Prediction of Adsorption Isotherms and Selectivities: Comparison between Classical Density Functional Theory Based on the Perturbed-Chain Statistical Associating Fluid Theory Equation of State and Ideal Adsorbed Solution Theory-Reference-Cited by-同舟云学术

Prediction of Adsorption Isotherms and Selectivities: Comparison between Classical Density Functional Theory Based on the Perturbed-Chain Statistical Associating Fluid Theory Equation of State and Ideal Adsorbed Solution Theory

Published:2019-08-12 Issue:36 Volume:35 Page:11690-11701
ISSN:0743-7463
Container-title:Langmuir
language:en
Short-container-title:Langmuir

Author:

Sauer Elmar¹,Gross Joachim¹^ORCID

Affiliation:

1. Institute of Thermodynamics and Thermal Process Engineering, University of Stuttgart, Pfaffenwaldring 9, 70569 Stuttgart, Germany

Funder

Deutsche Forschungsgemeinschaft

Publisher

American Chemical Society (ACS)

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.langmuir.9b02378

Reference113 articles.

1. The role of molecular modeling in confined systems: impact and prospects

2. Density functional theory for chemical engineering: From capillarity to soft materials

3. Recent advances in classical density functional theory for associating and polyatomic molecules

4. New developments in classical density functional theory

5. The nature of the liquid-vapour interface and other topics in the statistical mechanics of non-uniform, classical fluids

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