Abstract

U3_3Si2_2 nuclear fuel is corroded in deuterated steam with in situ neutron diffraction. Density functional theory is coupled with rigorous thermodynamic description of the hydride including gas/solid entropy contributions. H absorbs in the 2bb interstitial site of U3_3Si2_2Hx_x and moves to 8jj for x≥0.5x\ge 0.5. Hydriding forces lattice expansion and change in a/ca/c ratio linked to site preference. Rietveld refinement tracks the corrosion reactions at 350-500 °C and preference for the 8j site. Above 375 °C, formation of UO2_2, U3_3Si5_5 and USi3_3 take place in the grain boundaries and bulk. Hydriding occurs in bulk and precedes other reactions.

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