Group-contribution SAFT equations of state: A review

F Shaahmadi, SAM Smith, CE Schwarz, AJ Burger… - Fluid Phase …, 2023 - Elsevier
We present a review and thorough assessment of recent advances and applications of
group-contribution methods (GCMs) implemented in the Statistical Associating Fluid Theory …

[HTML][HTML] Group contribution methodology based on the statistical associating fluid theory for heteronuclear molecules formed from Mie segments

V Papaioannou, T Lafitte, C Avendaño… - The Journal of …, 2014 - pubs.aip.org
A generalization of the recent version of the statistical associating fluid theory for variable
range Mie potentials [Lafitte et al, J. Chem. Phys. 139, 154504 (2013)] is formulated within …

Towards a predictive thermodynamic description of sorption processes in polymers: The synergy between theoretical EoS models and vibrational spectroscopy

G Mensitieri, G Scherillo, C Panayiotou… - Materials Science and …, 2020 - Elsevier
Understanding and predicting sorption thermodynamics of low molecular weight compounds
in rubbery and glassy polymers is of great relevance to elucidate important phenomena in …

Recent advances and applications of statistical associating fluid theory

SP Tan, H Adidharma, M Radosz - Industrial & Engineering …, 2008 - ACS Publications
This review presents recent advances and applications of statistical associating fluid theory
(SAFT), which has been extended in the past few years, conceptually and practically, to …

A predictive group-contribution simplified PC-SAFT equation of state: application to polymer systems

A Tihic, GM Kontogeorgis, N Von Solms… - Industrial & …, 2008 - ACS Publications
A group-contribution (GC) method is coupled with the molecular-based perturbed-chain
statistical associating fluid theory (PC-SAFT) equation of state (EoS) to predict its …

Purely predicting the pharmaceutical solubility: what to expect from PC-SAFT and COSMO-RS?

M Klajmon - Molecular Pharmaceutics, 2022 - ACS Publications
A pair of popular thermodynamic models for pharmaceutical applications, namely, the
perturbed-chain statistical associating fluid theory (PC-SAFT) equation of state and the …

A generalisation of the SAFT-γ group contribution method for groups comprising multiple spherical segments

A Lymperiadis, CS Adjiman, G Jackson, A Galindo - Fluid Phase Equilibria, 2008 - Elsevier
A new group contribution (GC) approach based on the statistical associating fluid theory
(SAFT-γ) has recently been proposed [A. Lymperiadis, CS Adjiman, A. Galindo, G. Jackson …

SAFT associating fluids and fluid mixtures

C McCabe, A Galindo - 2010 - books.rsc.org
While we could argue that the goals of modelling fluid phase equilibria have not changed
greatly since the time of van der Waals, there is little doubt that the systems of interest have …

Application of GC-SAFT EOS to polar systems using a segment approach

D NguyenHuynh, JP Passarello, P Tobaly… - Fluid Phase …, 2008 - Elsevier
The GC-SAFT equation of state proposed by Tamouza et al.(Fluid Phase Equilib. 222–223
(2004) 67) is here extended to model phase equilibria of polar fluid (dipolar and …

Estimation of pure component parameters of PC-SAFT EoS by an artificial neural network based on a group contribution method

H Matsukawa, M Kitahara, K Otake - Fluid Phase Equilibria, 2021 - Elsevier
In this study, we introduced an artificial neural network (ANN), which can represent objects
that are difficult to formulate, rather than the integrated model of the group contribution …