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Multiscale,mechanistic modeling of cesium transport in silicon carbide for TRISO fuel performance prediction
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作者 Pierre-Clément A.Simon Jia-Hong Ke +3 位作者 Chao Jiang Larry K.Aagesen Wen Jiang Stephen Novascone 《npj Computational Materials》 2025年第1期2590-2602,共13页
Understanding cesium(Cs)transport in TRistructural ISOtropic(TRISO)particle fuel is crucial for predicting fission product release in high-temperature reactors.However,current challenges include significant scatter in... Understanding cesium(Cs)transport in TRistructural ISOtropic(TRISO)particle fuel is crucial for predicting fission product release in high-temperature reactors.However,current challenges include significant scatter in diffusivity data and unexplained temperature-dependent diffusion regimes in the silicon carbide layer.This study addresses these challenges by developing a multiscale,mechanistic Cs transport model integrating atomistic simulations and phase field modeling.Our model quantifies temperature and grain size effects on Cs diffusivity,attributing experimentally observed regimes to a transition from bulk-dominated diffusivity at high temperatures to grain boundary-dominated diffusivity at lower temperatures.The model,validated against diffusion measurements and advanced gas reactor(AGR)-1 and AGR-2 post-irradiation fission product release data,enhances the predictive capability of the BISON fuel performance code.This study advances our understanding of Cs release from TRISO particles and its dependence on temperature and silicon carbide grain size,with implications for the safety and efficiency of high-temperature nuclear reactors. 展开更多
关键词 diffusivity data cs transport model fission product release mechanistic modeling phase field modelingour multiscale modeling atomistic simulations temperature gr
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