Publications related to Uranium dioxide

Atomic level insight into irradiation effects in nuclear fuel materials

Microstructural evolution during in-pile irradiation, radiation damage effects and fission products behavior in UO2 nuclear fuel are key issues in understanding and for the modeling of the performance as well as safety characteristics of nuclear fuels in t ...

EPFL2024

Implementing Multi-Electron Transfer Strategies in Uranium Chemistry

Dieuwertje Katelijn Modder

In the last decades, the activation of small molecules has attracted increasing attention for their use as cheap and abundant feedstock. Low-oxidation state uranium complexes have displayed high reactivity towards small molecules thanks to their unique pro ...

EPFL2023

Spatial Series and Fractal Analysis Associated with Fracture Behaviour of UO2 Ceramic Material

Maria-Alexandra Paun

SEM micrographs of the fracture surface for UO2 ceramic materials have been analysed. In this paper, we introduce some algorithms and develop a computer application based on the time-series method. Utilizing the embedding technique of phase space, the attr ...

MDPI2022

Multi-electron Transfer by U(II) and Masked U(II) Complexes

Marinella Mazzanti

Complexes of uranium in low oxidation state have shown the ability to activate non-reactive small molecules such as N-2. However, the multi-electron transfer required for such activation remains limited in uranium chemistry. Here, we review our recent rese ...

SWISS CHEMICAL SOC2022

Systematic investigations of uranium carbide composites oxidation from micro- to nano-scale: Application to waste disposal

Nhât-Tân Vuong

The production of radioisotope beams at the ISOLDE (Isotope Separator OnLine DEvice) facility at CERN is achieved by irradiating target materials (e.g. uranium carbides and metal foils) with protons. The materials are usually operated at temperatures above ...

EPFL2021

Design, synthesis, reactivity, and magnetic properties of uranium based oxide and nitride complexes

Luciano Barluzzi

The activation of small molecules is a paramount challenge in modern chemistry. The use of cheap and abundant molecules such as N2, H2, CO2, or CO as energy supplies or as precursors for fine chemicals production is highly desirable. In particular, the onl ...

EPFL2021

Preliminary design and analysis of Liquid Fuel Molten Salt Reactor using multi-physics code GeN-Foam

Carlo Fiorina

In this study, a hypothetical fast spectrum Liquid Fuel Molten Salt Reactor (LFMSR) core is modeled using the multiphysics C++ code GeN-Foam (General Nuclear Foam). GeN-Foam is based on OpenFOAM, a C++ opensource library for solution of continuum mechanics ...

ELSEVIER SCIENCE SA2020

Hydrogenation of ZnFe2O4 Flat Films: Effects of the Pre-Annealing Temperature on the Photoanodes Efficiency for Water Oxidation

Kevin Sivula, Charles Roger Jean Lhermitte, Annalisa Polo

The effects induced by post-synthesis hydrogenation on ZnFe2O4 flat films in terms of photoelectrochemical (PEC) performance of photoanodes for water oxidation have been deeply investigated as a function of the pre-annealing temperature of the materials. T ...

2020

Small Molecule Activation by Multimetallic Uranium Complexes

Marta Falcone

The development of new processes for the selective and sustainable transformation of abundant small molecules constitutes one of the major research areas in inorganic and organometallic chemistry. These molecules as CO2, CO, N2 and H2 are abundant reservoi ...

EPFL2019

The effect of iron binding on uranyl(V) stability

Rosario Scopelliti, Marinella Mazzanti, Radmila Faizova

Here we report the effect of UO2+⋯Fe2+ cation–cation interactions on the redox properties of uranyl(V) complexes and on their stability with respect to proton induced disproportionation. The tripodal heptadentate Schiff base trensal3− ligand allowed the sy ...

2018

Microbial communities associated with uranium in-situ recovery mining process are related to acid mine drainage assemblages

Rizlan Bernier-Latmani, Pierre Rossi, Luiz Felippe De Alencastro, Thomas Coral

A large fraction (47%) of the world's uranium is mined by a technique called “In Situ Recovery” (ISR). This mining technique involves the injection of a leaching fluid (acidic or alkaline) into a uranium-bearing aquifer and the pumping of the resulting sol ...

2018

First-principles calculations of momentum distributions of annihilating electron-positron pairs in defects in UO2

Julia Anna Wiktor

We performed first-principles calculations of the momentum distributions of annihilating electron-positron pairs in vacancies in uranium dioxide. Full atomic relaxation effects (due to both electronic and positronic forces) were taken into account and self ...

Iop Publishing Ltd2017

Nitrogen reduction and functionalization by a multimetallic uranium nitride complex

Rosario Scopelliti, Marinella Mazzanti, Lucile Sylvie Danielle Chatelain, Ivica Zivkovic, Marta Falcone

Molecular nitrogen (N-2) is cheap and widely available, but its unreactive nature is a challenge when attempting to functionalize it under mild conditions with other widely available substrates (such as carbon monoxide, CO) to produce value-added compounds ...

2017

Modelling of fuel fragmentation, relocation and dispersal during Loss-of-Coolant Accident in Light Water Reactor

Vladimir Vladimirov Brankov

Recent LOCA tests with high burnup fuel at the OECD Halden Reactor Project and at Studsvik demonstrated the susceptibility of the fuel to fragment to small pieces, to relocate and possibly cause a hot-spot effect and to be dispersed in the event of claddin ...

EPFL2017

Facile CO Cleavage by a Multimetallic CsU2 Nitride Complex

Rosario Scopelliti, Marinella Mazzanti, Marta Falcone

Uranium nitrides are important materials with potential for application as fuels for nuclear power generation, and as highly active catalysts. Molecular nitride compounds could provide important insight into the nature of the uranium–nitride bond, but curr ...

Wiley-VCH Verlag GmbH2016

Products of in situ corrosion of depleted uranium ammunition in Bosnia and Herzegovina soils

Rizlan Bernier-Latmani, Barbora Bártová, Yuheng Wang, Konstantin von Gunten

Hundreds of tons of depleted uranium (DU) ammunition were used in previous armed conflicts in Iraq, Bosnia and Herzegovina, and Serbia/Kosovo. The majority (>90%) of DU penetrators miss their target and, if left in the environment, corrode in these postcon ...

Amer Chemical Soc2016

Process-induced strains in RTM processing of polyurethane/carbon composites

Véronique Michaud, Luis Pablo Canal Casado, Michael Hausmann, Maria Benavente Miana

The development of residual strains and stresses is critical to manufacture composite structures with the required dimensional stability and mechanical performance. This work uses Fiber Bragg Grating (FBG) sensors to monitor strain build-up in carbon fiber ...

Elsevier2015

Heterometallic Fe-2(II)-U-V and Ni-2(II)-U-V Exchange-Coupled Single-Molecule Magnets: Effect of the 3d Ion on the Magnetic Properties

Marinella Mazzanti, Lucile Sylvie Danielle Chatelain

Uranium-based compounds have been put forward as ideal candidates for the design of single-molecule magnets (SMMs) with improved properties, but to date, only two examples of exchange-coupled 3d-5f SMM containing uranium have been reported and both are bas ...

Wiley-Blackwell2015

Investigation of the water exchange mechanism of the Plutonyl(VI) and Uranyl(VI) ions with quantum chemical methods

François Rotzinger, Antonio Prlj

The water exchange reactions of PuO2(OH2)(5) and UO2(OH2)(5) were investigated with density functional theory (DFT) and wave function theory (WFT). Geometries and vibrational frequencies were calculated with DFT and CPCM hydration. The electron ...

Taylor & Francis2015

Self-Assembly of a 3d-5f Trinuclear Single-Molecule Magnet from a Pentavalent Uranyl Complex

Marinella Mazzanti, Lucile Sylvie Danielle Chatelain

Mixed-metal uranium compounds are very attractive candidates in the design of single-molecule magnets (SMMs), but only one 3d-5f hetero-polymetallic SMM containing a uranium center is known. Herein, we report two trimeric heterodimetallic 3d-5f complexes s ...

Wiley-VCH Verlag GmbH2014