Modelling the radiolytic corrosion of a-doped UO 2 and spent nuclear fuel Nazhen Liu a , Zack Qin a , James J. No el a, b, * , David W. Shoesmith a, b, ** a Department of Chemistry, The University of Western Ontario, London, Ontario, N6A 5B7, Canada b Surface Science Western, The University of Western Ontario, London, Ontario, N6G 0J3, Canada highlights A model is adapted to simulate the corrosion rates measured on a-doped UO 2 . Simulated corrosion rates are in good agreement with the published rates. The corrosion rate is determined by the radiolytic production rate of H 2 O 2 . The accumulation of O 2 leads to an increase in corrosion rate in a closed system. The corrosion rate decreases to a negligible level by including H 2 effect. article info Article history: Received 7 March 2017 Received in revised form 26 May 2017 Accepted 6 July 2017 Available online 8 July 2017 Keywords: a-Doped UO 2 Spent nuclear fuel Waste disposal Modelling abstract A model previously developed to predict the corrosion rate of spent fuel (UO 2 ) inside a failed waste container has been adapted to simulate the rates measured on a wide range of a-doped UO 2 and spent fuel specimens. This simulation conrms the validity of the model and demonstrates that the steady- state corrosion rate is controlled by the radiolytic production of H 2 O 2 (which has been shown to be the primary oxidant driving fuel corrosion), irrespective of the reactivity of the UO 2 matrix. The model was then used to determine the consequences of corrosion inside a failed container resealed by steel corrosion products. The possible accumulation of O 2 , produced by H 2 O 2 decomposition, was found to accelerate the corrosion rate in a closed system. However, the simultaneous accumulation of radiolytic H 2 , which is activated as a reductant on the noble metal (ε) particles in the spent fuel, rapidly overcame this acceleration leading to the eventual suppression of the corrosion rate to insignicant values. Cal- culations also showed that, while the radiation dose rate, the H 2 O 2 decomposition ratio, and the surface coverage of ε particles all inuenced the short term corrosion rate, the inuence of the radiolytically produced H 2 was the overwhelming inuence in reducing the rate to negligible level (i.e., <10 20 mol m 2 s 1 ). © 2017 Elsevier B.V. All rights reserved. 1. Introduction If nuclear energy is to play an important role in alleviating the risk of global climate change, it must be demonstrated that the high level waste can be safely disposed of. The approved approach for the long-term management of used nuclear fuel in Canada is disposal in a deep geologic repository (DGR) [1,2]. As accepted internationally, the repository concept is based on multiple barriers including the fuel bundles, durable metal containers, a clay buffer and seals around the container, and a deep geologic formation [3].A key barrier is the corrosion-resistant container which is expected to isolate the used fuel for a very long time [4,5]. However, it is judi- cious to examine the consequences of container failure and the exposure of used fuel bundles to groundwater. In the anoxic con- ditions anticipated in a DGR, H 2 O radiolysis resulting from the ra- diation elds associated with the used fuel within a failed container will be the only source of oxidants. The radiolysis product, H 2 O 2 , has been shown to be the primary oxidant driving fuel corrosion [6,7]. Oxidation of fuel (U IV ) will produce the oxidized form (U VI ) * Corresponding author. Department of Chemistry, The University of Western Ontario, London, Ontario, N6A 5B7, Canada. ** Corresponding author. Department of Chemistry, The University of Western Ontario, London, Ontario, N6A 5B7, Canada. E-mail addresses: jjnoel@uwo.ca (J.J. Noel), dwshoesm@uwo.ca (D.W. Shoesmith). Contents lists available at ScienceDirect Journal of Nuclear Materials journal homepage: www.elsevier.com/locate/jnucmat http://dx.doi.org/10.1016/j.jnucmat.2017.07.011 0022-3115/© 2017 Elsevier B.V. All rights reserved. Journal of Nuclear Materials 494 (2017) 87e94