Инд. авторы:	Islamov D.R., Gritsenko V.A., Perevalov T.V., Yelisseyev A.P., Pustovarov V.A., Korolkov I.V., Lomonova E.E.
Заглавие:	Oxygen vacancies in zirconium oxide as the blue luminescence centres and traps responsible for charge transport: Part I-Crystals
Библ. ссылка:	Islamov D.R., Gritsenko V.A., Perevalov T.V., Yelisseyev A.P., Pustovarov V.A., Korolkov I.V., Lomonova E.E. Oxygen vacancies in zirconium oxide as the blue luminescence centres and traps responsible for charge transport: Part I-Crystals // MATERIALIA. - 2021. - Vol.15. - Art.100979. - ISSN 2589-1529.
Внешние системы:	DOI: 10.1016/j.mtla.2020.100979; РИНЦ: 45074819; WoS: 000636280500007;
Реферат:	eng: troscopy and quantum-chemical calculations. The 2.7 eV luminescence band and 5.2 eV absorption/luminescence excitation band are associated with an oxygen vacancy. It was shown, that a half of the Stokes shift in blue photoluminescence spectra is equal to the trap thermal activation energy 1.25 eV. Within quantum-chemical simulations it was demonstrated that both electrons and holes can be trapped on oxygen vacancies in ZrO2. Hence, oxygen vacancies are supposed to operate as traps responsible for the blue luminescence band in ZrO2.
Ключевые слова:	Luminescence; Oxygen vacancy; Zirconium oxide; Defects; DFT;
Издано:	2021
Физ. характеристика:	100979
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