A modelling exercise on the importance of ternary alkaline earth carbonate species of uranium(VI) in the inorganic speciation of natural waters

International audiencePredictive modelling of uranium speciation in natural waters can be achieved using equilibrium thermodynamic data and adequate speciation software. The reliability of such calculations is highly dependent on the equilibrium reactions that are considered as entry data, and the values chosen for the equilibrium constants. The working group " Speciation " of the CETAMA (Analytical methods establishment committee of the French Atomic Energy commission, CEA) has organized a modelling exercise, including four participants, in order to compare modellers' selections of data and test thermodynamic data bases regarding the calculation of U(VI) inorganic speciation. Six different compositions of model waters were chosen so that to check the importance of ternary alkaline earth carbonate species of U(VI) on the aqueous speciation, and the possible uranium solid phases as solubility-limiting phases. The comparison of the results from the participants suggests i) that it would be highly valuable for end-users to review thermodynamic constants of ternary carbonate species of U(VI) in a consistent way and implement them in available speciation data bases, and ii) stresses the necessary care when using data bases to avoid biases and possible erroneous calculations

Review of Actinide Decorporation with Chelating Agents

International audienceIn case of accidental release of radionuclides in a nuclear facility or in the environment, internal contamination (inhalation, in-gestion or wound) with actinides represents a severe health risk to human beings. It is therefore important to provide effective che-lation therapy or decorporation to reduce acute radiation damage, chemical toxicity, and late radiation effects. Speciation governs bioavailability and toxicity of elements and it is a prerequisite tool for the design and success of new ligands or chelating agents. The purpose of this review is to present the state-of-the-art of actinide decorporation within biological media, to recall briefly actinide metabolism, to list the basic constraints of actinideeligand for development, to describe main tools developed and used for decorporation studies, to review mainly the chelating agents tested for actinides, and finally to conclude on the future trends in this field. To cite this article: E ´. Ansoborlo et al., C. R. Chimie X 33 (2007). Ó 2007 Académie des sciences. Published by Elsevier Masson SAS. All rights reserved.En cas de rejet accidentel de radionucléides dans une installation nucléaire ou dans l'environnement, il existe un risque de contamination interne (inhalation, ingestion ou blessure) pour l'homme et il est important de pouvoir fournir un traitement thérapeutique par des agents chélatants ou décorporation permettant de réduire la dose, la toxicité chimique et les effets retardés des radiations.La spéciation domine la biodisponibilité et la toxicité des éléments et représente un outil indispensable pour la conception et l'efficacité de nouveaux ligands ou chélatants. Le but de cet article est de présenter l'état de l'art sur la décorporation des actinides en milieu biologique, de rappeler les grandes lignes du métabolisme des actinides, de lister les contraintes indispensables actinide–ligands pour la décorporation, de décrire succinctement les principaux outils expérimentaux ou analytiques utilisés, de passer en revue les principaux ligands testés pour les actinides et de présenter les orientations du futur dans ce domaine

Plutonium in the environment: key factors related to impact assessment in case of an accidental atmospheric release

International audienceThis paper deals with plutonium and key factors related to impact assessment. It is based on recent work performed by CEA which summarize the main features of plutonium behaviour from sources inside installations to the environment and man, and to report current knowledge on the different parameters used in models for environmental and radiological impact assessment. These key factors are illustrated through a case study based on an accidental atmospheric release of Pu in a nuclear facility

Hidden magnetic order in plutonium dioxide nuclear fuel

A thorough understanding of the chemistry of PuO2 is critical to the design of next-generation nuclear fuels and the long-term storage of nuclear materials. Despite over 75 years of study, the ground-state magnetic structure of PuO2 remains a matter of much debate. Experimental studies loosely indicate a diamagnetic (DM) ground-state, whereas theoretical methods have proposed either a collinear ferromagnetic (FM) or anti-ferromagnetic (AFM) ground-state, both of which would be expected to cause a distortion from the reported Fm[3 with combining macron]m symmetry. In this work, we have used accurate calculations based on the density functional theory (DFT) to systematically investigate the magnetic structure of PuO2 to resolve this controversy. We have explicitly considered electron-correlation, spin–orbit interaction and noncollinear magnetic contributions to identify a hereto unknown longitudinal 3k AFM ground-state that retains Fm[3 with combining macron]m crystal symmetry. Given the broad interest in plutonium materials and the inherent experimental difficulties of handling this compound, the results presented in this paper have considerable implications for future computational studies relating to PuO2 and related actinide structures. As the crystal structure is coupled by spin–orbit interactions to the magnetic state, it is imperative to consider relativity when creating computational models

Bayonne, porte de la Péninsule Iberique (1795-1808)

I La dissolution de l’Armée des Pyrénées-Occidentales et la ventilation de ses unités avaient suivi de près la signature de la paix de Bâle. Un repli rapide en France avait été promis au gouvernement espagnol et en outre les autres armées françaises avaient des besoins urgents. Après les trois divisions affectées à l’Armée de l’Ouest en Vendée, la plupart des unités partirent successivement et Moncey qui, en raison de son état de santé, avait obtenu sur place le commandement de la 11e divisio..