Publicação: Visible PL phenomenon at room temperature in disordered structure of SrWO4 powder
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Coorientador
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Springer
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Resumo
The SrWO4 (SWO) powders were synthesized by the polymeric precursor method and annealed at different temperatures. The SWO structure was obtained by X-ray diffraction and the corresponding photoluminescence (PL) spectra was measured. The PL results reveal that the structural order-disorder degree in the SWO lattice influences in the PL emission intensity. Only the structurally order-disordered samples present broad and intense PL band in the visible range. To understand the origin of this phenomenon, we performed quantum-mechanical calculations with crystalline and order-disordered SWO periodic models. Their electronic structures were analyzed in terms of band structure. The appearance of localized levels in the band gap of the order-disordered structure was evidenced and is a favorable condition for the intense PL to occur.
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electronic structure, order-disorder, oxide powder, photoluminescence, scheelite, SrWO4
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Inglês
Como citar
Journal of Computer-aided Materials Design. Dordrecht: Springer, v. 12, n. 2-3, p. 111-119, 2005.