Les débouchés non alimentaires des produits agricoles : un enjeu pour la France et l'Union Européenne, 2004. ,
Chemicals from Biomass, Science, vol.318, pp.1250-1251, 2007. ,
Chapter 3: Process options for the catalytic conversion of renewables into bioproducts, Catalysis of renewables, 2007. ,
Overview of fuel properties of biomass fast pyrolysis oils, Energy Convers. Manag, vol.50, pp.1376-1383, 2009. ,
Solvent Fractionation Method with Brix for Rapid Characterization of Wood Fast Pyrolysis Liquids, Energy Fuels, vol.22, pp.4245-4248, 2008. ,
Ni-based sol-gel catalysts as promising systems for crude bio-oil upgrading: Guaiacol hydrodeoxygenation study, Appl. Catal B-Environ, pp.296-307, 2012. ,
Vapor-liquid equilibria for binary mixtures of carbon dioxide with 1,2-dimethoxybenzene, 2-methoxyphenol, or p-cresol at elevated pressures, Fluid Phase Equilib, vol.162, pp.211-224, 1999. ,
Isothermal vapor-liquid equilibria for mixtures composed of 1,2-dimethoxybenzene, 2-methoxyphenol, and diphenylmethane, Fluid Phase Equilib, vol.178, pp.209-223, 2001. ,
Extension of the group contribution associating equation of state to mixtures containing phenol, aromatic acid and aromatic ether compounds, Fluid Phase Equilib, vol.231, pp.197-210, 2005. ,
Advances in Thermodynamics for Chemical Process and Product Design, Chem. Eng. Res. Des, vol.92, pp.2912-2935, 2014. ,
Phase Equilibria of systems containing aromatic oxygenated compounds with CH 4, Fluid Phase Equilib, vol.382, pp.219-234, 2014. ,
URL : https://hal.archives-ouvertes.fr/hal-01105242
Group contribution method with SAFT EOS applied to vapor liquid equilibria of various hydrocarbon series, Fluid Phase Equilib, pp.67-76, 2004. ,
Application of GC-SAFT EOS to polar systems using a segment approach, Fluid Phase Equilib, vol.264, pp.62-75, 2008. ,
Application of GC-SAFT EOS to polycyclic aromatic hydrocarbons, Fluid Phase Equilib, vol.254, pp.60-66, 2007. ,
Modeling Phase Equilibria of Asymmetric Mixtures Using a Group-Contribution SAFT (GC-SAFT) with a k(ij) Correlation Method Based on London's Theory. 1 ,
Industrial & Engineering Chemistry Research, vol.47, pp.8847-8858, 2008. ,
,
, Predicting VLE of heavy esters and their mixtures using GC-SAFT, Fluid Phase Equilib, vol.264, 0200.
Modeling Phase Equilibria of Asymmetric Mixtures Using a GroupContribution SAFT (GC-SAFT) with a k(ij) Correlation Method Based on London's Theory. 2. Application to Binary Mixtures Containing Aromatic Hydrocarbons, nAlkanes, Ind. Eng. Chem. Res, vol.47, pp.8859-8868, 2008. ,
Modeling VLE of H 2 + Hydrocarbon Mixtures Using a Group Contribution SAFT with a k(ij) Correlation Method Based on London's Theory. Energ Fuels, vol.23, pp.2658-2665, 2009. ,
Application of perturbation theory to a hard-chain reference fluid: an equation of state for square well chains, Fluid Phase Equilib, vol.168, pp.183-199, 2000. ,
Perturbed-Chain SAFT: An equation of state based on a perturbation theory for chain molecules, Ind. Eng. Chem. Res, vol.40, pp.1244-1260, 2001. ,
Application of the Perturbed-Chain SAFT Equation of State to Associating Systems, Ind. Eng. Chem. Res, vol.41, pp.5510-5515, 2002. ,
, Thermodynamics of Polyatomic Fluid Mixtures-1
, Theory. Chem. Eng. Sci, vol.33, pp.863-878, 1978.
Application of Wertheim's thermodynamic Perturbation theory to dipolar hard sphere chains, Mol. Phys, vol.97, pp.307-319, 1999. ,
Application of Dipolar Chain Theory to the Phase Behavior of Polar Fluids and Mixtures, Ind. Eng. Chem. Res, vol.40, pp.4641-4648, 2001. ,
Application to Binary Mixtures of a Group Contribution SAFT EOS (GC-SAFT), Fluid Phase Equilib, pp.228-229, 2005. ,
Modélisation des Equilibres de Phases Liquid-Liquid et Liquid-Vapour des Mélanges Contenant de L'eau, des alcools e des hydrocarbures, 2009. ,
Modeling Liquid-Liquid and Liquid-Vapor Equilibria of Binary Systems Containing Water with an Alkane, ans Aromatic Hydrocarbon, an Alcohol or a Gas (Methane, Ethane, CO 2 or H 2 S), Using Group-Contribution Polar Perturbed-Chain Statistical Associating Fluid Theory, Ind. Eng. Chem. Res, vol.50, pp.7467-7483, 2011. ,
Modélisation thermodynamique de mélanges symétriques et asymétriques de composés polaires oxygénés et/ou aromatiques par GC-SAFT, 2008. ,
Application of GC-PPC-SAFT Eos to ammonia and its mixtures. Fluid Phase Equilibr, vol.37, pp.159-172, 2014. ,
Application to petroleum engineering of statistical thermodynamics-Based equations of state, Oil Gas Sci. Technol, vol.61, pp.363-386, 2006. ,
Extension of Polar GC-SAFT to Systems Containing Some Oxygenated Compounds: Application to Ethers, Aldehydes and Ketones, Fluid Phase Equilib, vol.307, issue.2, pp.142-159, 2011. ,
,
Prediction of heavy esters and their mixtures using GC-SAFT, Fluid Phase Equilib, vol.264, pp.184-200, 2008. ,
Equilibres de phases des fluides oxygénés issus du traitement thermochimique de la biomasse lignocellulosique, 2012. ,
Prediction of thermodynamic properties of fluid mixtures by molecular dynamics simulations: methane-ethane, J. Mol. Phys, vol.75, pp.363-378, 1992. ,
Carbon Dioxide's Liquid-Vapor Coexistence Curve And Critical Properties as Predicted by a Simple Molecular Model, J. Phys. Chem, vol.99, pp.12021-12024, 1995. ,
Monte Carlo simulations of nitrogen and hydrogen physisorption at high pressures and room temperature. Comparison with experiments, J. Chem. Phys, vol.110, pp.4020-4027, 1999. ,
, , vol.16, pp.1560-1571, 2010.
Effective Intermolecular Potential for Fluid Hydrogen Sulfide, J. Phys. Chem. B, vol.101, pp.5480-5483, 1997. ,
An optimised molecular model for ammonia, Mol. Phys, vol.10, pp.1039-1046, 2008. ,
Optimization of the anisotropic united atoms intermolecular potential for n-alkanes, J. Chem. Phys, vol.112, pp.5499-5510, 2000. ,
URL : https://hal.archives-ouvertes.fr/hal-00102549
Optimized Intermolecular Potential for Aromatic Hydrocarbons Based on Anisotropic United Atoms. III. Polyaromatic and Naphthenoaromatic Hydrocarbons, J. Phys. Chem. B, vol.109, pp.2970-2976, 2005. ,
URL : https://hal.archives-ouvertes.fr/hal-00109938
Transferable Force Field for Alcohols and Polyalcohols, J. Phys. Chem. B, vol.113, pp.5985-5995, 2009. ,
A Transferable Force Field to Predict Phase Equilibria and Surface Tension of Ethers and Glycol Ethers, J. Phys. Chem. B, vol.115, pp.10654-10664, 2011. ,
Combining rules for intermolecular potential parameters. II. Rules for the Lennard-Jones (12-6) potential and the Morse potential, J. Phys. Chem, issue.5, pp.2464-2467, 1973. ,
Direct determination of phase coexistence properties of fluids by Monte Carlo simulation in a new ensemble, Mol. Phys, pp.61-81361, 1987. ,
Computer Simulation of Liquids, 1987. ,
Understanding Molecular Simulation: From Algorithms to Applications, 1996. ,
Vapour-Liquid Phase Equilibria Predictions of Methane-Alkane Mixtures by Monte Carlo Simulation Mol, Sim, pp.1-15, 1997. ,
Applications of Molecular Simulation in the Oil and Gas Industry, 1 st Ed.; Edition Technip, 2005. ,
Phase equilibria by simulation in the Gibbs ensemble, Mol. Phys, vol.63, pp.527-545, 1988. ,
Correlation between Adsorption and Small Molecule Hydrogen Bonding, Langmuir, vol.15, pp.3987-3992, 1999. ,
Pairwise Substitution Effects, Inter-and Intramolecular Hydrogen Bonds in Methoxyphenols and Dimethoxybenzenes. Thermochemistry, Calorimetry, and First-Principles Calculations, J. Phys. Chem. B, vol.114, pp.16503-16516, 2010. ,
Theoretical and Experimental Studies on the Adsorption of Aromatic Compounds onto Cellulose, Langmuir, vol.20, pp.3151-3158, 2004. ,
URL : https://hal.archives-ouvertes.fr/hal-00306803
Thermochemical Study of the Methoxy-and Dimethoxyphenol Isomers, J. Chem. Eng. Data, vol.48, pp.669-679, 2003. ,
Formation and Dissociation of Intra-Intermolecular Hydrogen-Bonded Solute-Solvent Complexes: Chemical Exchange Two-Dimensional Infrared Vibrational Echo, Spectroscopy. J. Am. Chem. Soc, vol.128, pp.2977-2987, 2006. ,
Molecular structures of 2-methoxyphenol and 1,2-dimethoxybenzene as studied by gasphase electron diffraction and quantum chemical calculations, J Mol Struct, vol.933, pp.132-141, 2009. ,
Poly Methoxy Phenols in Solution: O-H Bond Dissociation Enthalpies, Structures, and Hydrogen Bonding, J. Org. Chem, vol.64, pp.6969-6975, 1999. ,
Optimized intermolecular potential functions for liquid alcohols, J. Phys. Chem, vol.90, pp.1276-1284, 1986. ,
Monte Carlo Calculations for Alcohols and Their Mixtures with Alkanes. Transferable Potentials for Phase Equilibria. 5. UnitedAtom Description of Primary, Secondary, and Tertiary Alcohols, J. Phys. Chem. B, vol.105, pp.3093-3104, 2001. ,
Design Institute for Physical Properties Data (DIPPR-AIChE), 2011. ,
Determination of the VLE in the systems water-guaiacol and butyl acetate-guaiacol, FIZ report, from Detherm, 1986. ,
Kalininskij Gosudarstvennyj Universite, Investigation of the hydrazine-guaicol-water system, pp.100-104, 1974. ,
Liquid-Liquid Equilibrium in Binary Polar Aromatic + Hydrocarbon Systems, Fluid Phase Equilib, vol.59, pp.291-308, 1990. ,
On the Knowledge of Aromatic Molecular Compounds. XVI. Bivalent Phenols and Their Ethers ,
, Wiss. math. Naturwiss, vol.134, pp.471-482, 1925.
Isobaric (vapour + liquid) equilibria of binary systems containing butyl acetate for the separation of methoxy aromatic compounds (anisole and guaiacol) from biomass fast pyrolysis oil, J. Chem. Thermodynamics, vol.87, pp.141-146, 2015. ,
Application of double retrograde vaporization as an optimizing factor in supercritical fluid separations, J. Supercrit. Fluids, vol.33, pp.115-120, 2005. ,
Solubilities of chlormezanone, metaxalone and methocarbamol in supercritical carbon dioxide, J. Supercrit. Fluids, vol.85, pp.11-16, 2014. ,
Anacardium occidentale L. leaves extraction via SFE: Global yields, extraction. kinetics, mathematical modeling and economic evaluation, J. Supercrit. Fluids, vol.78, pp.114-123, 2013. ,
Extraction of indole alkaloids from Tabernaemontana catharinensis using supercritical CO 2 +ethanol: an evaluation of the process variables and the raw material origin, J. Supercrit. Fluids, vol.30, pp.51-61, 2004. ,
Using molecular orbital calculations to describe the phase behavior of cross-associating mixtures, Ind. Eng. Chem. Res, vol.37, pp.2917-2928, 1998. ,
, Fluid Phase Equilib, vol.382, pp.219-234, 2014.
, J. Chem. Eng. Data, vol.61, pp.19-34, 2016.