[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 …
range Mie potentials [Lafitte et al, J. Chem. Phys. 139, 154504 (2013)] is formulated within …
Prediction of thermodynamic properties and phase behavior of fluids and mixtures with the SAFT-γ Mie group-contribution equation of state
Group contribution (GC) approaches are based on the premise that the properties of a
molecule or a mixture can be determined from the appropriate contributions of the functional …
molecule or a mixture can be determined from the appropriate contributions of the functional …
[HTML][HTML] Accurate statistical associating fluid theory for chain molecules formed from Mie segments
T Lafitte, A Apostolakou, C Avendaño… - The Journal of …, 2013 - pubs.aip.org
A highly accurate equation of state (EOS) for chain molecules formed from spherical
segments interacting through Mie potentials (ie, a generalized Lennard-Jones form with …
segments interacting through Mie potentials (ie, a generalized Lennard-Jones form with …
Developing a predictive group-contribution-based SAFT-VR equation of state
Y Peng, KD Goff, MC dos Ramos, C McCabe - Fluid Phase Equilibria, 2009 - Elsevier
The hetero-segmented version of the statistical associating fluid theory for potentials of
variable range (hetero-SAFT-VR) is used to develop a predictive molecular-based group …
variable range (hetero-SAFT-VR) is used to develop a predictive molecular-based group …
A generalisation of the SAFT-γ group contribution method for groups comprising multiple spherical segments
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-γ) has recently been proposed [A. Lymperiadis, CS Adjiman, A. Galindo, G. Jackson …
The A in SAFT: developing the contribution of association to the Helmholtz free energy within a Wertheim TPT1 treatment of generic Mie fluids
An accurate representation of molecular association is a vital ingredient of advanced
equations of state (EOSs), providing a description of thermodynamic properties of complex …
equations of state (EOSs), providing a description of thermodynamic properties of complex …
Developing intermolecular‐potential models for use with the SAFT‐VR M ie equation of state
A major advance in the statistical associating fluid theory (SAFT) for potentials of variable
range (SAFT‐VR) has recently been made with the incorporation of the Mie (generalized …
range (SAFT‐VR) has recently been made with the incorporation of the Mie (generalized …
Expanding the applications of the SAFT-γ Mie group-contribution equation of state: Prediction of thermodynamic properties and phase behavior of mixtures
AJ Haslam, A González-Pérez, S Di Lecce… - Journal of Chemical & …, 2020 - ACS Publications
We present the latest developments in thermodynamic modeling using the SAFT-γ Mie
group-contribution equation of state. The group database is updated, featuring now 58 …
group-contribution equation of state. The group database is updated, featuring now 58 …
[HTML][HTML] Application of the SAFT-γ Mie group contribution equation of state to fluids of relevance to the oil and gas industry
V Papaioannou, F Calado, T Lafitte, S Dufal… - Fluid Phase …, 2016 - Elsevier
The application of the SAFT-γ Mie group contribution approach [Papaioannou et al., J.
Chem. Phys., 140 (2014) 054107] to the study of a range of systems of relevance to the oil …
Chem. Phys., 140 (2014) 054107] to the study of a range of systems of relevance to the oil …
Simultaneous estimation of phase behavior and second-derivative properties using the statistical associating fluid theory with variable range approach
T Lafitte, D Bessieres, MM Piñeiro… - The Journal of chemical …, 2006 - pubs.aip.org
A modified statistical associating fluid theory (SAFT) with variable range version is presented
using the family of mn Mie potentials. The use of this intermolecular potential for modeling …
using the family of mn Mie potentials. The use of this intermolecular potential for modeling …
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