Publications

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Filters: Author is Roland Jean-Marc Pellenq  [Clear All Filters]
2011
Jelea A, Colbert M., Ribeiro F., Tréglia G., Pellenq RJean-Marc.  2011.  An atomistic modelling of the porosity impact on UO2 matrix macroscopic properties. Journal of Nuclear Materials. 415(2):210-216.
Ho LNgoc, Pellitero JPerez, Porcheron F, Pellenq RJean-Marc.  2011.  Enhanced CO2 Solubility in Hybrid MCM-41: Molecular Simulations and Experiments. Langmuir. 27(13):8187-8197.
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.
Manzano H, Durgun E, Qomi M J A, Ulm F-J, Pellenq RJean-Marc, Grossman JC.  2011.  Impact of Chemical Impurities on the Crystalline Cement Clinker Phases Determined by Atomistic Simulations. Crystal Growth & Design. 11(7):2964-2972.
Los J.H, Pellenq RJean-Marc.  2011.  Reply to “Comment on ‘Determination of the bulk melting temperature of nickel using Monte Carlo simulations: Inaccuracy of extrapolation from cluster melting temperatures' ”. Physical Review B. 84(9):ArticleNumber:096103.
Pellenq RJean-Marc, Whittle AJ, Ebrahimi D.  2011.  Springer Series in Geomechanics and Geoengineering Multiscale and Multiphysics Processes in Geomechanics SIMULATION OF HYDRATION AND ELASTIC PROPERTIES OF MONTMORILLONITE USING MOLECULAR DYNAMICS. International Workshop on Multiscale and Multiphysics Processes in Geomechanics. Springer Series in Geomechanics and Geoengineering:105-108.
Los J.H, Bichara C, Pellenq RJean-Marc.  2011.  Tight binding within the fourth moment approximation: Efficient implementation and application to liquid Ni droplet diffusion on graphene. Physical Review B. 84(8):ArticleNumber:085455.
2010
Shahsavari R, Pellenq RJean-Marc, Ulm F-J.  2010.  Empirical force fields for complex hydrated calcio-silicate layered materials. Phys. Chem. Chem. Phys.. 13(3):1002-1011.

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