Polar soft-SAFT: theory and comparison with molecular simulations and experimental data of pure polar fluids
Author:
Affiliation:
1. Chemical Engineering Department
2. Khalifa University of Science and Technology
3. Abu Dhabi
4. United Arab Emirates
5. Research and Innovation Center on CO2 and H2 (RICH)
6. Alya Technology & Innovation SL
7. 08202 Sabadell
8. Spain
Abstract
The consideration of polar interactions is of vital importance for the development of predictive and accurate thermodynamic models for polar fluids, as they govern most of their thermodynamic properties, making them highly non-ideal fluids.
Funder
Khalifa University of Science, Technology and Research
Publisher
Royal Society of Chemistry (RSC)
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://pubs.rsc.org/en/content/articlepdf/2020/CP/D0CP00846J
Reference101 articles.
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2. Modeling of Polar Systems with the Perturbed-Chain SAFT Equation of State. Investigation of the Performance of Two Polar Terms
3. A Comparative Study of the Perturbed-Chain Statistical Associating Fluid Theory Equation of State and Activity Coefficient Models in Phase Equilibria Calculations for Mixtures Containing Associating and Polar Components
4. Association theories for complex thermodynamics
5. Recent Advances and Applications of Statistical Associating Fluid Theory
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