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

Speed of Sound, Density, and Derivative Properties of Ethyl Myristate, Methyl Myristate, and Methyl Palmitate under High Pressure

(2013) El Hadji I. Ndiaye et al.   JOURNAL OF CHEMICAL AND ENGINEERING DATA

Accurate statistical associating fluid theory for chain molecules formed from Mie segments

(2013) Thomas Lafitte et al.   JOURNAL OF CHEMICAL PHYSICS

Long chain multifunctional molecules with GC-PPC-SAFT: Limits of data and model

(2012) Justyna Rozmus et al.   FLUID PHASE EQUILIBRIA

Application of the statistical associating fluid theory for potentials of variable range (SAFT-VR) coupled with renormalisation-group (RG) theory to model the phase equilibria and second-derivative properties of pure fluids

(2012) Esther Forte et al.   FLUID PHASE EQUILIBRIA

Evaluation of the PC-SAFT, SAFT and CPA equations of state in predicting derivative properties of selected non-polar and hydrogen-bonding compounds

(2012) A.J. de Villiers et al.   FLUID PHASE EQUILIBRIA

Approach to Improve Speed of Sound Calculation within PC-SAFT Framework

(2012) Xiaodong Liang et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

Heterosegmented Perturbed-Chain Statistical Associating Fluid Theory as a Robust and Accurate Tool for Modeling of Various Alkanes. 1. Pure Fluids

(2012) Kamil Paduszyński et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

Speed of Sound, Density, and Derivative Properties of Fatty Acid Methyl and Ethyl Esters under High Pressure: Methyl Caprate and Ethyl Caprate

(2012) El Hadji Ibrahima Ndiaye et al.   JOURNAL OF CHEMICAL AND ENGINEERING DATA

Modeling gas solubility in ionic liquids with the SAFT-γ group contribution method

(2012) Seyedeh-Soghra Ashrafmansouri et al.   JOURNAL OF SUPERCRITICAL FLUIDS

Comparative study of eight cubic equations of state for predicting thermodynamic properties of alkanes

(2011) Moosa Rabiei Faradonbeh et al.   CANADIAN JOURNAL OF CHEMICAL ENGINEERING

Evaluation of Statistical Associating Fluid Theory (SAFT) and Perturbed Chain-SAFT Equations of State for the Calculation of Thermodynamic Derivative Properties of Fluids Related to Carbon Capture and Sequestration

(2011) Nikolaos I. Diamantonis et al.   ENERGY & FUELS

Application of GC-PPC-SAFT EoS to amine mixtures with a predictive approach

(2011) J. Rozmus et al.   FLUID PHASE EQUILIBRIA

Simultaneous prediction of vapour–liquid and liquid–liquid equilibria (VLE and LLE) of aqueous mixtures with the SAFT-γ group contribution approach

(2011) Vasileios Papaioannou et al.   FLUID PHASE EQUILIBRIA

Modeling Liquid–Liquid and Liquid–Vapor Equilibria of Binary Systems Containing Water with an Alkane, an Aromatic Hydrocarbon, an Alcohol or a Gas (Methane, Ethane, CO2or H2S), Using Group Contribution Polar Perturbed-Chain Statistical Associating Fluid Theory

(2011) Dong Nguyen-Huynh et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

Hybridizing SAFT and Cubic EOS: What Can Be Achieved?

(2011) Ilya Polishuk   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

Application of a renormalization-group treatment to the statistical associating fluid theory for potentials of variable range (SAFT-VR)

(2011) Esther Forte et al.   JOURNAL OF CHEMICAL PHYSICS

Integrated solvent and process design using a SAFT-VR thermodynamic description: High-pressure separation of carbon dioxide and methane

(2010) F.E. Pereira et al.   COMPUTERS & CHEMICAL ENGINEERING

A duality-based optimisation approach for the reliable solution of (P, T) phase equilibrium in volume-composition space

(2010) Frances E. Pereira et al.   FLUID PHASE EQUILIBRIA

Modelling LLE and VLE of methanol+n-alkane series using GC-PC-SAFT with a group contribution kij

(2010) M. Mourah et al.   FLUID PHASE EQUILIBRIA

Second-order thermodynamic derivative properties of binary mixtures of n-alkanes through the SAFT-CP equation of state

(2010) Ali Maghari et al.   FLUID PHASE EQUILIBRIA

Continuous-Molecular Targeting for Integrated Solvent and Process Design

(2010) André Bardow et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

Group-Contribution Method for the Molecular Parameters of the PC-SAFT Equation of State Taking into Account the Proximity Effect. Application to Nonassociated Compounds

(2010) Javier Vijande et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

Densities and Viscosities of Fatty Acid Methyl and Ethyl Esters

(2010) Maria Jorge Pratas et al.   JOURNAL OF CHEMICAL AND ENGINEERING DATA

Measurements of the Excess Properties and Vapor−Liquid Equilibria at 101.32 kPa for Mixtures of Ethyl Ethanoate + Alkanes (from C5to C10)†

(2010) Luís Fernández et al.   JOURNAL OF CHEMICAL AND ENGINEERING DATA

Phase equilibria, surface tensions and heat capacities of hydrofluorocarbons and their mixtures including the critical region

(2010) O. Vilaseca et al.   JOURNAL OF SUPERCRITICAL FLUIDS

Thermodynamic characterization of pure perfluoroalkanes, including interfacial and second order derivative properties, using the crossover soft-SAFT EoS

(2009) A.M.A. Dias et al.   FLUID PHASE EQUILIBRIA

Analysis and applications of a group contribution sPC-SAFT equation of state

(2009) Amra Tihic et al.   FLUID PHASE EQUILIBRIA

Mie Potentials for Phase Equilibria Calculations: Application to Alkanes and Perfluoroalkanes

(2009) Jeffrey J. Potoff et al.   JOURNAL OF PHYSICAL CHEMISTRY B

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

(2008) Alexandros Lymperiadis et al.   FLUID PHASE EQUILIBRIA

Prediction of binary intermolecular potential parameters for use in modelling fluid mixtures

(2008) Andrew J. Haslam et al.   FLUID PHASE EQUILIBRIA

Developing a predictive group-contribution-based SAFT-VR equation of state

(2008) Yun Peng et al.   FLUID PHASE EQUILIBRIA

Joule−Thomson Inversion Curves and Third Virial Coefficients for Pure Fluids from Molecular-Based Models

(2008) F. Castro-Marcano et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

Modeling Phase Equilibria of Asymmetric Mixtures Using a Group-Contribution SAFT (GC-SAFT) with akijCorrelation Method Based on Londonʼs Theory. 2. Application to Binary Mixtures Containing Aromatic Hydrocarbons,n-Alkanes, CO2, N2, and H2S

(2008) Dong Nguyen-Huynh et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

Modeling Phase Equilibria of Asymmetric Mixtures Using a Group-Contribution SAFT (GC-SAFT) with akijCorrelation Method Based on London’s Theory. 1. Application to CO2+n-Alkane, Methane +n-Alkane, and Ethane +n-Alkane Systems

(2008) Dong Nguyen-Huynh et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

Recent Advances and Applications of Statistical Associating Fluid Theory

(2008) Sugata P. Tan et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

Estimation of 2nd-order derivative thermodynamic properties using the crossover lattice equation of state

(2008) Yongjin Lee et al.   JOURNAL OF CHEMICAL THERMODYNAMICS

A Predictive Group-Contribution Simplified PC-SAFT Equation of State: Application to Polymer Systems

(2007) Amra Tihic et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

Phase Equilibrium for the Esterification Reaction of Acetic Acid + Butan-1-ol at 101.3 kPa

(2007) Estela Lladosa et al.   JOURNAL OF CHEMICAL AND ENGINEERING DATA

Estimation of second-order derivative thermodynamic properties using the crossover cubic equation of state

(2007) Moon Sam Shin et al.   JOURNAL OF CHEMICAL THERMODYNAMICS