The role of cation ordering and disordering on mass transport in complex oxides
CR Kreller, BP Uberuaga - Current Opinion in Solid State and Materials …, 2021 - Elsevier
Mass transport is one of the most fundamental properties of a material and dictates its
potential use for a range of applications. In simple materials, mass transport is determined …
potential use for a range of applications. In simple materials, mass transport is determined …
Multiscale modeling of fission gas behavior in U3Si2 under LWR conditions
In this work, we present a model of fission gas behavior in U 3 Si 2 under light water reactor
(LWR) conditions for application in engineering fuel performance codes. The model includes …
(LWR) conditions for application in engineering fuel performance codes. The model includes …
Phase-field simulations of intergranular fission gas bubble behavior in U3Si2 nuclear fuel
U 3 Si 2 is a potential accident-tolerant fuel that shows promise due to its high thermal
conductivity and higher uranium density relative to UO 2. However, its swelling and fission …
conductivity and higher uranium density relative to UO 2. However, its swelling and fission …
Incorporation of Kr and Xe in uranium mononitride: a density functional theory study
L Yang, N Kaltsoyannis - The Journal of Physical Chemistry C, 2021 - ACS Publications
Uranium nitride is a material of considerable fundamental interest and is a promising
candidate for an advanced nuclear fuel. We here study intrinsic point defects and …
candidate for an advanced nuclear fuel. We here study intrinsic point defects and …
Understanding xenon and vacancy behavior in UO 2, UN and U 3 Si 2: a comparative DFT+ U study
J Zhao, D Sun, L **, P Chen, J Zhao… - Physical Chemistry …, 2023 - pubs.rsc.org
Extensive attention has been paid to accident tolerant fuels (ATFs), such as uranium
mononitride (UN) and uranium sesquisilicide (U3Si2), which are regarded as potential …
mononitride (UN) and uranium sesquisilicide (U3Si2), which are regarded as potential …
Irradiation-enhanced diffusion and diffusion-limited creep in U3Si2
U 3 Si 2 is an advanced fuel candidate due to its relatively high fissile density and attractive
thermal properties. Compared to standard UO 2 fuel, there are significant data gaps for the …
thermal properties. Compared to standard UO 2 fuel, there are significant data gaps for the …
U3Si2-SiC fuel performance analysis in BISON during normal operation
U 3 Si 2-SiC is an accident-tolerant fuel concept currently under development by
Westinghouse that has potential to improve economic performance and safety of light water …
Westinghouse that has potential to improve economic performance and safety of light water …
Simulations of self-and Xe diffusivity in uranium mononitride including chemistry and irradiation effects
A combination of density functional theory and empirical potential atomic scale simulations
have been used to determine a model for defect stability and mobility in uranium …
have been used to determine a model for defect stability and mobility in uranium …
Enthalpies of formation and phase stability relations of USi, U3Si5 and U3Si2
U–Si intermetallic compounds have drawn great attention due to their potential application
as nuclear fuels. However, the thermodynamic properties and phase equilibria of this binary …
as nuclear fuels. However, the thermodynamic properties and phase equilibria of this binary …
First-principles study of point defects in U 3 Si 2: effects on the mechanical and electronic properties
M Li, J Hu, H Gong, Q Ren, Y Liao, H **ao… - Physical Chemistry …, 2022 - pubs.rsc.org
In recent years, U3Si2 has been proposed as an alternative nuclear fuel material to uranium
dioxide (UO2) because of its intrinsically high uranium density and thermal conductivity …
dioxide (UO2) because of its intrinsically high uranium density and thermal conductivity …