Publications

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Journal Article
Manzano H, Pellenq RJean-Marc, Ulm F-J, Buehler MJ, Van Duin ACT.  2012.  Hydration of calcium oxide surface predicted by reactive force field molecular dynamics. Langmuir. 28(9):4187–4197.
Hocine S, Hartkamp R, Siboulet B, Duvail M, Coasne BA, Turq P., Dufreche J-F.  2016.  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.
Mao B, Bentaleb A, Louerat F, Divoux T, Snabre P.  2017.  Heat-induced aging of agar solutions: Impact on the structural and mechanical properties of agar gels. Food Hydrocolloids. 64:59-69.
Al-Mulla T, Pellenq RJean-Marc, Ulm F-J.  2018.  Griffith’s postulate: Grand Canonical Monte Carlo approach for fracture mechanics of solids. Engineering Fracture Mechanics. 199:544-554.
Rakotonirina ADaniel, Delenne J-Y, Radjaï F, Wachs A.  2019.  Grains3D, a flexible DEM approach for particles of arbitrary convex shape—Part III: extension to non-convex particles modelled as glued convex particles. Computational Particle Mechanics. 106(1):55-84.
Youssef M, Pellenq RJean-Marc, Yildiz B.  2011.  Glassy Nature of Water in an Ultraconfining Disordered Material: The Case of Calcium−Silicate−Hydrate. Journal of the American Chemical Society. 133(8):2499-2510.
Ho LNgoc, Clauzier S, Schuurman Y, Farrusseng D, Coasne BA.  2013.  Gas uptake in solvents confined in mesopores: adsorption versus enhanced solubility. The Journal of Physical Chemistry Letters. 4(14):2274–2278.
Delenne J-Y, Soulié F, El Youssoufi M S, Radjaï F.  2011.  From liquid to solid bonding in cohesive granular media. Mechanics of Materials. 43(10):529-537.
Atmani L, Bichara C, Pellenq RJean-Marc, Van Damme H, Van Duin ACT, Raza Z, Truflandier LA, Obliger A, Kralert PG, Ulm F-J et al..  2017.  From cellulose to kerogen: molecular simulation of a geological process. Chemical Science. 8(12):8325-8335.
Obliger A, Pellenq RJean-Marc, Ulm F-J, Coasne BA.  2016.  Free Volume Theory of Hydrocarbon Mixture Transport in Nanoporous Materials. The Journal of Physical Chemistry Letters. 7(19):3712-3717.
Bauchy M, Laubie H, Qomi M J A, Hoover CG, Ulm F-J, Pellenq RJean-Marc.  2015.  Fracture toughness of calcium–silicate–hydrate from molecular dynamics simulations. Journal of Non-Crystalline Solids. 419:58-64.
Bauchy M, Wang B, Wang M, Yu Y, Qomi M J A, Smedskjaer MM, Bichara C, Ulm F-J, Pellenq RJean-Marc.  2016.  Fracture toughness anomalies: Viewpoint of topological constraint theory. Acta Materialia. 121:234-239.
Akono A-T, Ulm F-J.  2012.  Fracture scaling relations for scratch tests of axisymmetric shape. Journal of the Mechanics and Physics of Solids. 60(3):379-390.
Zabat M., Harba R., Van Damme H.  2015.  Fractal analysis of surface roughness of montmorillonite clay self-supported films: Effects of exchanged cations and of mechanical tensile stress. Colloids and Surfaces A: Physicochemical and Engineering Aspects. 486:38-44.
Azéma E, Radjaï F.  2012.  Force chains and contact network topology in sheared packings of elongated particles. Physical Review E. 85(3):ArticleNumber:031303Part:1.
Louhghalam A, Akbarian M, Ulm F-J.  2014.  Flügge’s Conjecture: Dissipation- versus Deflection-Induced Pavement–Vehicle Interactions. Journal of Engineering Mechanics. 140(8):ArticleNumber:04014053.
Dezerald L, Proville L., Ventelon L, Willaime F., Rodney D..  2015.  First-principles prediction of kink-pair activation enthalpy on screw dislocations in bcc transition metals: V, Nb, Ta, Mo, W, and Fe. Physical Review B. 91(9):ArticleNumber094105.
Celino M., Le Roux S., Ori G, Coasne BA, Bouzid A., Boero M., Massobrio C.  2013.  First-principles molecular dynamics study of glassy GeS2: Atomic structure and bonding properties. Physical Review B. 88
Ronceray P, Broedersz CP, Lenz M.  2019.  Fiber plucking by molecular motors yields large emergent contractility in stiff biopolymer networks. Soft Matter. 15(7):1481-1487.
Radjaï F, Delenne J-Y, Azéma E, Roux S.  2012.  Fabric evolution and accessible geometrical states in granular materials. Granular Matter. 14( 2 SI):259-264.
Akono A-T, Randall NX, Ulm F-J.  2012.  Experimental determination of the fracture toughness via microscratch tests: Application to polymers, ceramics, and metals. Journal of Materials Research. 27(2):485-493.
Hoover CG, Ulm F-J.  2015.  Experimental chemo-mechanics of early-age fracture properties of cement paste. Cement and Concrete Research. 75:42-52.
Osetsky N., Béland LKarim, Barashev AV, Zhang Y.  2018.  On the existence and origin of sluggish diffusion in chemically disordered concentrated alloys. Current Opinion in Solid State and Materials Science. 22(3):65-74.
Berthonneau J, Grauby O, Abuhaikal M, Pellenq RJean-Marc, Ulm F-J, Van Damme H.  2016.  Evolution of organo-clay composites with respect to thermal maturity in type II organic-rich source rocks. Geochimica et Cosmochimica Acta. 195:68-83.
Qomi M J A, Ulm F-J, Pellenq RJean-Marc.  2012.  Evidence on the Dual Nature of Aluminum in the Calcium-Silicate-Hydrates Based on Atomistic Simulations. Journal of the American Ceramic Society. 95(3):1128–1137.

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