Bernard ROUSSEAU
Publications
Publications
Prediction of Anisotropic NMR Parameters in a PBLG based Chiral Liquid Crystal A comparison between Experiments and Molecular Dynamics SimulationsCHIRAFUN, GdR Chirafun, Sep 2024, Orsay, France |
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Membrane filtration of organic molecules in water: from the compounds organisation to the process performancesWorkshop on Applications of Multi-scale Approaches in Environmental chemistry (AMARE 2019), Apr 2019, Rennes, France |
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Simulation d'une interface entre un mélange trioléine-acide oléique et l'eau: analyse de la tension interfaciale et de l'organisation des lipides.Journées Scientifiques de l'Université de Nantes - travaux scientifiques basés sur le calcul intensif, Jun 2018, Nantes, France |
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INVESTIGATION OF THE THERMOPHYSICAL PROPERTIES OF THE R744 + R1234YF BINARY SYSTEMFifth IIR Conférence on Thermophysical Properties and Transfer Processes of Refrigerants (TPTPR2017), Apr 2017, SEOUL, South Korea. ⟨10.18462/iir.tptpr.2017.0008⟩ |
Theoretical prediction of physico-chemical properties of chemicals for regulatory purposes17. International Workshop on Quantitative Structure-Activity Relationship in Environmental and Health Sciences (QSAR 2016), Jun 2016, Miami, United States. pp.65 |
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Prédiction des propriétés physico-chimiques dans le cadre du projet PREDIMOLSéminaire IFPEN - SFGP "Données thermodynamiques : production, cohérence et impact sur le dimensionnement des procédés industriels", Apr 2016, Rueil-Malmaison, France |
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Prédiction des propriétés physico-chimiques dans le cadre du projet PREDIMOLCongrès annuel de la Société Française de Toxicologie "Les Nouvelles Approches en Evaluation du Risque : TTC, MOA, MOS, MOE, WOE, QSAR, et Read Across", Nov 2013, Paris, France |
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Prédiction des propriétés physico-chimiques dans le cadre du projet PREDIMOL14. Congrès de la Société Française de Génie des Procédés "Les sciences du génie des procédés pour une industrie durable" (SFGP 2013), Oct 2013, Lyon, France |
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Prediction of physico-chemical properties in the context of the French PREDIMOL project15. International Workshop on Quantitative Structure-Activity Relationships in Environmental and Health Sciences (QSAR 2012), Jun 2012, Tallinn, Estonia |
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Mechanisms of RO Membrane Fouling by Surfactants: a Combination of Experiments and Simulation StudiesEuromembrane Conference 2012, Sep 2012, Londres, France. pp.1751-1752, ⟨10.1016/j.proeng.2012.08.935⟩ |
Atomistic model of two commercial reverse osmosis membranesInternational Workshop "Molecular Modeling and Simulation for Industrial Applications", Mar 2010, Würzburg, Germany |
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Atomistic models of polyamide thin films used for the recycling of water in agrofood industries by reverse osmosis12ème Congrès de la Société Française de Génie des Procédés (SFGP 2009) "Pour relever les défis industriels du XXIème siècle", Société Française de Génie des Procédés (SFGP). FRA., Oct 2009, Marseille, France |
New theoretical model for thermal diffusion : prigogine's approach revisited8th International Meeting on Thermodiffusion, Jun 2008, Bonn, Germany. pp.227-282 |
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Calculation of the surface tension of n-alkanes using molecular simulations: operational expressions and long range corrections.Molecular simulation of equilibrium properties, A seminar celebrating the 10 th anniversary of the GIBBS Software, Mar 2006, Rueil-Malmaison, France |
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Self-diffusion of n-alkanes in MFI-type zeolites: A Molecular Dynamics study and a comparison to Quasi-Elastic Neutron Scattering experimentsDiffusion Fundamentals, 2005, Leipzig, Germany. 22-24 septembre |
Molecular modeling and experimental characterization of key polymeric material in reverse-osmosis membranes and of their interactions with water: A contribution to transfer control in dense polymers.European Polymer Congress, 2019, Crete, Greece |
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Investigation of the thermophysical properties of binary system CO 2 and Hydro-fluoro-olefinsESAT 2017, May 2017, Bucarest, Romania |
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Lipids behaviour in aqueous solution of disrupted microalgae cultivated under nitrogen starving conditions: molecular simulation compared to experimental study of representative synthetic mixturesInternational conference on Reniewable Resources and Biorefineries (RRB 12), May 2016, Ghent, Belgium |
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SCCO: Thermodiffusion for the Oil and Gas IndustryPhysical Science Under Microgravity: Experiments on Board the SJ-10 Recoverable Satellite, pp.171-190, 2019, ⟨10.1007/978-981-13-1340-0_8⟩ |