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We computed the Hydrogen diffusivity and activation energies in bulk amorphous Yttrium Stabilized Zirconia (YSZ), (Y2O3)8(ZrO2)92, using a Molecular Dynamics approach based on reactive forcefields. We found the Hydrogen diffusion activation energy to be approximately twice that in Silicon dioxide at around 0.35 eV, and found the Hydrogen diffusivity to be 2×10−13 cm2/s. We have also calculated the...
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