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LiGaF2(IO3)2:A mixed-metal gallium iodate-fluoride with large birefringence and wide band gap 被引量:1
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作者 Jin Chen Chun-Li Hu Jiang-Gao Mao 《Science China Materials》 SCIE EI CSCD 2021年第2期400-407,共8页
The first mixed alkali-metal gallium iodate-fluoride,namely,LiGaF2(IO3)2,was successfully obtained under hydrothermal conditions.The structure of LiGaF2(IO3)2 features a novel two-dimensional(2D)[GaF2(IO3)2]layer comp... The first mixed alkali-metal gallium iodate-fluoride,namely,LiGaF2(IO3)2,was successfully obtained under hydrothermal conditions.The structure of LiGaF2(IO3)2 features a novel two-dimensional(2D)[GaF2(IO3)2]layer composed of[Ga2F4(IO3)6]4 dimers further bridged by(IO3)groups.LiGaF2(IO3)2 exhibits a wide band gap of 4.33 eV,corresponding to the ultraviolet(UV)absorption edge of 230 nm.Calculations of linear optical property revealed that LiGaF2(IO3)2 has a remarkably large birefringence of 0.181@1064 nm and 0.206@532 nm,indicating that it is a potential birefringent material that could be used from visible to UV region.This study provides a new method for the future discovery of promising optical crystals. 展开更多
关键词 metal iodate-fluoride birefringent material band gap enlargement theoretical calculations
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Recent advances in F-containing iodate nonlinear optical materials
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作者 Dong Gao Hongping Wu +3 位作者 Zhanggui Hu Jiyang Wang Yicheng Wu Hongwei Yu 《Chinese Journal of Structural Chemistry》 SCIE CAS CSCD 2023年第1期30-45,共16页
Metal iodates containing I(Ⅴ)with lone electron pairs in an asymmetric coordination geometry exhibit excellent second-harmonic generation(SHG)responses,wide transmission range and large band gaps.During the past ten ... Metal iodates containing I(Ⅴ)with lone electron pairs in an asymmetric coordination geometry exhibit excellent second-harmonic generation(SHG)responses,wide transmission range and large band gaps.During the past ten years,metal iodates have been widely studied,and introducing large electronegative fluorine atoms into metal iodates has also attracted much attention.These F-containing iodates are different from pure iodates in terms of composition,symmetry and transmittance.Especially because oxide-fluoride heterolepic anion groups can exhibit interesting structure-directing properties,e.g.trans-and cis-directing properties,these F-containing iodates also have better structure designability.Therefore,in this review,we will review the research progress of F-containing iodates and address the effect of structure-directing properties of oxide-fluoride anions on the crystal structures of F-containing iodates.Since the valence of the central cations will greatly affect the distortions and configurations of the oxide-fluoride anion groups,these F-containing iodates will be classified and introduced according to the different valences of the central cations. 展开更多
关键词 MID-INFRARED Nonlinear optical materials iodate-fluorides Fluoroiodates
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