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Naji, M. |
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Motta, Antonella |
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Aletan, Dirar |
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Mohamed, Tarek |
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Ertürk, Emre |
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Taccardi, Nicola |
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Kononenko, Denys |
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Petrov, R. H. | Madrid |
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Alshaaer, Mazen | Brussels |
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Bih, L. |
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Casati, R. |
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Muller, Hermance |
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Kočí, Jan | Prague |
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Šuljagić, Marija |
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Kalteremidou, Kalliopi-Artemi | Brussels |
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Azam, Siraj |
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Ospanova, Alyiya |
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Blanpain, Bart |
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Ali, M. A. |
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Popa, V. |
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Rančić, M. |
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Ollier, Nadège |
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Azevedo, Nuno Monteiro |
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Landes, Michael |
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Rignanese, Gian-Marco |
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Kontogeorgis, Georgios M.
in Cooperation with on an Cooperation-Score of 37%
Topics
Publications (18/18 displayed)
- 2024Composition-dependence of relative static permittivity in ePPC-SAFT for mixed-solvent alkali halidescitations
- 2024Investigation of the Alcohols and Water Hydrogen Bonding Structure via Monomer Fraction Studiescitations
- 2024The Connection between the Debye and Güntelberg Charging Processes and the Importance of Relative Permittivity: The Ionic Cloud Charging Processcitations
- 2023On the estimation of equivalent conductivity of electrolyte solutions; The effect of relative static permittivity and viscositycitations
- 2023Comparisons of equation of state models for electrolytes: e-CPA and e-PPC-SAFTcitations
- 2023Comparison of models for the relative static permittivity with the e-CPA equation of statecitations
- 2023How to account for the concentration dependency of relative permittivity in the Debye–Hückel and Born equationscitations
- 2023Extension of the eSAFT-VR Mie Equation of State from aqueous to non-aqueous electrolyte solutionscitations
- 2022Importance of the Relative Static Permittivity in electrolyte SAFT-VR Mie Equations of Statecitations
- 2022The true Hückel equation for electrolyte solutions and its relation with the Born termcitations
- 2022Self-stratification studies in waterborne epoxy-silicone systemscitations
- 2022Self-stratification studies in waterborne epoxy-silicone systemscitations
- 2018A Multi-stage and Multi-level Computer Aided Framework for Sustainable Process Intensificationcitations
- 2013Modeling of Dielectric Properties of Aqueous Salt Solutions with an Equation of Statecitations
- 2013Modeling of dielectric properties of complex fluids with an equation of statecitations
- 2012Comparison of the Debye–Hückel and the Mean Spherical Approximation Theories for Electrolyte Solutionscitations
- 2007Adhesion between coating layers based on epoxy and siliconecitations
- 2004Chemical Product Design: A new challenge of applied thermodynamicscitations
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article
Modeling of dielectric properties of complex fluids with an equation of state
Abstract
The static permittivity is a key property for describing solutions containing polar and hydrogen bonding compounds. However, the precise relationship between the molecular and dielectric properties is not well-established. Here we show that the relative permittivity at zero frequency (static permittivity) can be modeled simultaneously with thermodynamic properties. The static permittivity is calculated from an extension of the framework developed by Onsager, Kirkwood, and Fröhlich to associating mixtures. The thermodynamic properties are calculated from the cubic-plus-association (CPA) equation of state that includes the Wertheim association model as formulated in the statistical associating fluid theory (SAFT) to account for hydrogen bonding molecules. We show that, by using a simple description of the geometry of the association, we may calculate the Kirkwood g-factor as a function of the probability of hydrogen bond formation. The results show that it is possible to predict the static permittivity of complex mixtures over wide temperature and pressure ranges from simple extensions of well-established theories simultaneously with the calculation of thermodynamic properties. © 2013 American Chemical Society.