Publications
Multiscale modeling for bioresources and bioproducts. Innovative Food Science & Emerging Technologies. 46( Special Issue: SI ):41-53.
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2018. .
2014. Molecular simulation of adsorption and transport in hierarchical porous materials. Langmuir. 29(25):7864–7875.
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2013. On the molecular origin of high-pressure effects in nanoconfinement: The role of surface chemistry and roughness. Journal of Chemical Physics. 139
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2013. Molecular intermittent dynamics of interfacial water: probing adsorption and bulk confinement. Soft Matter. 9(36):8654-8663.
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2013. Molecular intermittent dynamics of interfacial water: probing adsorption and bulk confinement. Soft Matter. 9(36):8654-8663.
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2013. 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)
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2014. Mesoscopic Monte Carlo simulations of microstructure and conductivity of zirconia-based ceramics. J. Eur. Ceram. Soc.. 61(13):5018-5025.
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2013. Mesoscopic Monte Carlo simulations of microstructure and conductivity of zirconia-based ceramics. J. Eur. Ceram. Soc.. 61(13):5018-5025.
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2013. Mesoscale structure, mechanics, and transport properties of source rocks’ organic pore networks. Proceedings of the National Academy of Sciences. 115(49):12365-12370.
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2018. 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.
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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.
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2015. Les matériaux poreux : un domaine scientifique et technologique pluridisciplinaire au futur radieux. Matériaux & Techniques. 103(7):701.
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2015. Les matériaux poreux : un domaine scientifique et technologique pluridisciplinaire au futur radieux. Matériaux & Techniques. 103(7):701.
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2015. Large pressure enhancements in confined phases: effect of surface chemistry and roughness. J. Chem. Phys.. 139
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2013. Ion-specific adsorption and electroosmosis in charged amorphous porous silica. Phys. Chem. Chem. Phys.. 17(38):24683-24695.
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2015. Ionic liquid confined in silica nanopores: molecular dynamics in the isobaric-isothermal ensemble. Molecular Physics. 112:1350-1361.
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2014. Improving the practicality and safety of artificial corneas: Pre-assembly and gamma-rays sterilization of the Boston Keratoprosthesis. The Ocular Surface. 16(3):322-330.
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2018. Improving the practicality and safety of artificial corneas: Pre-assembly and gamma-rays sterilization of the Boston Keratoprosthesis. The Ocular Surface. 16(3):322-330.
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2018. How Ion Condensation Occurs at a Charged Surface: A Molecular Dynamics Investigation of the Stern Layer for Water–Silica Interfaces. The Journal of Physical Chemistry C. 120(2):963-973.
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2016. Gas uptake in solvents confined in mesopores: adsorption versus enhanced solubility. The Journal of Physical Chemistry Letters. 4(14):2274–2278.
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2013. Gas uptake in solvents confined in mesopores: adsorption versus enhanced solubility. The Journal of Physical Chemistry Letters. 4(14):2274–2278.
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2013. Free Volume Theory of Hydrocarbon Mixture Transport in Nanoporous Materials. The Journal of Physical Chemistry Letters. 7(19):3712-3717.
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