화학공학소재연구정보센터
Fluid Phase Equilibria, Vol.306, No.1, 112-123, 2011
GCA-EoS: A SAFT group contribution model-Extension to mixtures containing aromatic hydrocarbons and associating compounds
GCA-EoS is the first equation of state that takes into account association using a SAFT-like group contribution term. It has been recently upgraded to deal simultaneously with multiple associating and solvating groups. In this work a review of applications and parameters revisions are presented and the GCA-EoS extension to aromatic hydrocarbons is discussed. These compounds are important in different industrial fields (textile, fine chemicals, pharmaceutical, petrochemicals, materials, etc.). Moreover, compounds like phenol play a major role not only in several polymers syntheses but also in biomass processing mixtures. Specifically, the extension to systems containing aromatic hydrocarbons (BETX and alkylbenzenes), water and alkanols is discussed. (C) 2011 Elsevier B.V. All rights reserved.