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Facile and effective synthesis strategy for terbium-doped hydroxyapatite toward photoelectric devices and flexible functional fibers
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作者 Xiao-Dong Zhang Kun Nie +10 位作者 Zi-Yao Hu Ran-Ran Zhou Xiu-Qiang Duan Wu-Bin Dai Song-Song Nie Song-Jun Yao Luo-Xin Wang le-fu mei Hua Wang Yi-Yi Yao Xiao-Xue Ma 《Rare Metals》 SCIE EI CAS CSCD 2024年第4期1713-1723,共11页
As a material with good biocompatibility,hydroxyapatite(HAP)can have optical properties after doping with various rare earth ions.As a biocompatible fluorescent material,doped HAP could have broad applications in biol... As a material with good biocompatibility,hydroxyapatite(HAP)can have optical properties after doping with various rare earth ions.As a biocompatible fluorescent material,doped HAP could have broad applications in biological probes,drug delivery,optoelectronic materials,fluorescence anti-counterfeiting,and other aspects.In this paper,we put forward the preparation of HAP doped with terbium(Ⅲ)ions(Tb^(3+))by hydrothermal co-precipitation.By controlling the Tb^(3+)doping content in reaction and the reaction time,the changes in HAP's structure,morphology,and luminescence properties under different conditions were studied.When the doping amount of Tb^(3+)reached an optimal value,the dipole-quadrupole would occur and the concentration would be quenched.The control experiment showed that the optimal Tb3+content was 7.5×10^(-5)mol,which showed the best fluorescence performance.HAP,a non-luminous material,was rarely used in the field of fluorescent anti-counterfeiting and photoelectric devices.We proposed to prepare a luminescent aramid/polyphenylene sulfide(ACFs/PPS)fiber paper and a new light-emitting diode(LED)using the Tb-doped HAP phosphor.The composite sample exhibited an excellent stability and fluorescence performance,which also demonstrated a possibility of HAP applications in anticounterfeiting and photoelectric.The introduction of Tb3+dopant HAP was done to give HAP optical properties and broaden the application range of HAP. 展开更多
关键词 HYDROXYAPATITE Rare earth luminescence Photoelectric device ARAMID Polyphenylene sulfide fiber paper Luminescent fiber
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Computational analysis of apatite-type compounds for band gap engineering: DFT calculations and structure prediction using tetrahedral substitution
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作者 Hai-Kun Liu Li-Bing Liao +7 位作者 Yuan-Yuan Zhang Sergey MAksenov Ning Liu Qing-Feng Guo Dina V.Deyneko Tian-Yi Wang le-fu mei Cheng-Hua Sun 《Rare Metals》 SCIE EI CAS CSCD 2021年第12期3694-3700,共7页
Mineral apatite compounds have attracted significant interest due to their chemical stability and adjustable hexagonal structure,which makes them suitable as new photovoltaic functional materials.The band gap of natur... Mineral apatite compounds have attracted significant interest due to their chemical stability and adjustable hexagonal structure,which makes them suitable as new photovoltaic functional materials.The band gap of natural apatite is ~5.45 eV,and such a large value limits their applications in the field of catalysis and energy devices.In this research,we designed a method to narrow the band gap via the tetrahedral substitution effect in apatite-based compounds.The density functional theory(DFT) and experimental investigation of the electronic and optical properties revealed that the continuous incorporation of [MO_(4)]^(4-) tetrahedrons(M=Si,Ge,Sn,and Mn) into the crystal lattice can significantly reduce the band gap.In particular,this phenomenon was observed when the[MnO_(4)]^(4-) tetrahedron replaces the [PO_(4)]^(4-) tetrahedron because of the formation of a Mn 3 d-derived conduction band minimum(CBM) and interacts with other elements,leading to band broadening and obvious reduction of the band gap.This approach allowed us to propose a novel scheme in the band gap engineering of apatite-based compounds toward an entire spectral range modification. 展开更多
关键词 APATITE Density functional theory(DFT) Band gap engineering Structure prediction Tetrahedral substitution
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