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Patrice Paricaud

Professeur de Génie des Procédés à l'ENSTA Paris, Palaiseau, France.
120
Documents

Présentation

ENSTA Paris, Institut Polytechnique de Paris
Unité Chimie et Procédés
828 boulevard des Maréchaux
91762 Palaiseau Cedex
Tel. 33 (0)1 81 87 20 26
Fax 33 (0)1 81 87 20 29
Office 1622

patrice.paricaud@ensta-paris.fr

ENSTA web page google scholar webpage

CV

  • Professeur (PR1) de Génie Chimique, à l'ENSTA Paris, Palaiseau, France
  • Palmes académiques (Janv. 2023)
  • Habilitation à Diriger des Recherches (october 2014)
  • Postdoc, Vanderbilt University, Nashville, USA (2003-2004).
  • Prix Dudley Newitt, Imperial College (2003).
  • Thèse en génie chimique, Imperial College, London (2003). « Understanding the Fluid Phase Behaviour of Polymer Systems with the SAFT Theory ».
  • Diplome d'ingénieur et DEA en génie chimique, ENSIC, Nancy (1999).

Member of the thermodynamic group of the French Society of Process Engineering (SFGP).

Domaines de recherche

Génie chimique

Compétences

modélisation thermodynamique Chimie physique génie des procédés simulation de procédés calculs CFD et transfert thermique

Publications

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Publications

A comprehensive approach to incorporating intermolecular dispersion into the openCOSMO-RS model. Part 2: Atomic polarizabilities

Daria Grigorash , Simon Müller , Esther Heid , Frank Neese , Dimitrios Liakos et al.

Chemical Engineering Science, 2026, 319, pp.122170. ⟨10.1016/j.ces.2025.122170⟩

Article dans une revue hal-05290499v1

Modeling polycyclic aromatic hydrocarbons (PAH) and liquid organic hydrogen carriers (LOHC) with the SAFT-γ Mie group-contribution equation of state

Edgar Velásquez Sarmiento , Patrice Paricaud

Fluid Phase Equilibria, 2025, 598, pp.114514. ⟨10.1016/j.fluid.2025.114514⟩

Article dans une revue hal-05290532v1

A comprehensive approach to incorporating intermolecular dispersion into the openCOSMO-RS model. Part 1. Halocarbons

Daria Grigorash , Patrice Paricaud , Patrice Paricaud , Erling Stenby , Irina Smirnova et al.

Chemical Engineering Science, 2025, 309, pp.121425. ⟨10.1016/j.ces.2025.121425⟩

Article dans une revue hal-05290507v1

Separation of ethylene glycol and ethylene glycol diacetate azeotropic mixture with a heterogeneous extraction distillation process

Wei Chen , Yan Ding , Fang Wang , Zhixia Xu , Qing Ye et al.

Separation and Purification Technology, 2025, 362, pp.131645. ⟨10.1016/j.seppur.2025.131645⟩

Article dans une revue hal-05290509v1

Water–Ionic Liquid Working Fluids in Absorption Cycles: Fluid Screening, Vapor–Liquid Equilibrium Measurements and Modeling, and Performance Evaluation

Jinxiang Cao , Yicang Guo , Jia Yan , Zixi Wu , Patrice Paricaud et al.

Industrial and engineering chemistry research, 2024, 63 (25), pp.11171-11183. ⟨10.1021/acs.iecr.4c01107⟩

Article dans une revue hal-05290518v1

The performance of [Emim]Br/H2O as a working pair in the absorption refrigeration system

Yicang Guo , Jinlong Li , Patrice Paricaud

Next Energy, 2024, 2, pp.100038. ⟨10.1016/j.nxener.2023.100038⟩

Article dans une revue hal-04399255v1

Modeling of the Phase Behavior of Carboxylic Acid Systems Using the SAFT-VR Mie DBD Model: Application to the Simulation of the Acrylic Acid Production Process

Mehdi Hafsi , Patrice Paricaud

Industrial and engineering chemistry research, 2024, ⟨10.1021/acs.iecr.3c03416⟩

Article dans une revue hal-04399240v1

Multipolar SAFT-VR Mie Equation of State: Predictions of Phase Equilibria in Refrigerant Systems with No Binary Interaction Parameter

Patrice Paricaud

Journal of Physical Chemistry B, 2023, 127 (13), pp.3052-3070. ⟨10.1021/acs.jpcb.3c01058⟩

Article dans une revue hal-04208020v1

Experimental and modelling of the vapor-liquid equilibria of [C mim]Br(n = 2, 3, 4) + H2O systems

Yicang Guo , Jinxiang Cao , Fang Wang , Yan Ding , Jinlong Li et al.

Fluid Phase Equilibria, 2023, 565, pp.113654. ⟨10.1016/j.fluid.2022.113654⟩

Article dans une revue hal-04208022v1
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Vapor-liquid equilibria of α-tocopherol in transportation fuels surrogates: An experimental and modeling study

Halla Kerkache , Abdourrahmane Bathily , Rodica Chiriac , Christelle Goutaudier , Patrice Paricaud et al.

Fuel, 2022, 319, pp.123866. ⟨10.1016/j.fuel.2022.123866⟩

Article dans une revue hal-03615256v1

Mixed Ionic Liquids as Entrainers for Aromatic Extraction Processes: Energy, Economic, and Environmental Evaluations

Yan Ding , Yicang Guo , Yuhang Sun , Tianyi Sun , Qing Ye et al.

Industrial and engineering chemistry research, 2022, ⟨10.1021/acs.iecr.2c02124⟩

Article dans une revue hal-04208021v1

Thermodynamic Modelling of Electrolyte Solutions

Patrice Paricaud

Techniques de l'Ingénieur. Physique Chimie, 2022

Article dans une revue hal-03615502v1
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Predictions of thermodynamic properties and phase equilibria of refrigerant systems with COSMO approaches

Danielle Mambo-Lomba , Patrice Paricaud

International Journal of Refrigeration, 2021, 124, pp.52-63. ⟨10.1016/j.ijrefrig.2020.11.005⟩

Article dans une revue hal-03609269v1
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Measurements and Modeling of High-Pressure O 2 and CO 2 Solubility in Brine (H 2 O + NaCl) between 303 and 373 K and Pressures up to 36 MPa

Salaheddine Chabab , Pezhman Ahmadi , Pascal Theveneau , Christophe Coquelet , Antonin Chapoy et al.

Journal of Chemical and Engineering Data, 2021, 66 (1), pp.609-620. ⟨10.1021/acs.jced.0c00799⟩

Article dans une revue hal-03111080v1

Modélisation thermodynamique par calculs ab initio et approche COSMO

Patrice Paricaud

Les Techniques de l'Ingenieur, A paraître

Article dans une revue hal-02961855v1

Détermination des propriétés thermodynamiques des fluides - Fluides purs

Salaheddine Chabab , Patrice Paricaud , Christophe Coquelet

Techniques de l’Ingénieur. Energies, 2020

Article dans une revue hal-02961849v1

Predictions of solvation Gibbs free energies with COSMO-SAC approaches

Chourouk Nait Saidi , Detlev Conrad Mielczarek , Patrice Paricaud

Fluid Phase Equilibria, 2020, 517, pp.112614. ⟨10.1016/j.fluid.2020.112614⟩

Article dans une revue hal-02614634v1
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Measurements and predictive models of high-pressure H2 solubility in brine (H2O+NaCl) for Underground Hydrogen Storage application

Salaheddine Chabab , Pascal Theveneau , Pascal Théveneau , Christophe Coquelet , Jérôme Corvisier et al.

International Journal of Hydrogen Energy, 2020, 45 (56), pp.32206-32220. ⟨10.1016/j.ijhydene.2020.08.192⟩

Article dans une revue hal-02984804v1

Détermination des propriétés thermodynamiques des fluides-Mélanges

Salaheddine Chabab , Patrice Paricaud , Christophe Coquelet

Techniques de l’Ingénieur. Energies, 2020

Article dans une revue hal-02961852v1
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Prediction of the flash points of multicomponent systems: Applications to solvent blends, gasoline, diesel, biodiesels and jet fuels

Patrice Paricaud , A. Ndjaka , L. Catoire

Fuel, 2020, 263, pp.116534. ⟨10.1016/j.fuel.2019.116534⟩

Article dans une revue hal-02614638v1
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Thermodynamic study of the CO 2 -H 2 O -NaCl system: Measurements of CO 2 solubility and modeling of phase equilibria using Soreide and Whitson, electrolyte CPA and SIT models

Salaheddine Chabab , Pascal Théveneau , Jérôme Corvisier , Christophe Coquelet , Patrice Paricaud et al.

International Journal of Greenhouse Gas Control, 2019, 91, pp.102825. ⟨10.1016/j.ijggc.2019.102825⟩

Article dans une revue hal-02310963v1

Experimental measurements and thermodynamic modelling of aqueous solubilities, octanol-water partition coefficients and vapor pressures of dimethyl phthalate and butyl benzyl phthalate

H. Ishak , I. Mokbel , J. Saab , J. Stephan , Patrice Paricaud et al.

Journal of Chemical Thermodynamics, 2019, 131, pp.286-293. ⟨10.1016/j.jct.2018.11.015⟩

Article dans une revue istex hal-04540472v1

Generalized Prediction of Enthalpies of Formation Using DLPNO-CCSD(T) Ab Initio Calculations for Molecules Containing the Elements H, C, N, O, F, S, Cl, Br

Detlev Conrad Mielczarek , Chourouk Nait Saidi , Patrice Paricaud , Laurent Catoire

Journal of Computational Chemistry, 2019, 40 (6), pp.768-793. ⟨10.1002/jcc.25763⟩

Article dans une revue hal-02614644v1
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Vapor–Liquid Equilibrium of Ethyl Lactate Highly Diluted in Ethanol–Water Mixtures at 101.3 kPa. Experimental Measurements and Thermodynamic Modeling Using Semiempirical Models

Cristian Puentes , Xavier Joulia , Patrice Paricaud , Pierre Giampaoli , Violaine Athès et al.

Journal of Chemical and Engineering Data, 2018, 63 (2), pp.365-379. ⟨10.1021/acs.jced.7b00770⟩

Article dans une revue hal-01778465v1

Long Range Corrections for Inhomogeneous Simulations of Mie n – m Potential

Jiří Janeček , Olivier Said-Aizpuru , Patrice Paricaud

Journal of Chemical Theory and Computation, 2017, 13 (9), pp.4482 - 4491. ⟨10.1021/acs.jctc.7b00212⟩

Article dans une revue hal-01778469v1

Predictions of the ideal gas properties of refrigerant molecules

L. Catoire , Aurélien Demenay , Julien Glorian , Patrice Paricaud

International Journal of Refrigeration, 2017, 79, pp.207 - 216. ⟨10.1016/j.ijrefrig.2017.03.023⟩

Article dans une revue hal-01665636v1
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Comparative study of vapour-liquid equilibrium and density modelling of mixtures related to carbon capture and storage with the SRK, PR, PC- SAFT and SAFT-VR Mie equations of state for industrial uses

Alfonso Gonzalez Perez , Christophe Coquelet , Patrice Paricaud , Antonin Chapoy

Fluid Phase Equilibria, 2017, 440, ⟨10.1016/j.fluid.2017.02.018⟩

Article dans une revue hal-01487723v1
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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 , Fan Zhang , El Abbadi Jamal , Céline Houriez et al.

Fluid Phase Equilibria, 2016, ⟨10.1016/j.fluid.2016.02.005⟩

Article dans une revue hal-01305721v1

A new optimization method for the determination of classical force fields. Application to the united atom force field of short alkanes

Jiří Janeček , Patrice Paricaud

Fluid Phase Equilibria, 2016, 429, pp.27-36. ⟨10.1016/j.fluid.2016.08.023⟩

Article dans une revue hal-01359831v1

Experimental measurements and modeling of the dissociation conditions of semiclathrate hydrates of tetrabutyl ammonium nitrate and carbon dioxide

Ponnivalavan Babu , Patrice Paricaud , Praveen Linga

Fluid Phase Equilibria, 2016, 413, pp.80-85. ⟨10.1016/j.fluid.2015.08.034⟩

Article dans une revue istex hal-01298504v1
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Experimental and modelling study of the densities of the hydrogen sulphide + methane mixtures at 253, 273 and 293 K and pressures up to 30 MPa

Alfonso Gonzalez Perez , Alain Valtz , Christophe Coquelet , Patrice Paricaud , Antonin Chapoy

Fluid Phase Equilibria, 2016, 427, pp.371-383. ⟨10.1016/j.fluid.2016.08.002⟩

Article dans une revue hal-01372274v1

Extension of the BMCSL equation of state for hard spheres to the metastable disordered region: Application to the SAFT approach

Patrice Paricaud

The Journal of Chemical Physics, 2015, 143 (4), pp.044507. ⟨10.1063/1.4927148⟩

Article dans une revue hal-01214720v1

Modeling of Transport Properties Using the SAFT-VR Mie Equation of State

Alfonso Gonzales , Patrice Paricaud , Christophe Coquelet , Antonin Chapoy

Society of Petroleum Engineers Journal, 2015, pp.SPE-175051-MS. ⟨10.2118/175051-MS⟩

Article dans une revue hal-01214975v1

La Filière Hydrogène

Johnny Deschamps , Patrice Paricaud , L. Catoire

Industrie & Technologies, 2015, 30 technos Made In France, Décembre 2015 (982-983), pp.57

Article dans une revue hal-01241814v1
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A generalized Kiselev crossover approach applied to Soave–Redlich–Kwong equation of state

Jiri Janecek , Patrice Paricaud , Moussa Dicko , Christophe Coquelet

Fluid Phase Equilibria, 2015, 401, pp.16-26. ⟨10.1016/j.fluid.2015.04.024⟩

Article dans une revue hal-01158602v1

Modeling of the dissociation conditions of H2 + CO2 semiclathrate hydrate formed with TBAB, TBAC, TBAF, TBPB, and TBNO3 salts. Application to CO2 capture from syngas

Ayako Fukumoto , Luiz Paulo Sales Silva , Patrice Paricaud , Didier Dalmazzone , Walter Fürst

International Journal of Hydrogen Energy, 2015, 40 (30), pp.9254-9266. ⟨10.1016/j.ijhydene.2015.05.139⟩

Article dans une revue istex hal-01214501v1

Experimental Measurements and Modeling of the Dissociation Conditions of Tetrabutylammonium Chloride Semiclathrate Hydrates in the Presence of Hydrogen

Ayako Fukumoto , Didier Dalmazzone , Patrice Paricaud , Walter Fürst

Journal of Chemical and Engineering Data, 2015, 60 (2), pp.343-350. ⟨10.1021/je5006104⟩

Article dans une revue hal-01153015v1

Modeling the Dissociation Conditions of Carbon Dioxide + TBAB, TBAC, TBAF, and TBPB Semiclathrate Hydrates

Ayako Fukumoto , Patrice Paricaud , Didier Dalmazzone , Wassila Bouchafaa , Thi Thu-Suong Ho et al.

Journal of Chemical and Engineering Data, 2014, 59 (10), pp.3193-3204. ⟨10.1021/je500243k⟩

Article dans une revue hal-01153016v1
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Influence of Cyclic Dimer Formation on the Phase Behavior of Carboxylic Acids. II. Cross-Associating Systems

Jiri Janecek , Patrice Paricaud

Journal of Physical Chemistry B, 2013, 117, pp.9430-9438. ⟨10.1021/jp4012125⟩

Article dans une revue hal-01058133v1
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Size distribution of associated clusters in liquid alcohols: Interpretation of simulation results in the frame of SAFT approach

Jiri Janecek , Patrice Paricaud

The Journal of Chemical Physics, 2013, 139, pp.174502. ⟨10.1063/1.4827107⟩

Article dans une revue hal-01058097v1

Vapour-liquid equilibrium (VLE) for the systems furan + n-hexane and furan + toluene. Measurements, data treatment and modeling using molecular models

Mqondisi Nala , Eric Auger , Ibrahim Gedik , Nicolas Ferrando , Moussa Dicko et al.

Fluid Phase Equilibria, 2013, 337, pp.234-245. ⟨10.1016/j.fluid.2012.08.005⟩

Article dans une revue istex hal-00880590v1

Vapour–liquid equilibrium of binary systems containing pentafluorochemicals from 363 to 413 K: Measurement and modelling with Peng–Robinson and three SAFT-like equations of states

Elise El Ahmar , Alain Valtz , Patrice Paricaud , Christophe Coquelet , Laurent Abbas et al.

International Journal of Refrigeration, 2012, 35 (8), pp.2297-2310. ⟨10.1016/j.ijrefrig.2012.05.016⟩

Article dans une revue istex hal-01153347v1

Influence of cyclic dimer formation on the phase behavior of carboxylic acids

Jiri Janecek , Patrice Paricaud

Journal of Physical Chemistry B, 2012, 116 (27), pp.7874-7882. ⟨10.1021/jp303051j⟩

Article dans une revue hal-00848769v1

Application of the Conduct-like Screening Models for Real Solvent and Segment Activity Coefficient for the Predictions of Partition Coefficients and Vapor–Liquid and Liquid–Liquid Equilibria of Bio-oil-Related Mixtures

Jinlong Li , Patrice Paricaud

Energy & Fuels, 2012, 26 (6), pp.3756-3768. ⟨10.1021/ef300181j⟩

Article dans une revue hal-01153351v1

Modeling of the thermodynamic properties of aqueous ionic liquid solutions with an equation of state for square-well chain fluid with variable range

Jinlong Li , Changchun He , Changjun Peng , Honglai Liu , Ying Hu et al.

Industrial and engineering chemistry research, 2011, 50 (11), pp.7027-7040. ⟨10.1021/ie102156m⟩

Article dans une revue hal-00848771v1

Modeling the Dissociation Conditions of Salt Hydrates and Gas Semiclathrate Hydrates: Application to Lithium Bromide, Hydrogen Iodide, and Tetra-n-butylammonium Bromide plus Carbon Dioxide Systems

Patrice Paricaud

Journal of Physical Chemistry B, 2011, 115 (2), pp.288-299. ⟨10.1021/jp1067457⟩

Article dans une revue hal-01153369v1

Vapor−Liquid Equilibria in the Propyl Acetate + Ethanoic Acid Binary System from (323.15 to 353.15) K: Measurement with a Static Method and Modeling with the NRTL, Wilson, UNIQUAC, and COSMO−SAC Approaches

Dongfu Fan , Jinlong Li , Jibin Shi , Changjun Peng , Honglai Liu et al.

Journal of Chemical and Engineering Data, 2011, 56 (4), pp.1323-1329. ⟨10.1021/je101131x⟩

Article dans une revue hal-01153354v1

Modeling the phase equilibria of the HIx mixture using the SAFT-VRE equation of state: Binary systems

Patrice Paricaud , Laetitia Tazi , Jean-Marc Borgard

International Journal of Hydrogen Energy, 2010, 35 (3), pp.978-991. ⟨10.1016/j.ijhydene.2009.11.025⟩

Article dans une revue istex hal-01153457v1

Vapor-liquid equilibrium in the n-butane + methanol system, measurement and modeling from 323.2 to 443.2 K

Xavier Courtial , Chien-Bin Soo , Christophe Coquelet , Patrice Paricaud , Deresh Ramjugernath et al.

Fluid Phase Equilibria, 2009, 277 (2), pp.152-161. ⟨10.1016/j.fluid.2008.12.001⟩

Article dans une revue istex hal-00508615v1

Vapour–liquid equilibria of aroma compounds in hydroalcoholic solutions: Measurements with a recirculation method and modelling with the NRTL and COSMO-SAC approaches

Violaine Athès , Patrice Paricaud , Mohammed Ellaite , Isabelle Souchon , Walter Fürst

Fluid Phase Equilibria, 2008, 265 (1-2), pp.139-154. ⟨10.1016/j.fluid.2008.01.012⟩

Article dans une revue istex hal-01153461v1

Phase equilibria in polydisperse nonadditive hard-sphere systems

Patrice Paricaud

Physical Review E : Statistical, Nonlinear, and Soft Matter Physics [2001-2015], 2008, 78 (2), pp.021202. ⟨10.1103/PhysRevE.78.021202⟩

Article dans une revue hal-01153370v1

Examining the effect of chain length polydispersity on the phase behavior of polymer solutions with the statistical associating fluid theory (Wertheim TPT1) using discrete and continuous distributions

Patrice Paricaud , Amparo Galindo , George Jackson

The Journal of Chemical Physics, 2007, 127 (15), ⟨10.1063/1.2772600⟩

Article dans une revue hal-00848776v1

Predicting enhanced absorption of light gases in polyethylene using simplified PC-SAFT and SAFT-VR

Andrew J. Haslam , Nicolas von Solms , Claire S. Adjiman , Amparo Galindo , George Jackson et al.

Fluid Phase Equilibria, 2006, 243 (1-2), pp.74-91. ⟨10.1016/j.fluid.2006.02.014⟩

Article dans une revue istex hal-01153442v1

Polarizable contributions to the surface tension of liquid water

Jose L. Rivera , Francis W. Starr , Patrice Paricaud , Peter T. Cummings

The Journal of Chemical Physics, 2006, 125 (9), pp.094712. ⟨10.1063/1.2345063⟩

Article dans une revue hal-01153441v1

A general perturbation approach for equation of state development: Applications to simple fluids, ab initio potentials, and fullerenes

Patrice Paricaud

The Journal of Chemical Physics, 2006, 124 (15), ⟨10.1063/1.2181979⟩

Article dans une revue hal-00848777v1

From dimer to condensed phases at extreme conditions: Accurate predictions of the properties of water by a Gaussian charge polarizable model

Patrice Paricaud , Milan Předota , Ariel A. Chialvo , Peter T. Cummings

Journal of the Chemical Society, Faraday Transactions 2: Molecular and Chemical Physics, 2005, 122 (24), pp.244511. ⟨10.1063/1.1940033⟩

Article dans une revue hal-01153443v1

Vapour–liquid equilibria in the carbon dioxide–water system, measurement and modelling from 278.2 to 318.2K

Alain Valtz , Antonin Chapoy , Christophe Coquelet , Patrice Paricaud , Dominique Richon

Fluid Phase Equilibria, 2004, 226, pp.333-344. ⟨10.1016/j.fluid.2004.10.013⟩

Article dans une revue istex hal-01153444v1

Effect of polymer chain-length polydispersity on the phase behavior of model athermal mixtures of colloids and flexible self-excluding polymers

Patrice Paricaud , Szabolcs Varga , Peter T. Cummings , George Jackson

Chemical Physics Letters, 2004, 398 (4-6), pp.489-494. ⟨10.1016/j.cplett.2004.09.071⟩

Article dans une revue istex hal-01153450v1

Modeling the Cloud Curves and the Solubility of Gases in Amorphous and Semicrystalline Polyethylene with the SAFT-VR Approach and Flory Theory of Crystallization

Patrice Paricaud , Amparo Galindo , George Jackson

Industrial and engineering chemistry research, 2004, 43 (21), pp.3809-3823. ⟨10.1021/ie049592a⟩

Article dans une revue istex hal-01153447v1

Understanding liquid-liquid immiscibility and LCST behaviour in polymer solutions with a Wertheim TPT1 description

Patrice Paricaud , Amparo Galindo , George Jackson

Molecular Physics, 2003, 101, pp.2575-2600. ⟨10.1080/0026897031000123710⟩

Article dans une revue hal-01145208v1

Prediction of the Salting-Out Effect of Strong Electrolytes on Water + Alkane Solutions

Birju. H. Patel , Patrice Paricaud , Amparo Galindo , Geoffrey. C. Maitland

Industrial and engineering chemistry research, 2003, 42 (16), pp.3809-3823. ⟨10.1021/ie020918u⟩

Article dans une revue istex hal-01153446v1

Study of the demixing transition in model athermal mixtures of colloids and flexible self-excluding polymers using the thermodynamic perturbation theory of Wertheim

Patrice Paricaud , Szabolcs Varga , George Jackson

The Journal of Chemical Physics, 2003, 118, pp.8525-8536. ⟨10.1063/1.1565104⟩

Article dans une revue hal-01145214v1

Recent advances in the use of the SAFT approach in describing electrolytes, interfaces, liquid crystals and polymers

Patrice Paricaud , Amparo Galindo , George Jackson

Fluid Phase Equilibria, 2002, 194, pp.87-96. ⟨10.1016/s0378-3812(01)00659-8⟩

Article dans une revue istex hal-01145204v1

Use of Distribution Functions: A Useful Tool To Calculate the Properties of Condensate Gases

Jean-Noël Jaubert , Roland Solimando , Patrice Paricaud , Alain Barreau

Industrial and engineering chemistry research, 2000, 39 (12), pp.5029 - 5036. ⟨10.1021/ie0003786⟩

Article dans une revue istex hal-01706019v1

Use of distribution functions: A useful tool to calculate the properties of condensate gases

Jean-Noël Jaubert , Rolland Solimando , Patrice Paricaud , Alain Barreau

Industrial and engineering chemistry research, 2000, 39, pp.5029-5036. ⟨10.1021/ie0003786⟩

Article dans une revue istex hal-01121170v1

Modeling polycyclic aromatic hydrocarbons (PAH) and liquid organic hydrogen carriers (LOHC) with the SAFT-γ Mie group-contribution equation of state

Edgar Velásquez Sarmiento , Patrice Paricaud

JEEP 2025, 2025, paris, France

Communication dans un congrès hal-05290537v1

Modeling of the Phase Behavior of Carboxylic Acid Systems Using the SAFT-VR Mie DBD Model

Patrice Paricaud , Mehdi Hafsi

JEEP 2025, 2025, paris, France

Communication dans un congrès hal-05290527v1

Modelling of the Thermophysical Properties of a-tocopherol + ethanol + n-pentane and a-tocopherol + gasoline mixtures

Kerkache A. , A. Bathily , Rodica Chiriac , Patrice Paricaud , André Nicolle et al.

ESAT 2021, Jul 2021, Rueil-Malmaison, France

Communication dans un congrès hal-03609327v1

Using ab initio calculation to predict the thermochemical and safety properties of multicomponent systems

Chourouk Nait Saidi , Detlev Conrad Mielczarek , Patrice Paricaud , L. Catoire

ESAT 2021, Jul 2021, Rueil-Malmaison, France

Communication dans un congrès hal-03609300v1

The effect of antoxidant additives on the physicochemical properties of a surrogate gasoline system

A. Bathily , Rodica Chiriac , Andre Nicolle , Patrice Paricaud , Christelle Goutaudier

ESAT 2021, Jul 2021, Rueil-Malmaison, France

Communication dans un congrès hal-03609317v1

Solubility of gases in brine for underground gas storage application: Experimental measurements and modeling, AIChE meeting, (2019).

Salaheddine Chabab , Pezhman Ahmadi , Pascal Théveneau , Christophe Coquelet , Antonin Chapoy et al.

AIChE Meeting, 2019, Orlando, United States

Communication dans un congrès hal-03615520v1

Predictions of gas phase thermochemical properties and solvation free energies from ab initio calculation. Applications the thermal decomposition of biomass.

Chourouk Nait Saidi , Detlev Conrad Mielczarek , Julian Garrec , Patrice Paricaud , L. Catoire

Thermodynamics 2019, 2019, Huelva, Spain

Communication dans un congrès hal-03615528v1
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INVESTIGATION OF THE THERMOPHYSICAL PROPERTIES OF THE R744 + R1234YF BINARY SYSTEM

P-A Artola , B Rousseau , J-N Jaubert , Patrice Paricaud , A Chapoy et al.

Fifth IIR Conférence on Thermophysical Properties and Transfer Processes of Refrigerants (TPTPR2017), Apr 2017, SEOUL, South Korea. ⟨10.18462/iir.tptpr.2017.0008⟩

Communication dans un congrès hal-01518918v1

Extension of the BMCSL equation of state for hard spheres to the metastable disordered region: Application to the PC-SAFT model

Patrice Paricaud

29th European Symposium on Applied Thermodynamics (ESAT), May 2017, Bucarest, Romania

Communication dans un congrès hal-01778494v1

Experimental measurements and predictions of the properties of refrigerant fluids using ab-initio, SAFT-VR Mie and COSMO calculations

Julien Glorian , El Abbadi Jamal , Jiri Janecek , Patrice Paricaud , Johnny Deschamps et al.

14th PPEPPD, May 2016, Porto, Portugal

Communication dans un congrès hal-01256195v1

High pressure DSC characterization of clathrate and semi-clathrate gas hydrates for potential industrial applications

Didier Dalmazzone , Patrice Paricaud , Luiz Paulo Sales Silva

47th French Conference on Calorimetry and Thermal Analysis, Université de Pau et des Pays de l'Adour, May 2016, Anglet, France. pp.15

Communication dans un congrès hal-01319354v1

From theoretical developments to process simulation: applications to the production process of acryclic acid, and to refrigerant systems

Patrice Paricaud , Jiri Janecek

Équations d'état en thermodynamique : des équations cubiques aux équations issues de la thermodynamique moléculaire, Oct 2015, Toulouse, France

Communication dans un congrès hal-01235441v1
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Modeling of Transport Properties Using the SAFT-VR Mie Equation of State

Alfonso Gonzalez , Luis Pereira , Patrice Paricaud , Christophe Coquelet , Antonin Chapoy

SPE Annual Technical Conférence and Exhibition, Sep 2015, HOUSTON, United States. ⟨10.2118/175051-MS⟩

Communication dans un congrès hal-01251948v1

Modeling the phase equilibria of refrigerant fluids with the COSMO-SAC and COSMO-RS approaches. Application to process simulation

Patrice Paricaud , Olivier Baudouin , Abdelatif Baba-Ahmed , Jiri Janecek , Celine Houriez et al.

European Congress of Chemical Engineering, Sep 2015, NICE, France

Communication dans un congrès hal-01250847v1

Prediction of the physical properties of next-generation refrigerant fluids

El Abbadi Jamal , Houriez Celine , F. Zhang , Alain Valtz , Christophe Coquelet et al.

10th European Congress of Chemical Enginnering, Sep 2015, Nice, France

Communication dans un congrès hal-01214945v1

Experimental determination and thermodynamic modeling of gas hydrates in relation with industrial applications

Didier Dalmazzone , Patrice Paricaud

XX International Conference on Chemical Thermodynamic in Russia, Jun 2015, Nizhni Novgorod, Russia. pp.1

Communication dans un congrès hal-01179813v1

Experimental measurements and modelling of the dissociation conditions of gas semi-clathrate hydrates formed with TBAB, TBAC, TBAF, and TBPB salts

Didier Dalmazzone , Patrice Paricaud , Ayako Fukumoto

8th International Conference on Gas Hydrates, Jul 2014, Beijing, China. pp.1

Communication dans un congrès hal-01179808v1

Influence of cyclic dimer formation on the equilibrium behavior of carboxylic acids. From theory to process simulation

Jiri Janecek , Patrice Paricaud , Olivier Baudouin , Eric Auget , Christophe Coquelet et al.

27th European Symposium on Applied Thermodynamics (ESAT), Jul 2014, Eindhoven, Netherlands

Communication dans un congrès hal-01235566v1

Modeling of the dissociation conditions of salt hydrates and gas semi-clathrate hydrates. Application to lithium bromide, hydrogen iodide hydrates, and mixed hydrates of gas + Tetra-n-butylammonium bromide

Patrice Paricaud , Wassila Bouchafaa , Didier Dalmazzone

25th European Symposium on Applied Thermodynamics (ESAT 2011), Jun 2011, Saint-Pétersbourg, Russia

Communication dans un congrès hal-01256356v1

Choosing a crossover approach for industrial applications

Moussa Dicko , Patrice Paricaud , Christophe Coquelet

Thermodynamics 2011, Sep 2011, Athène, Greece

Communication dans un congrès hal-01256359v1

Phase diagram of methanol and alkane binary systems in the field of natural gas fractionators: experimental work and modeling

Xavier Courtial , C.-B. Soo , Patrice Paricaud , Christophe Coquelet , Dominique Richon et al.

AIChE annual meeting, Nov 2008, Philadelphia, France

Communication dans un congrès hal-01256343v1

A General Perturbation Approach for Equation of State Development: Applications to Simple Fluids, Ab initio Potentials and Fullerenes

Patrice Paricaud

Thermodynamics 2007, 2007, Rueil-Malmaison, France

Communication dans un congrès hal-01256328v1

From dimer to condensated phases at extreme conditions: accurate prediction properties of water by a Gaussian charge polarisable model

Patrice Paricaud , Ariel A. Chialvo , Milan Předota , Peter T. Cummings

Joint European Thermodynamics Conference (JETC) IX, Jun 2007, Saint-Étienne, France

Communication dans un congrès hal-01256339v1

Polarizable Contributions to the Surface Tension of Liquid Water

Jose L. Rivera , Patrice Paricaud , Francis W. Starr , Peter T. Cummings

AIChE annual meeting, Nov 2006, San-Francisco, United States

Communication dans un congrès hal-01256325v1

Modeling the Solubility of Gases in Semi-crystalline Polyethylene with the SAFT-VR Theory

Patrice Paricaud , Yun Peng , Clare Mccabe

Polymer workshop, CECAM, Sep 2005, Lyon, France

Communication dans un congrès hal-01256249v1

Modelling of the solubility of gases in semi-crystalline polyethylene

Patrice Paricaud , Clare Mccabe , Yun Peng

4th Workshop of molecular simulation of amorphous polymers and materials, Jun 2005, Clermont-Ferrand, France

Communication dans un congrès hal-01256282v1

Phase equilibrium in the polyethylene manufacturing process - a Comparison of PC-SAFT and SAFT-VR approaches

Nicolas von Solm , J. Haslam Andrew , Patrice Paricaud , S. Adjiman Claire , Amparo Galindo et al.

Thermodynamics 2005, Apr 2005, Sesimbra, Portugal

Communication dans un congrès hal-01256277v1

Understanding the thermodynamics and fluid phase behaviour of polymer-colloid and polymer-solvent systems

Patrice Paricaud , Szabolcs Varga , Amparo Galindo , George Jackson

Thermodynamics 2003, Apr 2003, Cambridge, United Kingdom

Communication dans un congrès hal-01256235v1

Understanding the thermodynamics and fluid phase behaviour of polymer solutions

Patrice Paricaud , Amparo Galindo , George Jackson

16th European Conference on Thermophysical Properties, Sep 2002, Londres, United Kingdom

Communication dans un congrès hal-01256231v1

Modeling the thermodynamics and phase equilibria of hydrocarbons in polyethylene

George Jackson , Patrice Paricaud , Amparo Galindo

6th Liblice conference on the Statistical Mechanics of Liquids, Jun 2002, Liblice, Czech Republic

Communication dans un congrès hal-01256214v1

Recent advances in the use of the SAFT approach in describing electrolytes interfaces, liquid crystals and polymers

George Jackson , Patrice Paricaud , Amparo Galindo

PPEPPD 2001, May 2001, Kurashiki, Japan

Communication dans un congrès hal-01214693v1

Recent advances in the use of the SAFT approach in describing electrolytes interfaces, liquid crystals and polymers

Patrice Paricaud , Amparo Galindo , George Jackson

PPEPPD (Properties and Phase Equilibria for Product and Process Design), May 2001, Kurashiki, Japan

Communication dans un congrès hal-01256202v1

Understanding the fluid phase equilibria in n-alkanes -polyethylene systems

Patrice Paricaud , Amparo Galindo , George Jackson

Thermodynamics 2001, Apr 2001, Bristol, United Kingdom

Communication dans un congrès hal-01256179v1

The performance of Ionic Liquid / water mixtures as working fluids in absorption refrigeration systems

Yicang Guo , Patrice Paricaud

ESAT 2024, 2024, Edinburgh, United Kingdom

Poster de conférence hal-05290545v1

Thermal behaviour of phtalates in saturated water solution. Comparison between experimental and calculated data

Christelle Goutaudier , H. Ishak , J. Saab , Patrice Paricaud

PPEPPD 2019, 2019, Vancouver, Canada

Poster de conférence hal-03615524v1

Modélisation des conditions de dissociation des hydrates semi-clathrates de gaz formés à partir de solutions aqueuses de TBAB avec des mélanges de gaz CO2 + N2 application au captage du CO2

Luiz Paulo Sales Silva , Patrice Paricaud , Didier Dalmazzone

48th French Conference on Calorimetry and Thermal Analysis , May 2017, Rueil Malmaison, France

Poster de conférence hal-01778101v1

Vapour-liquid equilibria and density modelling of CO2-rich systems with PC-SAFT and SAFT-VR Mie

Alfonso González Pérez , Patrice Paricaud , Antonin Chapoy , Christophe Coquelet

PPEPPD 2016, May 2016, Porto, Portugal

Poster de conférence hal-01323929v1

Generation and thermodynamic modelling of vapour-liquid equilibrium data for aroma compounds in hydroalcoholic mixtures - Application to the simulation of spirits distillation units

Christian Puentes , Martine Esteban-Decloux , Patrice Paricaud

PPEPPD 2016, May 2016, Porto, Portugal

Poster de conférence hal-01323935v1

All-atom force-fields for short hydrofluoroalkanes

Jiri Janecek , Patrice Paricaud , Johnny Deschamps , Houriez Celine

14th PPEPPD, May 2016, Porto, Portugal

Poster de conférence hal-01256429v1

Experimental measurements and predictions of the properties of refrigerant fluids using ab-initio, SAFT-VR Mie and COSMO calculations

Julien Glorian , El Abbadi Jamal , Jiri Janececk , Patrice Paricaud , Johnny Deschamps et al.

10th European Congress of Chemical Enginnering, Sep 2015, Nice, France

Poster de conférence hal-01260532v1

Influence of dimer formation on the phase behaviour of carboxylic acids

Jiri Janecek , Patrice Paricaud

Inmother 2012, Mar 2012, Lyon, France

Poster de conférence hal-01256363v1

Including polarizability effects in GCPPC-SAFT: application to alkyl-ether containing systems

Eric Auget , Jean-Philippe Passarello , Patrice Paricaud , Pascal Tobaly , Fabien Volle

25th European Symposium on Applied Thermodynamics (ESAT 2011), Jun 2011, Saint-Pétersbourg, Russia

Poster de conférence hal-01256354v1

Modeling the phase equilibria of the HIx mixture using the SAFT-VRE equation of state

Patrice Paricaud , Laetitia Tazi , Jean-Marc Borgard

SAFT 2010, Sep 2010, Barcelone, Spain

Poster de conférence hal-01256348v1

Recent advances in the use of the SAFT approach to describe the phase behaviour of associating molecules, electrolytes and polymers

Patrice Paricaud , Birju Patel , Amparo Galindo , George Jackson

Joint European Thermodynamics Conference (JETC) IX, Jun 2007, Saint-Étienne, France

Poster de conférence hal-01256334v1

Modeling the solubility of hydrocarbons in amorphous and semi-crystalline polyethylene with SAFT-VR

Patrice Paricaud , Amparo Galindo , George Jackson

FOMMS 2003, Jul 2003, Keystone, Colorado, United States

Poster de conférence hal-01256239v1

Modeling the solubility of gas in amorphous and semicrystalline polyethylene with SAFT-VR

Patrice Paricaud , Amparo Galindo , George Jackson

AIChE annual Meeting, Nov 2003, San-Francisco, United States

Poster de conférence hal-01256241v1

Predicting the salting out of alkanes in aqueous solutions with strong electrolytes

Birju. H. Patel , Patrice Paricaud , Amparo Galindo , George Jackson

6th Liblice conference on the Statistical Mechanics of Liquids, Jun 2002, Liblice, Czech Republic. 2002

Poster de conférence hal-01214694v1

Predicting the anomalous temperature dependence of n-alkanes in aqueous solution using SAFT-VR approach

Birju Patel , Patrice Paricaud , Amparo Galindo , George Jackson

Thermodynamics 2001, Apr 2001, Bristol, United Kingdom

Poster de conférence hal-01256168v1

Thermodynamic modeling of solid-fluid equilibria, from pure solid phases to gas semiclathrate hydrates

Patrice Paricaud

Gas Hydrates: From Characterization and Modeling to Applications, Ed. ISTE Wiley, London, UK (2017)., 2017

Chapitre d'ouvrage hal-01778489v1
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New Amine Based Solvents for Acid Gas Removal

Yohann Coulier , Elise El Ahmar , Jean-Yves Coxam , Élise Provost , Didier Dalmazzone et al.

Ying Wu, John J. Carroll. Carbon dioxide capture and acid gas injection, Wiley, pp.127-145, 2016, 978-1-118-93866-9

Chapitre d'ouvrage hal-01525924v1

Etude et détermination des points critiques : mesures expérimentales et modélisation

Moussa Dicko , Chien-Bin Soo , Christophe Coquelet , Patrice Paricaud

Récents Progrès en Génie des Procédés, 98, SFGP, 2009, 2-910239-72-1

Chapitre d'ouvrage hal-04177692v1

Understanding the fluid phase behaviour of polymer systems with the SAFT theory

Patrice Paricaud

Theoretical and/or physical chemistry. Imperial College London, 2003. English. ⟨NNT : ⟩

Thèse tel-04253090v1
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Thermodynamique Moléculaire Appliquée au Génie des Procédés (HDR)

Patrice Paricaud

Génie des procédés. Université Paris 13 - Sorbonne Paris Cité, 2014

HDR tel-04540270v1