2012
DOI: 10.4028/www.scientific.net/ddf.326-328.126
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Thermodynamics of Defect Formation and Hydration of Y<sub>2</sub>O<sub>3</sub>

Abstract: Defect formation in yttria with a small content of acceptor impurities in equilibrium with a hydrogen-containing gas phase is studied theoretically. A statistical-thermodynamic description of the yttriagas equilibrium is based on the approach developed for compounds with a complex electronic structure [Phys. Stat. Sol. B (1991) Vol. 168, p. 233]. The considered model of electronic structure for Y2O3 includes, besides valence and conduction bands, acceptor and F-center states. The energy of F-centers was calcul… Show more

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