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Toward the modelling of surface tension of refrigerant mixture based on linear gradient theory
Zhiheng Wang
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Christophe Coquelet
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Houriez Céline
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Chieko Kondou
Journal articles
hal-03790555v1
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NaCl salts in finite aqueous environments at the fine particle marine aerosol scale
Valérie Vallet
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Jonathan Coles
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Florent Réal
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Houriez Céline
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Michel Masella
Journal articles
hal-03360947v1
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Vapor pressures and vapor phase compositions of choline chloride urea and choline chloride ethylene glycol deep eutectic solvents from molecular simulation
Hirad Salehi
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H. Mert Polat
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Frédérick de Meyer
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Houriez Céline
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Christophe Coquelet
Journal articles
hal-03533192v1
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Corrigendum and Comments to “Vapor-liquid equilibrium and molecular simulation data for carbon dioxide (CO2) + trans-1,3,3,3-tetrafluoroprop-1-ene (R-1234ze(E)) mixture at temperatures from 283.32 to 353.02 K and pressures up to 7.6 MPa” [Int. J. Refrig. 98 (2019) 362–371]
Rémi Fauve
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Christophe Coquelet
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Céline Houriez
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Pierre-Arnaud Artola
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Elise El Ahmar
Journal articles
hal-02354201v1
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Ion hydration free energies and water surface potential in water nano drops: The cluster pair approximation and the proton hydration Gibbs free energy in solution
Céline Houriez
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Florent Réal
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Valérie Vallet
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Michael Mautner
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Michel Masella
Journal articles
hal-02355191v1
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Experimental measurements and modelling of vapour-liquid equilibrium of 2,3,3,3-tetrafluoropropene (R-1234yf)- pentafluoropropane (R-245cb) system
Alain Valtz
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Jamal El Abbadi
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Christophe Coquelet
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Céline Houriez
Journal articles
hal-02297363v1
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Corrigendum to "Vapor-liquid equilibrium and molecular simulation data for carbon dioxide (CO 2 ) + trans-1,3,3,3-tetrafluoroprop-1-ene (R-1234ze(E)) mixture at temperatures from 283.32 to 353.02 K and pressures up to 7.6MPa"
Rémi Fauve
,
Christophe Coquelet
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Houriez Céline
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Pierre-Arnaud Artola
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Elise El Ahmar
Journal articles
hal-02184056v1
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Organic ion association in aqueous phase and ab initio -based force fields: The case of carboxylate/ammonium salts
Celine Houriez
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Valérie Vallet
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Florent Réal
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Michael Meot-Ner (mautner)
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Michel Masella
Journal articles
hal-01579459v1
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Solvation of the Guanidinium Ion in Pure Aqueous Environments: A Theoretical Study from an "Ab Initio"-Based Polarizable Force Field
Celine Houriez
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Michael Meot-Ner Mautner
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Michel Masella
Journal articles
hal-02281954v1
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Experimental determination of the critical loci for R-23 + (n-propane or n-hexane) and R-116 + n-propane binary mixtures
Mark D. Williams-Wynn
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Jamal El Abbadi
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Alain Valtz
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Elodie Kovacs
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Céline Houriez
Journal articles
hal-01460064v1
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Prediction of thermodynamic properties of refrigerant fluids with a new three-parameter cubic equation of state
Christophe Coquelet
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Céline Houriez
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Jamal El Abbadi
Journal articles
hal-01344174v1
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Isothermal vapor–liquid equilibrium data for the trifluoromethane (R23) + 2,3,3,3-tetrafluoroprop-1-ene (R1234yf) system at temperatures from 254 to 348 K
Hakim Madani
,
Alain Valtz
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Fan Zhang
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El Abbadi Jamal
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Céline Houriez
Journal articles
hal-01305721v1
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Extrapolating Single Organic Ion Solvation Thermochemistry from Simulated Water Nanodroplets
Jonathan Coles
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Céline Houriez
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Michael Mautner
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Michel Masella
Journal articles
hal-01356025v1
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Simulated Solvation of Organic Ions II: Study of Linear Alkylated Carboxylate Ions in Water Nanodrops and in Liquid Water. Propensity for Air/Water Interface and Convergence to Bulk Solvation Properties
Celine Houriez
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Michael Meot-Ner (mautner)
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Michel Masella
Journal articles
hal-01432216v1
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Simulated solvation of organic ions II: Study of linear alkylated
Céline Houriez
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Meot-Ner Michael
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Michel Masella
Journal articles
hal-01254502v1
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Simulated Solvation of Organic Ions: Protonated Methylamines in Water Nanodroplets. Convergence toward Bulk Properties and the Absolute Proton Solvation Enthalpy
Houriez Céline
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Meot-Ner Michael
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Michel Masella
Journal articles
hal-01075877v1
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Importance of a Nonlocal Description of Electron-Electron Interactions in Modeling the Dissociative Adsorption of H-2 on Cu(100)
F. Goltl
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C. Houriez
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Marie Guitou
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Gilberte Chambaud
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P. Sautet
Journal articles
hal-01076259v1
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