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• W2513504809 abstract "Eu(2+)-activated single phase Ba(2+)-oxonitridosilicate phosphors were prepared under a mild synthetic condition via silicate precursors, and their luminescent properties were investigated. Both the preferred oxonitridosilicate formation as for the available host compounds and thermodynamic stability within the Ba-Si-O-N system were elucidated in detail by the theoretical simulation based on the first-principles density functional theory. Those results can visualize the optimum synthetic conditions for Eu(2+)-activated highly luminescent Ba(2+)-oxonitridosilicates, especially Ba3Si6O12N2, as promising conversion phosphors for white LEDs, including Ba3Si6O9N4 and BaSi2O2N2 phases. To prove the simulated design rule, we synthesized the Ba3Si6O12N2:Eu(2+) phosphor using various silicate precursors, Ba2Si4O10, Ba2Si3O8, and BaSiO3, in a carbothermal reduction ambient and finally succeeded in obtaining a phase of pure highly luminescent oxonitridosilicate phosphor without using any solid-state nitride addition and/or high pressure synthetic procedures. Our study provides useful guidelines for robust synthetic procedures for developing thermally stable rare-earth-ion activated oxonitridosilicate phosphors and an established simulation method that can be effectively applied to other multigas systems." @default.
• W2513504809 created "2016-09-16" @default.
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• W2513504809 date "2016-08-12" @default.
• W2513504809 modified "2023-10-16" @default.
• W2513504809 title "Eu²⁺-Activated Phase-Pure Oxonitridosilicate Phosphor in a Ba–Si–O–N System via Facile Silicate-Assisted Routes Designed by First-Principles Thermodynamic Simulation" @default.
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• W2513504809 doi "https://doi.org/10.1021/acs.inorgchem.6b01278" @default.
• W2513504809 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/27518370" @default.
• W2513504809 hasPublicationYear "2016" @default.
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