Recherche
Résultats 1-10 de 22
-
A consistent molecular model to predict the behavior of early tetravalent actinides in aqueous solution: from thorium to plutonium
JTMS17 "Journées Théorie, Modélisation et Simulation 2017", Paris, 01-06-2017, 01-06-2017 -
Structural, dynamical, and transport properties of the hydrated halides: How do At<sup>-</sup> bulk properties compare with those of the other halides, from F<sup>-</sup> to I<sup>-</sup>?
The Journal of Chemical Physics, American Institute of Physics, 28-03-2016, 144, 124513Compte-rendu et recension critique d'ouvrage -
Revealing the Hydration of Thorium(IV) With Combined Techniques Involving EXAFS, HEXS and Molecular Dynamics Simulations
249th ACS National Meeting, Denver, 13-03-2015, 13-10-2015 -
Revealing the Hydration of the Cm<sup>3+</sup> Ion With Combined Techniques Involving EXAFS, HEXS and Molecular Dynamics Simulations
APS workshop: Combining Experiments and Theory in f-Element Research, Argonne, 08-05-2013 -
Revisiting a many-body model for water based on a single polarizable site: From gas phase clusters to liquid and air/liquid water systems
The Journal of Chemical Physics, American Institute of Physics, 18-09-2013, 139, 114502Compte-rendu et recension critique d'ouvrage -
Development and application of a polarizable force-field for halides counter anions and lanthanides cations in aqueous solution
International Meeting on Atomic and Molecular Physics and Chemistry, Lille, 02-07-2013, 02-07-2013Autre communication scientifique (congrès sans actes - poster - séminaire...) -
Macroscopic modeling: insights in the ability of classical non-additive potentials to model radionucleides in aqueous solution
Advanced Techniques in Actinide Spectroscopy (ATAS), Dresden, 05-11-2012, 05-11-2012Autre communication scientifique (congrès sans actes - poster - séminaire...) -
Macroscopic modeling: insights in the ability of classical non-additive potentials to model radionucleides in aqueous solution
14th ICQC (International Conference of Quantum Chemistry), Boulder, 25-06-2012, 25-06-2012Autre communication scientifique (congrès sans actes - poster - séminaire...) -
How to build accurate macroscopic modesls of actinide ions in aqueous solutions?
Joint International Conference on Supercomputing in Nuclear Applications + Monte Carlo, Paris, 27-10-2013, 30-10-2013 -
Further insights in the ability of classical nonadditive potentials to model actinide ion-water interactions
Journal of Computational Chemistry, Wiley, 05-04-2013, 34, 707-719Compte-rendu et recension critique d'ouvragetexte intégral