A group contribution method for associating chain molecules based on the statistical associating fluid theory (SAFT-γ)
A Lymperiadis, CS Adjiman, A Galindo… - The Journal of chemical …, 2007 - pubs.aip.org
Alexandros Lymperiadis, Claire S. Adjiman, Amparo Galindo, George Jackson; A group
contribution method for associating chain molecules based on the statistical associating fluid …
contribution method for associating chain molecules based on the statistical associating fluid …
The thermodynamics of mixtures and the corresponding mixing rules in the SAFT-VR approach for potentials of variable range
AGLAD Alejandro, GILVG JACKSON - Molecular Physics, 1998 - Taylor & Francis
The statistical associating fluid theory (SAFT) has been extended recently to describe the
thermodynamic properties of chain molecules formed from monomeric segments interacting …
thermodynamic properties of chain molecules formed from monomeric segments interacting …
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 …
Statistical associating fluid theory for chain molecules with attractive potentials of variable range
A Gil-Villegas, A Galindo, PJ Whitehead… - The Journal of …, 1997 - pubs.aip.org
A version of the statistical associating fluid theory (SAFT) is developed for chain molecules
of hard-core segments with attractive potentials of variable range (SAFT-VR). The different …
of hard-core segments with attractive potentials of variable range (SAFT-VR). The different …
An accurate density functional theory for the vapor-liquid interface of associating chain molecules based on the statistical associating fluid theory for potentials of …
A Helmholtz free energy density functional is developed to describe the vapor-liquid
interface of associating chain molecules. The functional is based on the statistical …
interface of associating chain molecules. The functional is based on the statistical …
Perturbed chain-statistical associating fluid theory extended to dipolar and quadrupolar molecular fluids
EK Karakatsani, IG Economou - The Journal of Physical Chemistry …, 2006 - ACS Publications
The perturbed chain statistical associating fluid theory (PC-SAFT) is extended to polar
molecular fluids, namely dipolar and quadrupolar fluids. The extension is based on the …
molecular fluids, namely dipolar and quadrupolar fluids. The extension is based on the …
Developing optimal Wertheim-like models of water for use in Statistical Associating Fluid Theory (SAFT) and related approaches
The statistical associating fluid theory (SAFT) is now well established as an approach for the
description of the thermodynamics and phase equilibria of a wide variety of fluid systems …
description of the thermodynamics and phase equilibria of a wide variety of fluid systems …
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 …
Molecular-based equations of state for associating fluids: A review of SAFT and related approaches
EA Müller, KE Gubbins - Industrial & engineering chemistry …, 2001 - ACS Publications
We present a review of recent advances in the statistical associating fluid theory (SAFT). In
contrast to the “chemical theory”, in which nonideality is explained in terms of chemical …
contrast to the “chemical theory”, in which nonideality is explained in terms of chemical …
[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 …
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