Articles

Marco Campestrini, Paolo Stringari, Salem Hoceini. A new modelling approach for reliable prediction of solid-fluid behaviour: Application to the methane + benzene system including low-temperature and high-pressure regions Fluid Phase Equilibria, 2024, 577, pp.113964. ⟨10.1016/j.fluid.2023.113964⟩

Pierre Six, Alain Valtz, Yulong Zhou, Zhiqiang Yang, Christophe Coquelet. Experimental measurements and correlation of vapor-liquid equilibrium data for the difluoromethane (R32)?+?1,3,3,3-tetrafluoropropene (R1234ze(E)) binary system from 254 to 348 K Fluid Phase Equilibria, 2024, 581, pp.114072. ⟨10.1016/j.fluid.2024.114072⟩

Alain Valtz, Frédérick de Meyer, Christophe Coquelet. Density, viscosity and excess properties of aqueous solution of 2-(2-Diethylaminoethoxy)ethanol (DEAE-EO) Fluid Phase Equilibria, 2024, 576, pp.113939. ⟨10.1016/j.fluid.2023.113939⟩

Serena Delgado, Alain Gaunand, Christophe Coquelet, Renaud Cadours, Céline Volpi. A new reactive absorption model using extents of reaction and activities. II. Application to CO 2 absorption into aqueous MDEA solutions Chemical Engineering Science, 2024, 287, pp.119759. ⟨10.1016/j.ces.2024.119759⟩

H. Mert Polat, Casper van der Geest, Frédérick de Meyer, Houriez Céline, Thijs J.H. Vlugt, Othonas Moultos. Densities, viscosities, and diffusivities of loaded and unloaded aqueous CO2/H2S/MDEA mixtures: A molecular dynamics simulation study Fluid Phase Equilibria, 2023, 575, pp.113913. ⟨10.1016/j.fluid.2023.113913⟩

Marco Campestrini, Salem Hoceini, Paolo Stringari. Crystallization risk of aromatic compounds in LNG production. Part II: The solubility of p-xylene in methane-rich mixtures down to cryogenic temperatures Fluid Phase Equilibria, 2023, pp.114015. ⟨10.1016/j.fluid.2023.114015⟩

Frédérick de Meyer, Eric Cloarec, Xavier Rozanska, Karen Gonzalez-Tovar, Alain Valtz, Christophe Coquelet. Inhibition of aqueous chemical reactions by strong liquid structure makers: experimental demonstration with amides and acid-base reactions Journal of Physical Chemistry B, 2023, ⟨10.1021/acs.jpcb.3c04462#⟩

Murad S. Abuaisha, Ahmed Rouabhi, Faouzi Hadj-Hassen, David Eaton, Firas Tayeb, Alain Valtz. Geothermal effects on CO2 dissolution kinetics in brine: A non-dimensional model for underground storage in salt caverns Journal of Natural Gas Science and Engineering, 2023, 117, pp.205076. ⟨10.1016/j.jgsce.2023.205076⟩

Xavier Rozanska, Alain Valtz, Mauro Riva, Christophe Coquelet, Erich Wimmer, Karen Gonzalez-Tovar, Frédérick de Meyer. Selective H 2 S Absorption in Aqueous Tertiary Alkanolamine Solvents: Experimental Measurements and Quantitative Kinetic Model Industrial and engineering chemistry research, 2023, 62 (29), pp.11480-11490. ⟨10.1021/acs.iecr.3c00888⟩

Marco Campestrini, Salem Hoceini, Paolo Stringari, Nicolò Baiguini. On the crystallization of solid formers during liquefaction of gases Fluid Phase Equilibria, 2023, 570, pp.113774. ⟨10.1016/j.fluid.2023.113774⟩

Firas Tayeb, Ahmed Rouabhi, Murad S. Abuaisha, Alain Valtz. Kinetics of CO 2 dissolution for underground applications Geoenergy Science and Engineering, 2023, 230, pp.212061. ⟨10.1016/j.geoen.2023.212061⟩

Salem Hoceini, Marco Campestrini, Paolo Stringari. New insights into the modeling of low-temperature phase equilibria involving molecular solids: Focus on the systems of interest for the LNG production Fluid Phase Equilibria, 2023, 568, pp.113741. ⟨10.1016/j.fluid.2023.113741⟩

H. Mert Polat, Frédérick de Meyer, Houriez Céline, Othonas Moultos, Thijs Vlugt. Solving Chemical Absorption Equilibria using Free Energy and Quantum Chemistry Calculations: Methodology, Limitations, and New Open-Source Software Journal of Chemical Theory and Computation, 2023, 19 (9), pp.2616-2629. ⟨10.1021/acs.jctc.3c00144⟩

Alain Valtz, Frédérick de Meyer, Christophe Coquelet. Density, Viscosity, and Excess Properties of Aqueous Solution of 1,3-Dimethyl-2-imidazolidinone (DMI) Journal of Chemical and Engineering Data, 2023, 68 (4), p. 781-792. ⟨10.1021/acs.jced.2c00613⟩

Vincent Okechukwu Dickson, Thomas Deleau, Christophe Coquelet, Fabienne Espitalier, Julien Lombart, Antoine Tardy. The influence of activity coefficient and equilibrium constant models on the speciation of aqueous solutions of H2SO4-MgSO4-Al2(SO4)3 at 235 and 250 °C Physicochemical Problems of Mineral Processing, 2023, IMPS 2022, 59 (167497), pp.10. ⟨10.37190/ppmp/167497⟩

Marion Négrier, Elise El Ahmar, Romain Sescousse, Martial Sauceau, Tatiana Budtova. Upcycling of textile waste into high added value cellulose porous materials, aerogels and cryogels RSC Sustainability, 2023, 1 (2), pp.335-345. ⟨10.1039/d2su00084a⟩

Jamal El Abbadi, Julien Brocus, Alain Valtz, Christophe Coquelet, Houriez Céline. Experimental Measurements and Modeling of Vapor?Liquid Equilibria for Eight Mixtures Containing trans -1-Chloro-3,3,3-trifluoropropene (R1233zd(E)) and 2-Chloro-3,3,3-trifluoropropene (R1233xf) Journal of Chemical and Engineering Data, 2023, 68 (9), pp.2316-2331. ⟨10.1021/acs.jced.3c00296⟩

Zhiheng Wang, Christophe Coquelet, Houriez Céline, Chieko Kondou. Toward the modelling of surface tension of refrigerant mixture based on linear gradient theory International Journal of Refrigeration, 2023, 147, pp.71-84. ⟨10.1016/j.ijrefrig.2022.09.014⟩

Okechukwu Vincent Dickson, Thomas Deleau, Christophe Coquelet, Fabienne Espitalier, Julien Lombart, Antoine Tardy, Fatima Lachaize. Speciation and reaction equilibrium constant modelling of aqueous hydrometallurgical systems at elevated temperatures: A review Chemical Thermodynamics and Thermal Analysis, 2023, 11, pp.100117. ⟨10.1016/j.ctta.2023.100117⟩

Serena Delgado, Alain Gaunand, Christophe Coquelet, Renaud Cadours, Céline Volpi. A New Reactive Absorption Model Using Extents of Reaction and Activities. I. Application to Alkaline-salts-CO2 Systems Chemical Engineering Science, 2023, 270, pp.118522. ⟨10.1016/j.ces.2023.118522⟩