Confined Water Dissociation in Microporous Defective Silicates: Mechanism, Dipole Distribution, and Impact on Substrate Properties von Manzano, Hegoi, Moeini, Sina, Marinelli, Francis, van Duin, Adri C. T, Ulm, Franz-Josef, Pellenq, Roland J.-M

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Adsorption, intrusion and freezing in porous silica: the view from the nanoscale von Coasne, Benoit, Galarneau, Anne, Pellenq, Roland J M, Di Renzo, Francesco

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Empirical force fields for complex hydrated calcio-silicate layered materials von SHAHSAVARI, Rouzbeh, PELLENQ, Roland J.-M, ULM, Franz-Josef

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Adsorption-Induced Deformation of Microporous Materials: Coal Swelling Induced by CO2–CH4 Competitive Adsorption von Brochard, Laurent, Vandamme, Matthieu, Pellenq, Roland J.-M., Fen-Chong, Teddy

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realistic molecular model of cement hydrates von Pellenq, Roland J.-M, Kushima, Akihiro, Shahsavari, Rouzbeh, Van Vliet, Krystyn J, Buehler, Markus J, Yip, Sidney, Ulm, Franz-Josef

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Realistic molecular model of kerogen’s nanostructure von Bousige, Colin, Ghimbeu, Camélia Matei, Vix-Guterl, Cathie, Pomerantz, Andrew E., Suleimenova, Assiya, Vaughan, Gavin, Garbarino, Gaston, Feygenson, Mikhail, Wildgruber, Christoph, Ulm, Franz-Josef, Pellenq, Roland J.-M., Coasne, Benoit

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Glassy Nature of Water in an Ultraconfining Disordered Material: The Case of Calcium−Silicate−Hydrate von Youssef, Mostafa, Pellenq, Roland J.-M, Yildiz, Bilge

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Potential of Mean Force for Face–Face Interactions between Pairs of 2:1 Clay Mineral Platelets von Zhu, Hejian, Whittle, Andrew J., Pellenq, Roland J.-M.

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Mesoscale texture of cement hydrates von Ioannidou, Katerina, Krakowiak, Konrad J., Bauchy, Mathieu, Hoover, Christian G., Masoero, Enrico, Yip, Sidney, Ulm, Franz-Josef, Levitz, Pierre, Pellenq, Roland J.-M., Del Gado, Emanuela

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Controlling local packing and growth in calcium-silicate-hydrate gels von Ioannidou, Katerina, Pellenq, Roland J.-M, Del Gado, Emanuela

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Nanoscale Elastic Properties of Montmorillonite upon Water Adsorption von Ebrahimi, Davoud, Pellenq, Roland J.-M, Whittle, Andrew J

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Rigidity transition in materials: hardness is driven by weak atomic constraints von Bauchy, Mathieu, Qomi, Mohammad Javad Abdolhosseini, Bichara, Christophe, Ulm, Franz-Josef, Pellenq, Roland J-M

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How chemical defects influence the charging of nanoporous carbon supercapacitors von Dupuis, Romain, Valdenaire, Pierre-Louis, Pellenq, Roland J.-M., Ioannidou, Katerina

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Evidence on the Dual Nature of Aluminum in the Calcium-Silicate-Hydrates Based on Atomistic Simulations von Abdolhosseini Qomi, Mohammad Javad, Ulm, Franz-Josef, Pellenq, Roland J.-M.

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Capillary Stress and Structural Relaxation in Moist Granular Materials von Zhou, Tingtao, Ioannidou, Katerina, Masoero, Enrico, Mirzadeh, Mohammad, Pellenq, Roland J.-M, Bazant, Martin Z

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Staggered structural dynamic-mediated selective adsorption of H2O/D2O on flexible graphene oxide nanosheets von Futamura, Ryusuke, Iiyama, Taku, Ueda, Takahiro, Bonnaud, Patrick A., Coudert, François-Xavier, Furuse, Ayumi, Tanaka, Hideki, Pellenq, Roland J. -M., Kaneko, Katsumi

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Elastic Properties of Swelling Clay Particles at Finite Temperature upon Hydration von Carrier, Benoit, Vandamme, Matthieu, Pellenq, Roland J.-M, Van Damme, Henri

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Anomalous composition-dependent dynamics of nanoconfined water in the interlayer of disordered calcium-silicates von Qomi, Mohammad Javad Abdolhosseini, Bauchy, Mathieu, Ulm, Franz-Josef, Pellenq, Roland J-M

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Pressure and temperature diagram of C60 from atomistic simulations von Hakim, Karim, Dupuis, Romain, Bichara, Christophe, Pellenq, Roland J.-M.

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Methane Diffusion in a Flexible Kerogen Matrix von Obliger, Amaël, Valdenaire, Pierre-Louis, Ulm, Franz-Josef, Pellenq, Roland J.-M, Leyssale, Jean-Marc

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