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Atomic-scale insights into stability and oxygen diffusion in uranium oxynitride UN1-xOx

https://doi.org/10.2139/ssrn.6963661
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Outgoing claims: the papers this work cites, builds on, or argues with.

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The Chemistry of the Actinide and Transactinide Elements
inferredcites →https://doi.org/10.1016/0022-3115(72)90002-5openalex-snapshot
The uranium-plutonium-carbon-oxygen systems
inferredcites →https://doi.org/10.1016/0022-3115(75)90049-5openalex-snapshot
Investigations on uranium carbonitrides (I)
inferredcites →https://doi.org/10.1016/0022-3115(79)90457-4openalex-snapshot
Lattice parameter of uranium mononitride
inferredcites →https://doi.org/10.1016/0022-3115(93)90394-eopenalex-snapshot
Experimental evaluation of oxygen solubility in UN, PuN and (U, Pu) N
inferredcites →https://doi.org/10.1016/0022-5088(59)90030-xopenalex-snapshot
The uranium monocarbide-uranium mononitride system
inferredcites →https://doi.org/10.1016/0022-5088(72)90186-5openalex-snapshot
Oxygen solubility in uranium mononitride phase
inferredcites →https://doi.org/10.1016/0039-6028(86)90028-2openalex-snapshot
On the stability of sub-stoichiometric uranium oxides
inferredcites →https://doi.org/10.1016/0927-0256(96)00008-0openalex-snapshot
Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set
inferredcites →https://doi.org/10.1016/j.apsusc.2012.11.018openalex-snapshot
Structural analysis of nitride layer formed on uranium metal by glow plasma surface nitriding
inferredcites →https://doi.org/10.1016/j.apsusc.2013.04.147openalex-snapshot
Initial oxidation behaviors of nitride surfaces of uranium by XPS analysis
inferredcites →https://doi.org/10.1016/j.apsusc.2018.02.271openalex-snapshot
Electronic structure and fine structural features of the air-grown UNxOy on nitrogen-rich uranium nitride
inferredcites →https://doi.org/10.1016/j.apsusc.2019.144229openalex-snapshot
The microstructure and oxidation behavior of the N-doped modified layers on uranium surface prepared by pulsed laser irradiating
inferredcites →https://doi.org/10.1016/j.calphad.2013.06.006openalex-snapshot
Efficient stochastic generation of special quasirandom structures
inferredcites →https://doi.org/10.1016/j.corsci.2018.03.002openalex-snapshot
A review of uranium corrosion by hydrogen and the formation of uranium hydride
inferredcites →https://doi.org/10.1016/j.jallcom.2003.11.121openalex-snapshot
Photoemission study of UNxOy and UCxOy in thin films
inferredcites →https://doi.org/10.1016/j.jallcom.2007.05.028openalex-snapshot
The interaction of uranium metal with nitrogen oxides: The formation of an oxynitride surface layer
inferredcites →https://doi.org/10.1016/j.jallcom.2014.09.052openalex-snapshot
UN2−x layer formed on uranium metal by glow plasma nitriding
inferredcites →https://doi.org/10.1016/j.jallcom.2018.05.187openalex-snapshot
Oxidation kinetics of nitrided uranium determined by ultraviolet–visible reflectance spectroscopy
inferredcites →https://doi.org/10.1016/j.jnucmat.2008.04.015openalex-snapshot
First principles modelling of oxygen impurities in UN nuclear fuels
inferredcites →https://doi.org/10.1016/j.jnucmat.2009.06.016openalex-snapshot
Implementing first principles calculations of defect migration in a fuel performance code for UN simulations
inferredcites →https://doi.org/10.1016/j.jnucmat.2016.08.025openalex-snapshot
The initial oxidation behaviors of uranium nitride UNx (x = 0, 0.23, 0.68, 1.66) films
inferredcites →https://doi.org/10.1016/j.jnucmat.2018.01.020openalex-snapshot
Extended study on oxidation behaviors of UN0.68 and UN1.66 by XPS
inferredcites →https://doi.org/10.1016/j.jnucmat.2021.153048openalex-snapshot
Challenges and opportunities to alloyed and composite fuel architectures to mitigate high uranium density fuel oxidation: Uranium mononitride
inferredcites →https://doi.org/10.1016/j.jnucmat.2021.153401openalex-snapshot
First-principles investigation of uranium mononitride (UN): Effect of magnetic ordering, spin-orbit interactions and exchange correlation functional
inferredcites →https://doi.org/10.1016/j.surfcoat.2018.10.093openalex-snapshot
Oxidation kinetics of uranium treated by pulsed laser nitriding in air
inferredcites →https://doi.org/10.1016/j.surfcoat.2019.124921openalex-snapshot
Preparation of UNx by laser nitriding and its corrosion performance
inferredcites →https://doi.org/10.1016/s0022-3115(00)00335-4openalex-snapshot
Passivation of uranium towards air corrosion by N2+ and C+ ion implantation
inferredcites →https://doi.org/10.1016/s0022-3115(02)00878-4openalex-snapshot
Thermodynamic assessment of the uranium–oxygen system
inferredcites →https://doi.org/10.1016/s0160-4120(03)00151-xopenalex-snapshot
Environmental and health consequences of depleted uranium use in the 1991 Gulf War
inferredcites →https://doi.org/10.1016/s0925-8388(98)00639-2openalex-snapshot
Corrosion of uranium in air and water vapor: consequences for environmental dispersal
inferredcites →https://doi.org/10.1021/acs.jctc.4c01520openalex-snapshot
Circumventing the Metastable States within DFT+U through Random Orbital-Dependent Local Perturbation
inferredcites →https://doi.org/10.1021/ic901165jopenalex-snapshot
Reaction Sequence and Kinetics of Uranium Nitride Decomposition
inferredcites →https://doi.org/10.1021/ja01181a029openalex-snapshot
The Structures of the Carbides, Nitrides and Oxides of Uranium1
inferredcites →https://doi.org/10.1038/429238aopenalex-snapshot
Nuclear power's new dawn
inferredcites →https://doi.org/10.1039/tf9666203591openalex-snapshot
Oxidation of uranium mononitride and uranium monocarbide
inferredcites →https://doi.org/10.1103/physrevb.40.3616openalex-snapshot
High-precision sampling for Brillouin-zone integration in metals
inferredcites →https://doi.org/10.1103/physrevb.54.11169openalex-snapshot
Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set
inferredcites →https://doi.org/10.1103/physrevb.57.1505openalex-snapshot
Electron-energy-loss spectra and the structural stability of nickel oxide: An LSDA+U study
inferredcites →https://doi.org/10.1103/physrevb.59.1758openalex-snapshot
From ultrasoft pseudopotentials to the projector augmented-wave method
inferredcites →https://doi.org/10.1103/physrevb.76.115101openalex-snapshot
Density functional study of the actinide nitrides
inferredcites →https://doi.org/10.1103/physrevb.83.035126openalex-snapshot
First-principles calculation and experimental study of oxygen diffusion in uranium dioxide
inferredcites →https://doi.org/10.1103/physrevlett.77.3865openalex-snapshot
Generalized Gradient Approximation Made Simple
inferredcites →https://doi.org/10.1111/j.1151-2916.1969.tb09159.xopenalex-snapshot
The Quaternary System U‐C‐0‐N at 1700 C
inferredcites →https://doi.org/10.21105/joss.00773openalex-snapshot
Galore: Broadening and weighting for simulation of photoelectron spectroscopy
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