Advanced Optical Materials · 2021 · 65 citations · 59 references
Natural SciencesChemistryMaterials ScienceInorganic ChemistryOptical MaterialsPhotonicsLuminescent MaterialsPerovskite MaterialsRare-earth-doped MaterialsX-ray CrystallographyIntrinsic DefectsOptical PhenomenaPhosphor MaterialsPhosphorsSynchrotron DiffractionSynchrotron X-ray DiffractionVacanciesVacancy Complexes
Abstract Long persistent phosphors (LPPs) have drawn tremendous research interest owing to their mysterious optical phenomena and widespread applications. LPPs in the ultraviolet‐C (UVC, 200–280 nm) spectral range particularly hold promise in terms of sterilization, drug release, and cancer therapy. However, all reported UVC LPPs have so far relied on the use of Pr 3+ as the emitter, resulting in a limited scope of such phosphors. Here, a new concept for designing UVC LPPs is proposed, leading to the birth of the first non‐rare‐earth phosphor (YPO 4 :Bi 3+ ) with a UVC afterglow duration of more than 2 h. Experimental characterizations including thermoluminescence spectra and high‐resolution synchrotron X‐ray diffraction, coupled with first‐principles calculations, reveal that various intrinsic defects in YPO 4 , such as Y vacancies and Y–O vacancy complexes, serve as hole traps to capture and store a large number of holes created by X‐ray irradiation, while Bi 3+ ions can trap thermalized electrons. This work highlights the key role of Bi 3+ ions in mediating energy storage and release in persistent phosphors by acting as both electron traps and emitters, and thus offers new opportunities for rationally designing non‐RE‐activated UVC LPPs.
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Generalized Gradient Approximation Made Simple
John P. Perdew, Kieron Burke, Matthias Ernzerhof · Physical Review Letters · 1996 · 211.5K citations · Full text
Natural Sciences, Chemistry, Physics +16
Projector augmented-wave method
Peter E. Blöchl · Physical review. B, Condensed matter · 1994 · 90.8K citations
Natural Sciences, Chemistry, Physics +17