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Mineral-fluid interactions on the molecular scale: Computational atomistic modeling of clay-related materials for geochemical and environmental applications
Kalinichev A. G.
Invited seminar at the Institute of Geological Sciences, Polish Academy of Sciences, Pologne (2012) [in2p3-00769160 - version 1]
Molecular Modeling of the Swelling Properties and Interlayer Structure of Cs, and K-Montmorillonites: Effects of Charge Distribution in the Clay Layers
Ngouana Wakou B. F., Kalinichev A. G.
XIIIe journées nationale de radiochimie et de chimie nucléaire, France (2012) [in2p3-00769157 - version 1]
Molecular Dynamics Simuation of Cs+ on the Hydrated Muscovite Surface: Local Structural Environment and Dynamics
Narasimhan L., Kalinichev A. G.
XIIIe journées nationale de radiochimie et de chimie nucléaire, France (2012) [in2p3-00769158 - version 1]
Computational molecular modeling of mineral-water interfaces for geochemical and environmental applications (invited lecture)
Kalinichev A. G.
VIII International School of Earth's Sciences I.S.E.S., Ukraine (2012) [in2p3-00769187 - version 1]
Structure and Energetics of Smectite Interlayer Hydration: Molecular Dynamics Investigations of Na- and Ca Hectorite
Morrow C. P., Yazaydin A. O., Bowers G. M., Kalinichev A. G., Kirkpatrick R. J.
Symposium 8g: Structure and dynamics of ions and water at mineral-water interfaces: insights from experimental and computational studies, 2012 Goldschmidt Conference, Canada (2012) [in2p3-00769208 - version 1]
fulltext access Parallel Spherical Harmonic Transforms on heterogeneous architectures (GPUs/multi-core CPUs)
Szydlarski M., Esterie P., Falcou J., Grigori L., Stompor R.
Research report (2012) 31 [inria-00597576 - version 2]
Molecular structure and dynamics of nano-confined aqueous solutions: Computer simulations of clay, cement, and polymer membranes
Kalinichev A. G.
NATO Advanced Research Workshop on the Physical Chemistry of Capillary and Bound/Confined Liquids, Israel (2012) [in2p3-00769209 - version 1]
Micro-scale in situ characterisation of the organic and mineral composition of modern, hypersaline, photosynthetic microbial mats
Gautret P., Ramboz C., De Wit R., Delarue F., Orange F. et al
EGU General Assembly, Autriche (2012) [insu-00840595 - version 1]
Structure of Puy de Dôme volcano (Chaîne des Puys, France): towards a revised model
Miallier D., Boivin P., Deniel C., Gourgaud A.
International Workshop on "Muon and Neutrino Radiography 2012", France (2012) [in2p3-00770756 - version 1]
Computational molecular modeling for nuclear waste management and other radiochemical applications (invited talk)
Kalinichev A. G., Narasimhan L., Ngouana Wakou B. F.
Journée GRIM3 2012, Groupe de Recherche Interdisciplinaire sur les Matériaux, les Molécules et la Matière, France (2012) [in2p3-00769210 - version 1]