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Thermochemistry of Ruthenium Oxyhydroxide Species and Their Impact on Volatile Speciations in Severe Nuclear Accident Conditions
Journal of Physical Chemistry A, American Chemical Society, 20-01-2016, 120, 606-614Compte-rendu et recension critique d'ouvrage -
Investigation of the spectroscopic and thermodynamics properties of gaseous plutonium oxides
Workshop Excited States Simulations: Bridging Scales, Marseille, 07-11-2016, 07-11-2016Autre communication scientifique (congrès sans actes - poster - séminaire...) -
Thermodynamic Properties of Gaseous Ruthenium Species
Journal of Physical Chemistry A, American Chemical Society, 23-04-2015, 119, 4961--4971Compte-rendu et recension critique d'ouvrage -
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...) -
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 -
Can Quantum Chemical Methods be Used to Predict Gibbs Energies for Reactions in Solution? A Case Study Using Binary and Ternary Lanthanide(III) and Actinide(III) - Tris[4,4,4-trifluoro-1-(2-thienyl)-1,3-butanedione] (TTA) - Tributyl/Trimethyl phosphate (TBP/TMP) Complexes.
SOLVENT EXTRACTION AND ION EXCHANGE, Taylor & Francis, 24-07-2013, 31, 358-369Compte-rendu et recension critique d'ouvrage -
Towards systematically improvable models for actinides in condensed phase: the electronic spectrum of uranyl in Cs2UO2Cl4 as a test case.
Physical Chemistry Chemical Physics, Royal Society of Chemistry, 21-08-2013, 15; 36, 15153-62Compte-rendu et recension critique d'ouvrage -
Structure and Dynamics of Binary and Ternary Lanthanide(III) and Actinide(III) - Tris[4,4,4-trifluoro-1-(2-thienyl)-1,3-butanedione] (TTA) -- Tributylphosphate (TBP) Complexes. Part 3, The Structure and Thermodynamics of 8- and 9-Coordinated Binary and Ternary Y - TTA Complexes Studied by Quantum Chemical Methods
Dalton, 21-02-2011, 40, 3154--3165Compte-rendu et recension critique d'ouvrage -
How to probe the electronic structure of heavy element complexes?
International Meeting on Atomic and Molecular Physics and Chemistry 2011, Rennes, 01-07-2011, 01-07-2011 -
Investigation of thermodynamics properties of gaseous plutonium oxides through a deep dive into electronic structure
Strasbourg satellite meeting to the 16th ICQC: Strong correlation in electronic structure theory, Strasbourg, 24-06-2018, 24-06-2018