Fission gas release from UO2 nuclear fuel: A review

J Rest, MWD Cooper, J Spino, JA Turnbull… - Journal of Nuclear …, 2019 - Elsevier
Gaseous fission product generation, transport, and release can have a large impact on
nuclear fuel performance, degrading fuel and fuel–cladding gap properties. Over the past …

Cluster dynamics simulation of xenon diffusion during irradiation in UO2

C Matthews, R Perriot, MWD Cooper, CR Stanek… - Journal of Nuclear …, 2020 - Elsevier
Diffusion of fission gas in UO 2 nuclear fuel impacts several important performance metrics,
such as fission gas release, swelling, and thermal conductivity. Current empirical models of …

State of the art of fuel micro-mechanical modelling: From atomic scale to engineering laws in fuel performance codes

B Michel, M Welland, N Ofori-Opoku… - Journal of Nuclear …, 2022 - Elsevier
This paper presents the state-of-the-art knowledge about the micro-mechanical modelling of
the fuel behavior under irradiation with normal and off normal operating conditions …

Development of Xe and Kr empirical potentials for CeO2, ThO2, UO2 and PuO2, combining DFT with high temperature MD

MWD Cooper, N Kuganathan, PA Burr… - Journal of Physics …, 2016 - iopscience.iop.org
The development of embedded atom method (EAM) many-body potentials for actinide
oxides and associated mixed oxide (MOX) systems has motivated the development of a …

Segregation of xenon to dislocations and grain boundaries in uranium dioxide

PV Nerikar, DC Parfitt, LA Casillas Trujillo… - Physical Review B …, 2011 - APS
It is well known that Xe, being insoluble in UO 2, segregates to dislocations and grain
boundaries (GBs), where bubbles may form resulting in fuel swelling. Less well known is …

Understanding xenon and vacancy behavior in UO 2, UN and U 3 Si 2: a comparative DFT+ U study

J Zhao, D Sun, L Xi, 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 …

First-principles DFT modeling of nuclear fuel materials

XY Liu, DA Andersson, BP Uberuaga - Journal of Materials Science, 2012 - Springer
We review the state of first-principles density functional theory (DFT) modeling of nuclear
fuel materials. DFT-based first-principles modeling has emerged as a quantitatively rigorous …

Molecular dynamics study of fission gas bubble nucleation in UO2

XY Liu, DA Andersson - Journal of Nuclear Materials, 2015 - Elsevier
Molecular dynamics (MD) simulations are used to study helium and xenon gas bubble
nucleation in UO 2. For helium bubbles, the pressure release mechanism is by creating …

Free energy of Xe incorporation at point defects and in nanovoids and bubbles in

ST Murphy, A Chartier, L Van Brutzel… - Physical Review B …, 2012 - APS
Intra-and intergranular fission gas bubbles in nuclear fuels are known to have a deleterious
effect on fuel performance, particularly at high levels of burnup. The mechanisms by which …

[HTML][HTML] Incorporation of volatile fission products in UN and PuN and comparison to oxides

N Kuganathan, NJ Barron, RW Grimes - Journal of Nuclear Materials, 2023 - Elsevier
The incorporation of volatile fission products (Kr, Xe, Br, I, Te, Rb and Cs) in a range of
interstitial and defect sites in UN and PuN is examined via predictions made using atomic …