Recherche
Résultats 21-30 de 98
-
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...) -
Combining DMRG with standard relativistic multireference methods to probe the properties of plutonium oxide molecules
AVS 64th International Symposium, Tampa, Florida, 31-10-2017, 31-10-2017 -
Investigation of thermodynamics properties of gaseous plutonium oxides through a deep dive into electronic structure
10th International Conference on f-Elements (ICFE-10), Lausanne, 03-09-2018, 03-09-2018 -
Probing the bonding in dimers of tetravalent Cerium and actinide homologues
28th Rare Earth Research Conference, Ames, Iowa, 18-06-2017, 18-06-2017Communication dans un congrès avec actes -
Thermodynamic Properties of Gaseous Ruthenium Species
Journal of Physical Chemistry. Part A, 04-2015, 119 (20), 4961-4971Article dans une revue scientifique -
Exploring the dynamic and thermodynamic properties of halides through molecular dynamics simulations
Journées de la solvatation, Lille, 08-10-2018, 08-10-2018Communication dans un congrès avec actes -
Accessing Properties of Large Actinide systems with Frozen-Density Embedding
Pacifichem, The International Chemical Congress of Pacific Basin Societies, Honolulu, Hawaii, 14-12-2015, 14-12-2015 -
Alkali–metal ion coordination in uranyl(VI) poly-peroxo complexes in solution, inorganic analogues to crown-ethers. Part 2. Complex formation in the tetramethyl ammonium-, Li<sup>+</sup>-, Na<sup>+</sup>- and K<sup>+</sup>-uranyl(VI)–peroxide–carbonate systems
Dalton Transactions, Royal Society of Chemistry, 10-08-2015, 44, 16565-16572Compte-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 -
Modelling of ruthenium chemistry in case of severe accidents occurring to a nuclear power plant
RCTF2014 14ème Rencontre des Chimistes Théoriciens Francophones, Paris, 30-06-2014, 30-06-2014Autre communication scientifique (congrès sans actes - poster - séminaire...)