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439 Documents classés par : 
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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]
An off-line method to characterize the fission product release from uranium carbide-target prototypes developed for SPIRAL2 project
Hy B., Barré-Boscher N., Roussiere B., Tusseau-Nenez S., Lau C. et al
Nuclear Instruments and Methods in Physics Research Section B: Beam Interactions with Materials and Atoms 288 (2012) 34-41 [hal-00816939 - version 1]
Is nitrogen functionality responsible for contrasted responses of riverine dissolved organic matter in pyrolysis?
Templier J., Miserque F., Barre N., Mercier F., Croué J.P. et al
Journal of Analytical and Applied Pyrolysis 97 (2012) 62-72 [hal-00832407 - 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]
fulltext access Influence of mesostructuration on the reactivity of bioactive glasses in biological medium: a PIXE-RBS study
Soulié J., Lao J., Jallot E., Nedelec J.-M.
Journal of Materials Chemistry 22, 38 (2012) 20680 - 20688 [hal-00731072 - version 1]
fulltext access Etude thermodynamique de la sorption de l'uranyle sur la monazite et la magnétite
Felix O.
Université Paris Sud - Paris XI (10/07/2012), Romuald Drot (Dir.) [tel-00737326 - version 1]
STAR - Dépôt national des thèses électroniques
fulltext access Modélisation de l'interaction de l'ion uranyle à l'interface eau/gibbsite par la dynamique moléculaire quantique et classique
Lectez S.
Université Paris Sud - Paris XI (03/07/2012), Eric Simoni (Dir.) [tel-00727757 - version 1]
STAR - Dépôt national des thèses électroniques
DFT study of the fragmentation mechanism of uracil RNA base.
Arani L. S., Mignon P., Abdoul-Carime H., Farizon B., Farizon M. et al
Physical Chemistry Chemical Physics 14, 28 (2012) 9855-9870 [hal-00877324 - version 1]
(87)Sr solid-state NMR as a structurally sensitive tool for the investigation of materials: antiosteoporotic pharmaceuticals and bioactive glasses.
Bonhomme C., Gervais C., Folliet N., Pourpoint F. Pourpoin@ccr.Jussieu.Fr, Coelho Diogo C. et al
Journal of the American Chemical Society 134, 30 (2012) 12611-12628 [hal-00726394 - 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]