflects the "current" impact/attention (the "hype") of an article in the research community at large, based on the underlying citation network.
BIP!Popularity provided by BIP!
influence
This indicator reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Influence provided by BIP!
impulse
This indicator reflects the initial momentum of an article directly after its publication, based on the underlying citation network.
BIP!Impulse provided by BIP!
9
Average
Average
Average
Green
bronze