Céline Houriez

Hirad Salehi, H. Mert Polat, Frédérick de Meyer, Houriez Céline, Christophe Coquelet, et al.. Vapor pressures and vapor phase compositions of choline chloride urea and choline chloride ethylene glycol deep eutectic solvents from molecular simulation. Journal of Chemical Physics, American Institute of Physics, 2021, 155 (11), pp.114504. ⟨10.1063/5.0062408⟩. ⟨hal-03533192⟩

Rémi Fauve, Christophe Coquelet, Céline Houriez, Pierre-Arnaud Artola, Elise El Ahmar, et al.. 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]. International Journal of Refrigeration, Elsevier, 2019, 104, pp.386-389. ⟨10.1016/j.ijrefrig.2019.05.039⟩. ⟨hal-02354201⟩

Alain Valtz, Jamal El Abbadi, Christophe Coquelet, Céline Houriez. Experimental measurements and modelling of vapour-liquid equilibrium of 2,3,3,3-tetrafluoropropene (R-1234yf)- pentafluoropropane (R-245cb) system. International Journal of Refrigeration, Elsevier, 2019, 107, pp.315-325. ⟨10.1016/j.ijrefrig.2019.07.024⟩. ⟨hal-02297363⟩

Céline Houriez, Florent Réal, Valérie Vallet, Michael Mautner, Michel Masella. 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. Journal of Chemical Physics, American Institute of Physics, 2019, 151 (17), pp.174504. ⟨10.1063/1.5109777⟩. ⟨hal-02355191⟩

Rémi Fauve, Christophe Coquelet, Pierre-Arnaud Artola, Elise El Ahmar, Bernard Rousseau, et al.. 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". International Journal of Refrigeration, Elsevier, 2018, 98. ⟨hal-02184056⟩

Celine Houriez, Valérie Vallet, Florent Réal, Michael Meot-Ner (mautner), Michel Masella. Organic ion association in aqueous phase and ab initio -based force fields: The case of carboxylate/ammonium salts. Journal of Chemical Physics, American Institute of Physics, 2017, 147, pp.161720. ⟨10.1063/1.4997996⟩. ⟨hal-01579459⟩

Mark D. Williams-Wynn, Jamal El Abbadi, Alain Valtz, Elodie Kovacs, Céline Houriez, et al.. Experimental determination of the critical loci for R-23 + (n-propane or n-hexane) and R-116 + n-propane binary mixtures. Journal of Chemical Thermodynamics, Elsevier, 2017, 108, pp.84-96. ⟨10.1016/j.JCT.2016.12.021⟩. ⟨hal-01460064⟩

Celine Houriez, Michael Meot-Ner Mautner, Michel Masella. Solvation of the Guanidinium Ion in Pure Aqueous Environments: A Theoretical Study from an "Ab Initio"-Based Polarizable Force Field. Journal of Physical Chemistry B, American Chemical Society, 2017, 121 (50), pp.11219--11228. ⟨10.1021/acs.jpcb.7b07874⟩. ⟨hal-02281954⟩

Christophe Coquelet, Céline Houriez, Jamal El Abbadi. Prediction of thermodynamic properties of refrigerant fluids with a new three-parameter cubic equation of state . International Journal of Refrigeration, Elsevier, 2016, 69, pp.418-436. ⟨10.1016/j.ijrefrig.2016.05.017⟩. ⟨hal-01344174⟩

Jonathan Coles, Céline Houriez, Michael Mautner, Michel Masella. Extrapolating Single Organic Ion Solvation Thermochemistry from Simulated Water Nanodroplets. Journal of Physical Chemistry B, American Chemical Society, 2016, ⟨10.1021/acs.jpcb.6b02486⟩. ⟨hal-01356025⟩

Hakim Madani, Alain Valtz, Fan Zhang, El Abbadi Jamal, Céline Houriez, et al.. 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. Fluid Phase Equilibria, Elsevier, 2016, ⟨10.1016/j.fluid.2016.02.005⟩. ⟨hal-01305721⟩

Celine Houriez, Michael Meot-Ner (mautner), Michel Masella. 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. Journal of Physical Chemistry B, American Chemical Society, 2015, 119 (36), pp.12094 - 12107. ⟨10.1021/acs.jpcb.5b04556⟩. ⟨hal-01432216⟩

Céline Houriez, Meot-Ner Michael, Michel Masella. Simulated solvation of organic ions II: Study of linear alkylated. Journal of Physical Chemistry B, American Chemical Society, 2015, 119, pp.12094-12107. ⟨10.1021/acs.jpcb5b04556⟩. ⟨hal-01254502⟩

F. Goltl, C. Houriez, Marie Guitou, Gilberte Chambaud, P. Sautet. Importance of a Nonlocal Description of Electron-Electron Interactions in Modeling the Dissociative Adsorption of H-2 on Cu(100). Journal of Physical Chemistry C, American Chemical Society, 2014, 118 (10), pp.5374-5382. ⟨10.1021/jp4118634⟩. ⟨hal-01076259⟩

Houriez Céline, Meot-Ner Michael, Michel Masella. Simulated Solvation of Organic Ions: Protonated Methylamines in Water Nanodroplets. Convergence toward Bulk Properties and the Absolute Proton Solvation Enthalpy. Journal of Physical Chemistry B, American Chemical Society, 2014, 118, pp.6222-6233. ⟨10.1021/jp501630q⟩. ⟨hal-01075877⟩

Christophe Coquelet, H. Mert Polat, Thijs J. H. Vlugt, Othon Moultons, Houriez Céline, et al.. Predicting the transport properties of acid gases in Aqueous MEA solutions using molecular simulation. ESAT 2021-31st European Symposium on Applied Thermodynamics, Jul 2021, Paris, France. ⟨hal-03547721⟩

Salaheddine Chabab, Pezhman Ahmadi, Pascal Théveneau, Christophe Coquelet, Antonin Chapoy, et al.. Solubility of gases in brine for underground gas storage application: Experimental measurements and modeling, AIChE meeting, (2019).. AIChE Meeting, 2019, Orlando, United States. ⟨hal-03615520⟩

P-A Artola, B Rousseau, J-N Jaubert, Patrice Paricaud, A Chapoy, et al.. INVESTIGATION OF THE THERMOPHYSICAL PROPERTIES OF THE R744 + R1234YF BINARY SYSTEM. Fifth IIR Conférence on Thermophysical Properties and Transfer Processes of Refrigerants (TPTPR2017), Apr 2017, SEOUL, South Korea. ⟨10.18462/iir.tptpr.2017.0008⟩. ⟨hal-01518918⟩

Julien Glorian, El Abbadi Jamal, Jiri Janecek, Patrice Paricaud, Johnny Deschamps, et al.. Experimental measurements and predictions of the properties of refrigerant fluids using ab-initio, SAFT-VR Mie and COSMO calculations. 14th PPEPPD, May 2016, Porto, Portugal. ⟨hal-01256195⟩

Christophe Coquelet, Céline Houriez, Jean-Noël Jaubert. DETERMINATION OF THERMODYNAMIC PROPERTIES OF REFRIGERANTS BY USING MOLECULAR SIMULATION AND EXPERIMENT: APPLICATION TO DEVELOPMENT OF PREDICTIVE THERMODYNAMIC MODELS. ICR, Aug 2015, Yokohama, Japan. ⟨hal-01250894⟩

El Abbadi Jamal, Houriez Celine, F. Zhang, Alain Valtz, Christophe Coquelet, et al.. Prediction of the physical properties of next-generation refrigerant fluids. 10th European Congress of Chemical Enginnering, Sep 2015, Nice, France. ⟨hal-01214945⟩

Patrice Paricaud, Olivier Baudouin, Abdelatif Baba-Ahmed, Jiri Janecek, Celine Houriez, et al.. Modeling the phase equilibria of refrigerant fluids with the COSMO-SAC and COSMO-RS approaches. Application to process simulation. European Congress of Chemical Engineering, Sep 2015, NICE, France. ⟨hal-01250847⟩

Gilberte Chambaud, Alexander Mitrushchenkov, C. Houriez, Marie Guitou, E. Bernard. Ro-vibrational spectroscopy in reduced dimensionality of physisorbed H2 molecules on a metallic surface (Ag, Cu). Workshop HeSSSMe 2014, Pilar de Lara Castells, Oct 2014, Madrid, Spain. ⟨hal-01081746⟩

Gilberte Chambaud, E. Bernard, C. Houriez, Marie Guitou, A. Mitrushchenkov. Spectroscopie de H2 sur une surface métallique. Journées sur la Dynamique Moléculaire, Nov 2014, SOUSSE, Tunisie. ⟨hal-01091102⟩

C. Houriez, Alexander Mitrushchenkov, Marie Guitou, Gilberte Chambaud. Spectroscopy of H2 physisorbed on a Cu(100) surface. CODECS- Workshop, Apr 2013, MADRID, Spain. ⟨hal-00813013⟩

Houriez Céline. Investigation of the thermophysical properties of binary system CO2 and Hydro-fluoro-olefins. ESAT 2017, May 2017, Bucarest,, Romania. ⟨hal-01636335⟩

P.-A Artola, B. Rousseau, R Fauve, C. Houriez, E. El Ahmar, et al.. Investigation of the thermophysical properties of binary system CO 2 and Hydro-fluoro-olefins. ESAT 2017, May 2017, Bucarest, Romania. ⟨hal-01633874⟩

Jiri Janecek, Patrice Paricaud, Johnny Deschamps, Houriez Celine. All-atom force-fields for short hydrofluoroalkanes. 14th PPEPPD, May 2016, Porto, Portugal. ⟨hal-01256429⟩

Julien Glorian, El Abbadi Jamal, Jiri Janececk, Patrice Paricaud, Johnny Deschamps, et al.. Experimental measurements and predictions of the properties of refrigerant fluids using ab-initio, SAFT-VR Mie and COSMO calculations. 10th European Congress of Chemical Enginnering, Sep 2015, Nice, France. ⟨hal-01260532⟩

Marie Debacq, Alain Gaunand, Houriez Céline. Génie des procédés : introduction et fondamentaux. Jean-Pierre Dal Pont; Marie Debacq. Les industries de procédés, volume 1, ISTE editions, 2020, 9781784056582. ⟨hal-02527728⟩

Valérie Vallet, Jonathan Coles, Florent Réal, Houriez Céline, Michel Masella. NaCl salts in finite aqueous environments at the fine particle marine aerosol scale. 2021. ⟨hal-03360947⟩