Publications

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Journal Article
Hartkamp R, Siboulet B, Dufreche J-F, Coasne BA.  2015.  Ion-specific adsorption and electroosmosis in charged amorphous porous silica. Phys. Chem. Chem. Phys.. 17(38):24683-24695.
Long Y, Palmer JC, Coasne BA, Sliwinska-Bartkowiak M, Jackson G, Mueller EA, Gubbins KE.  2013.  Large pressure enhancements in confined phases: effect of surface chemistry and roughness. J. Chem. Phys.. 139
Ayral A, Calas-Etienne S, Coasne BA, Deratani A, Grande D, Quemener D, Rossignol S.  2015.  Les matériaux poreux : un domaine scientifique et technologique pluridisciplinaire au futur radieux. Matériaux & Techniques. 103(7):701.
Ayral A, Calas-Etienne S, Coasne BA, Deratani A, Grande D, Quemener D, Rossignol S.  2015.  Les matériaux poreux : un domaine scientifique et technologique pluridisciplinaire au futur radieux. Matériaux & Techniques. 103(7):701.
Alabarse FG, Rouquette J, Coasne BA, Haidoux A, Paulmann C, Cambon O, Haines J.  2015.  Mechanism of H2O Insertion and Chemical Bond Formation in AlPO 4-54·x H2O at High Pressure. Journal of the American Chemical Society. 137(2):584-587.
Alabarse FG, Rouquette J, Coasne BA, Haidoux A, Paulmann C, Cambon O, Haines J.  2015.  Mechanism of H2O Insertion and Chemical Bond Formation in AlPO 4-54·x H2O at High Pressure. Journal of the American Chemical Society. 137(2):584-587.
Berthonneau J, Obliger A, Valdenaire P-L, Grauby O, Ferry D, Chaudanson D, Levitz PE, Kim JJin, Ulm F-J, Pellenq RJean-Marc.  2018.  Mesoscale structure, mechanics, and transport properties of source rocks’ organic pore networks. Proceedings of the National Academy of Sciences. 115(49):12365-12370.
Epicoco P., Coasne BA, Gioia A., Papet P., Cabodi I., Gaubil M..  2013.  Mesoscopic Monte Carlo simulations of microstructure and conductivity of zirconia-based ceramics. J. Eur. Ceram. Soc.. 61(13):5018-5025.
Epicoco P., Coasne BA, Gioia A., Papet P., Cabodi I., Gaubil M..  2013.  Mesoscopic Monte Carlo simulations of microstructure and conductivity of zirconia-based ceramics. J. Eur. Ceram. Soc.. 61(13):5018-5025.
Cortes-Huerto R, Sondon T., Saùl A.  2014.  Molecular dynamics simulations of the formation of 1D spin-valves from stretched Au-Co and Pt-Co nanowires. J. Phys.: Condens. Matter. 26(Special issue: Break junctions)
Levitz PE, Bonnaud PA, Cazade P-A, Pellenq RJean-Marc, Coasne BA.  2013.  Molecular intermittent dynamics of interfacial water: probing adsorption and bulk confinement. Soft Matter. 9(36):8654-8663.
Levitz PE, Bonnaud PA, Cazade P-A, Pellenq RJean-Marc, Coasne BA.  2013.  Molecular intermittent dynamics of interfacial water: probing adsorption and bulk confinement. Soft Matter. 9(36):8654-8663.
Long Y, Palmer JC, Coasne BA, Sliwinska-Bartkowiak M, Jackson G, Mueller EA, Gubbins KE.  2013.  On the molecular origin of high-pressure effects in nanoconfinement: The role of surface chemistry and roughness. Journal of Chemical Physics. 139
Coasne BA, Galarneau A, Gerardin C, Fajula F, Villemot F.  2013.  Molecular simulation of adsorption and transport in hierarchical porous materials. Langmuir. 29(25):7864–7875.
Benedict L.X, Driver K.P, Hamel S., Militzer B., Qi T., Correa AA, Saùl A, Schwegler E..  2014.  Multiphase equation of state for carbon addressing high pressures and temperatures. Phys Rev. B. 89
Barnabe M., Blanc N, Chabin T., Delenne J-Y, Duri A., Frank X, Hugouvieux V., Lutton E., Mabille F., Nezamabadi S et al..  2018.  Multiscale modeling for bioresources and bioproducts. Innovative Food Science & Emerging Technologies. 46( Special Issue: SI ):41-53.
Picallo CB, Gravelle S, Joly L, Charlaix E, Bocquet L.  2013.  Nanofluidic Osmotic Diodes: Theory and Molecular Dynamics Simulations. Physical Review Letters. 111:244501.
Chichti E, George M, Delenne J-Y, Radjaï F, Lullien-Pellerina V.  2013.  Nano-mechanical properties of starch and gluten biopolymers from atomic force microscopy. European Polymer Journal. 49(12):3788-3795.
Ori G, Massobrio C, Pradel A, Ribes M, Coasne BA.  2016.  Nanoporous chalcogenides for adsorption and gas separation. Physical Chemistry Chemical Physics. 18(19):13449-13458.
Berthonneau J, Grauby O, Jeannin C, Chaudanson D, Joussein E, Baronnet A.  2015.  Native Morphology of Hydrated Spheroidal Halloysite Observed by Environmental Transmission Electron Microscopy. Clays and Clay Minerals. 63(5):368-377.
Cuellar P, Benseghier Z, Luu L-H, Bonelli S, Delenne J-Y, Radjaï F, Philippe P.  2017.  Numerical insight into the micromechanics of jet erosion of a cohesive granular material. EPJ Web of Conferences. 140:ArticleNumber15017.
Bousige C, Botan A, Ulm F-J, Pellenq RJean-Marc, Coasne BA.  2015.  Optimized molecular reconstruction procedure combining hybrid reverse Monte Carlo and molecular dynamics. The Journal of Chemical Physics. 142(11):ArticleNumber:114112.
Gravelle S, Joly L, Detcheverry F, Ybert C, Cottin-Bizonne C, Bocquet L.  2013.  Optimizing water permeability through the hourglass shape of aquaporins. Proceedings of the National Academy of Sciences. 110(41):16367–16372.
Bocquet M-L, Coasne BA, Pellenq RJean-Marc, Ulm F-J.  2015.  Organic–Clay Interfacial Chemical Bonds Probed by ab Initio Calculations. The Journal of Physical Chemistry C. 119(12):6511-6517.
Saint-Cyr B, Szarf K, Voivret C, Azéma E, Richefeu V, Delenne J-Y, Combe G, Nouguier-Lehon C, Villard P, Sornay P et al..  2012.  Particle shape dependence in 2D granular media. EPL (Europhysics Letters). 98(4):ArticleNumber:44008.

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