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RESEARCH PAPER · Inorganic Chemistry · 2015

K2Pb3(CO3)3F2 and KCdCO3F: Novel Fluoride Carbonates with Layered and 3D Framework Structures

Yuan Hua Lin, Chun‐Li Hu, Jiang‐Gao Mao

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K2Pb3(CO3)3F2 and KCdCO3F: Novel Fluoride Carbonates with Layered and 3D Framework StructuresOriginalChemInform Abstract: K2Pb3(CO3)3F2 and KCdCO3F: Novel Fluoride Carbonates with Layered and 3D Framework Structures.0Influence of original and simulated microscopic units on SHG response in semiorganic NLO materials9Three new phosphates with isolated P 2 O 7 units: noncentrosymmetric Cs 2 Ba 3 (P 2 O 7 ) 2 and centrosymmetric Cs 2 BaP 2 O 7 and LiCsBaP 2 O 768Design and Syntheses of Three Novel Carbonate Halides: Cs 3 Pb 2 (CO 3 ) 3 I, KBa 2 (CO 3 ) 2 F, and RbBa 2 (CO 3 ) 2 F29Mixed-Metal Carbonate Fluorides as Deep-Ultraviolet Nonlinear Optical Materials259Crystal growth and optical properties of a UV nonlinear optical material KSrCO 3 F73Role of spin–orbit interaction on the nonlinear optical response of CsPbCO 3 F using DFT35Comparative Interrelationship of the Structural, Nonlinear-Optical and Other Acentric Properties for Oxide, Borate and Carbonate Crystals16Design and Synthesis of a Series of Novel Mixed Borate and Carbonate Halides21Synthesis and characterization of a new beryllium-free deep-ultraviolet nonlinear optical material: Na2GdCO3F331Synthesis, Structure, and Properties of Nonlinear Optical Crystal Na2SiF622A Joint Strategy To Evaluate the Microscopic Origin of the Second-Harmonic-Generation Response in Nonpolar ABCO3F Compounds32Electronic, optical, infrared, and elastic properties of KCdCO3F from first principles2Recent advances in ultraviolet and deep-ultraviolet second-order nonlinear optical crystals257The relationship between covalent bonds and the optical response in a nonpolar family ATeMoO 6 (A=Mg, Zn, Cd): A Berry-phase investigation14Module-Guided Design Scheme for Deep-Ultraviolet Nonlinear Optical Materials195Second-order nonlinear optical crystals with mixed anions250The linear and nonlinear optical response of CsGeX3 (X=Cl, Br, and I): The finite field and first-principles investigation26LiGeBO 4 : a nonlinear optical material with a balance between deep-ultraviolet cut-off edge and large SHG response induced by hand-in-hand tetrahedra21K9[B4O5(OH)4]3(CO3)X·7H2O (X = Cl, Br): Syntheses, Characterizations, and Theoretical Studies of Noncentrosymmetric Halogen Borate–Carbonates with Short UV Cutoff Edges16Ionothermal Synthesis of Metal Chalcogenides M2Ag3Sb3S7 (M = Rb, Cs) Displaying Nonlinear Optical Activity in the Infrared Region33Structure-property relationship in nonlinear optical materials with π-conjugated CO3 triangles146Ba3(BO3)(CO3)F: The First Borate Carbonate Fluoride Synthesized by the High‐Temperature Solution Method19Intense d ‑ p Hybridization Induced a Vast SHG Response Disparity between Tetrahedral Vanadates and Arsenates13Second-order nonlinear optical property of the ultraviolet transparent alkali metal-rare earth metal carbonate Na3Y(CO3)3.3H2O5Cd3(IO3)(IO4)F2·0.1CdO: A Nonlinear-Optical Crystal with the Introduction of Fluoride into Iodate Containing Both [IO3]− and [IO4]3– Groups18From Centrosymmetry to Noncentrosymmetry: Tailoring the Structural Arrangements of Carbonates with Strong Nonlinear Optical Response through Partial Anion Substitution33Sr5(CO3)2(BO3)2: A new family member of isostructural mixed borate and carbonate Ba4M(BO3)2(CO3)2 (M = Ba, Sr) with isolated BO3 and CO3 groups7Two molybdenyl carbonates with different dimensional structures exhibiting huge differences in band gaps7( R )- and ( S )-[C 8 H 10 NO 3 ] 2 [NbOF 5 ]: noncentrosymmetric niobium oxyfluorides with large optical anisotropy3KRE(CO 3 ) 2 (RE = Eu, Gd, Tb): new mixed metal carbonates with strong photoluminescence and large birefringence15Crystal Growth of K2HCO3F·H2O with a Very Short Cutoff Edge and Large Birefringence17A Cation-Driven Approach toward Deep-Ultraviolet Nonlinear Optical Materials17Ultraviolet Crystal with Strong Optical Nonlinearity by Creating Halogen-Centered Secondary Building Blocks15Discovery of excellent ultraviolet nonlinear optical materials in chlorates and bromates with highly stereochemically active lone pairs12Na3K6(CO3)3(NO3)2X·6H2O (X = NO3, Cl, Br): Exploring High-Performance UV Birefringent Crystals Induced by Coplanar π-Conjugated CO3 and NO3 Groups15(C5H12N2S)Hg(NO3)2: A Mercury Nitrate Nonlinear Optical Crystal Motivated by Heteroatom Coordination Strategy9Cs2Pb(CO3)2: a novel mixed-metal carbonate with rare Pb-C-O one-dimensional chain0Crystal Growth and Characterization of the Rare Earth Fluoride Carbonates NaLnCO3F2 (Ln = Eu–Lu)5BaPb2(CO3)2F2: Enhancing Birefringence by a Multiunit Synergy Effect9Highly Polarizable Phosphorus‐Centered Tetrahedra and π‐Conjugated Carbon‐Centered Triangular Moieties Inducing Large Anisotropy and Short‐Wavelength Phase‐Matching23From (C6H5N2)2CdCl4 to (C6H5N2)2ZnCl4, Chirality Transformation to Realize a Nonlinear Optical Organic–Inorganic Hybrid Halide with Balanced Comprehensive Performance19

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  1. ChemInform Abstract: K2Pb3(CO3)3F2 and KCdCO3F: Novel Fluoride Carbonates with Layered and 3D Framework Structures.

    ChemInform · 2015-12-18

    Yuan Hua Lin, Chun‐Li Hu, Jiang‐Gao Mao

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  2. Influence of original and simulated microscopic units on SHG response in semiorganic NLO materials

    RSC Advances · 2016-01-01

    Dianwei Hou, Bing‐Hua Lei, Shilie Pan, Bingbing Zhang, Zhihua Yang

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  3. Three new phosphates with isolated P 2 O 7 units: noncentrosymmetric Cs 2 Ba 3 (P 2 O 7 ) 2 and centrosymmetric Cs 2 BaP 2 O 7 and LiCsBaP 2 O 7

    Dalton Transactions · 2016-01-01

    Lin Li, Shujuan Han, Bing‐Hua Lei, Ying Wang, Hongyi Li, Zhihua Yang, Shilie Pan

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  4. Design and Syntheses of Three Novel Carbonate Halides: Cs 3 Pb 2 (CO 3 ) 3 I, KBa 2 (CO 3 ) 2 F, and RbBa 2 (CO 3 ) 2 F

    Chemistry - A European Journal · 2016-01-28

    Lili Liu, Yun Mo Yang, Xiaoyu Dong, Bingbing Zhang, Ying Wang, Zhihua Yang, Shilie Pan

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  5. Mixed-Metal Carbonate Fluorides as Deep-Ultraviolet Nonlinear Optical Materials

    Journal of the American Chemical Society · 2016-12-24

    T. Thao Tran, Joshua Young, James M. Rondinelli, P. Shiv Halasyamani

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  6. Crystal growth and optical properties of a UV nonlinear optical material KSrCO 3 F

    CrystEngComm · 2017-01-01

    Weiguo Zhang, P. Shiv Halasyamani

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  7. Role of spin–orbit interaction on the nonlinear optical response of CsPbCO 3 F using DFT

    Physical Chemistry Chemical Physics · 2017-01-01

    E. Narsimha Rao, G. Vaitheeswaran, A.H. Reshak, S. Auluck

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  8. Comparative Interrelationship of the Structural, Nonlinear-Optical and Other Acentric Properties for Oxide, Borate and Carbonate Crystals

    Crystals · 2017-04-12

    Boris I. Kidyarov

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  9. Design and Synthesis of a Series of Novel Mixed Borate and Carbonate Halides

    Chemistry - A European Journal · 2017-06-02

    Lili Liu, Yun Mo Yang, Junben Huang, Xiaoyu Dong, Zhihua Yang, Shilie Pan

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  10. Synthesis and characterization of a new beryllium-free deep-ultraviolet nonlinear optical material: Na2GdCO3F3

    Journal of Alloys and Compounds · 2017-07-12

    Ling Huang, Qian Wang, Chensheng Lin, Guohong Zou, Daojiang Gao, Jian Bi, Ning Ye

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  11. Synthesis, Structure, and Properties of Nonlinear Optical Crystal Na2SiF6

    Zeitschrift für anorganische und allgemeine Chemie · 2017-09-29

    Wenyao Zhang, Qun Jing, Yuan Fang, Zhaohui Chen

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  12. A Joint Strategy To Evaluate the Microscopic Origin of the Second-Harmonic-Generation Response in Nonpolar ABCO3F Compounds

    Inorganic Chemistry · 2018-01-17

    Qun Jing, Guang Yang, Zhaohui Chen, Xiaoyu Dong, Yunjing Shi

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  13. Electronic, optical, infrared, and elastic properties of KCdCO3F from first principles

    Journal of Physics and Chemistry of Solids · 2018-02-07

    Xue‐Qian Huang, Han-Yu Xue, Can Zhang, Dongdong Pang, Zhen‐Long Lv, Man-Yi Duan

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  14. Recent advances in ultraviolet and deep-ultraviolet second-order nonlinear optical crystals

    Coordination Chemistry Reviews · 2018-03-15

    Chao Wu, Gang Yang, Mark Graeme Humphrey, Chi Zhang

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  15. The relationship between covalent bonds and the optical response in a nonpolar family ATeMoO 6 (A=Mg, Zn, Cd): A Berry-phase investigation

    Journal of Solid State Chemistry · 2018-04-26

    Qiaoqiao Zhang, Qun Jing, Haiming Duan, Haibin Cao

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  16. Module-Guided Design Scheme for Deep-Ultraviolet Nonlinear Optical Materials

    Journal of the American Chemical Society · 2018-07-27

    Bing‐Hua Lei, Zhihua Yang, Hongwei Yu, Chao Cao, Zhi Li, Cong Hu, Kenneth Reinhard Poeppelmeier, Shilie Pan

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  17. Second-order nonlinear optical crystals with mixed anions

    Coordination Chemistry Reviews · 2018-08-06

    Yu Pan, Sheng‐Ping Guo, Bin‐Wen Liu, Huaiguo Xue, Guo‐Cong Guo

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  18. The linear and nonlinear optical response of CsGeX3 (X=Cl, Br, and I): The finite field and first-principles investigation

    Optik · 2018-10-25

    Qiaoqiao Zhang, Hahaer Mushahali, Haiming Duan, Ming‐Hsien Lee, Qun Jing

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  19. LiGeBO 4 : a nonlinear optical material with a balance between deep-ultraviolet cut-off edge and large SHG response induced by hand-in-hand tetrahedra

    Inorganic Chemistry Frontiers · 2019-01-01

    Qiong Liu, Cong Hu, Xin Su, Maierhaba Abudoureheman, Shilie Pan, Zhihua Yang

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  20. K9[B4O5(OH)4]3(CO3)X·7H2O (X = Cl, Br): Syntheses, Characterizations, and Theoretical Studies of Noncentrosymmetric Halogen Borate–Carbonates with Short UV Cutoff Edges

    Inorganic Chemistry · 2019-05-01

    Xueyan Zhang, Hongping Wu, Shichao Cheng, Guopeng Han, Zhihua Yang, Shilie Pan

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  21. Ionothermal Synthesis of Metal Chalcogenides M2Ag3Sb3S7 (M = Rb, Cs) Displaying Nonlinear Optical Activity in the Infrared Region

    Inorganic Chemistry · 2019-09-25

    Gang Yang, Long-Hua Li, Chao Wu, Mark Graeme Humphrey, Chi Zhang

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  22. Structure-property relationship in nonlinear optical materials with π-conjugated CO3 triangles

    Coordination Chemistry Reviews · 2020-01-10

    Youchao Liu, Yaoguo Shen, Sangen Zhao, Junhua Luo

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  23. Ba3(BO3)(CO3)F: The First Borate Carbonate Fluoride Synthesized by the High‐Temperature Solution Method

    Chemistry - A European Journal · 2020-09-25

    Chunmei Huang, Fangfang Zhang, Shichao Cheng, Zhihua Yang, Hao Li, Shilie Pan

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  24. Intense d ‑ p Hybridization Induced a Vast SHG Response Disparity between Tetrahedral Vanadates and Arsenates

    The Journal of Physical Chemistry C · 2020-10-28

    Xin Su, Yu Chu, Zhihua Yang, Bing‐Hua Lei, Chao Cao, Ying Wang, Qiong Liu, Shilie Pan

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  25. Second-order nonlinear optical property of the ultraviolet transparent alkali metal-rare earth metal carbonate Na3Y(CO3)3.3H2O

    Journal of Solid State Chemistry · 2021-02-28

    Chao Wu, Lin Lin, Tianhui Wu, Zhipeng Huang, Chi Zhang

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  26. Cd3(IO3)(IO4)F2·0.1CdO: A Nonlinear-Optical Crystal with the Introduction of Fluoride into Iodate Containing Both [IO3]− and [IO4]3– Groups

    Inorganic Chemistry · 2021-04-06

    Liling Cao, Shengzi Zhang, Dan Zhao, Bingxuan Li, Tao Yan, Guangsai Yang, Zheshuai Lin, Min Luo, Ning Ye

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  27. From Centrosymmetry to Noncentrosymmetry: Tailoring the Structural Arrangements of Carbonates with Strong Nonlinear Optical Response through Partial Anion Substitution

    Advanced Optical Materials · 2021-05-22

    Xianghe Meng, Pifu Gong, Chunlan Tang, Wenlong Yin, Zheshuai Lin, Mingjun Xia

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  28. Sr5(CO3)2(BO3)2: A new family member of isostructural mixed borate and carbonate Ba4M(BO3)2(CO3)2 (M = Ba, Sr) with isolated BO3 and CO3 groups

    Journal of Molecular Structure · 2021-08-28

    Jiongquan Chen, Zhihua Yang, Kui Wu, Yun Mo Yang, Shilie Pan

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  29. Two molybdenyl carbonates with different dimensional structures exhibiting huge differences in band gaps

    Inorganic Chemistry Frontiers · 2021-11-26

    Yunqiao Guo, Yalan Deng, Ting Zheng, Ling Huang, Daojiang Gao, Jian Bi, Guohong Zou

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  30. ( R )- and ( S )-[C 8 H 10 NO 3 ] 2 [NbOF 5 ]: noncentrosymmetric niobium oxyfluorides with large optical anisotropy

    Inorganic Chemistry Frontiers · 2022-01-01

    Jihyeon Moon, Kang Min Ok

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  31. KRE(CO 3 ) 2 (RE = Eu, Gd, Tb): new mixed metal carbonates with strong photoluminescence and large birefringence

    Inorganic Chemistry Frontiers · 2022-01-01

    Yuan Hua Lin, Chun‐Li Hu, Zhi Gang Fang, Jin Chen, Weijie Xie, Yan Chen, Jianpu Wang, Jiang‐Gao Mao

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  32. Crystal Growth of K2HCO3F·H2O with a Very Short Cutoff Edge and Large Birefringence

    Crystal Growth & Design · 2022-08-15

    Yang Li, Kang Min Ok

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  33. A Cation-Driven Approach toward Deep-Ultraviolet Nonlinear Optical Materials

    Research · 2023-01-01

    Cong Hu, Meng Cheng, Wenqi Jin, Jian Wei Han, Zhihua Yang, Shilie Pan

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  34. Ultraviolet Crystal with Strong Optical Nonlinearity by Creating Halogen-Centered Secondary Building Blocks

    Chemistry of Materials · 2023-07-06

    Xuping Shi, Abudukadi Tudi, Minqiang Gai, Zhihua Yang, Shujuan Han, Shilie Pan

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  35. Discovery of excellent ultraviolet nonlinear optical materials in chlorates and bromates with highly stereochemically active lone pairs

    Inorganic Chemistry Frontiers · 2024-01-01

    Chun‐Li Hu, Qianqian Chen, Fang Kong, Jiang‐Gao Mao

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  36. Na3K6(CO3)3(NO3)2X·6H2O (X = NO3, Cl, Br): Exploring High-Performance UV Birefringent Crystals Induced by Coplanar π-Conjugated CO3 and NO3 Groups

    Inorganic Chemistry · 2024-04-23

    Wencong Li, Junbo Wang, Lili Liu, Chunmei Huang, Yanyan Ding, Mengmeng Zhu, Jindan Tian, Hai-Xin Qi, Yaoqing Chu, Jiayue Xu

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  37. (C5H12N2S)Hg(NO3)2: A Mercury Nitrate Nonlinear Optical Crystal Motivated by Heteroatom Coordination Strategy

    Inorganic Chemistry · 2024-07-31

    Yi‐Lei Lv, Liang Ma, Wenlong Liu, Sheng‐Ping Guo, Ru‐Ling Tang

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  38. Cs2Pb(CO3)2: a novel mixed-metal carbonate with rare Pb-C-O one-dimensional chain

    Journal of Materials Science · 2024-08-01

    Qun Jing, Mei Hu, Jialong Wang, Yi Jiang, Haiming Duan, Zhaohui Chen

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  39. Crystal Growth and Characterization of the Rare Earth Fluoride Carbonates NaLnCO3F2 (Ln = Eu–Lu)

    Crystal Growth & Design · 2024-08-06

    Navindra Keerthisinghe, Gregory W. Morrison, Hans‐Conrad zur Loye

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  40. BaPb2(CO3)2F2: Enhancing Birefringence by a Multiunit Synergy Effect

    Inorganic Chemistry · 2024-12-02

    Yuan Hua Lin, Rongfang Zhang, Yucheng Hao, Ming-Yang Cao, Xuanlin Pan, Jiang‐Gao Mao

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  41. Highly Polarizable Phosphorus‐Centered Tetrahedra and π‐Conjugated Carbon‐Centered Triangular Moieties Inducing Large Anisotropy and Short‐Wavelength Phase‐Matching

    Advanced Optical Materials · 2025-01-28

    Wen-Bin Zhang, Muhammad Arif, Huan Zhou, Ran An, Zhihua Yang, Xueling Hou, Shilie Pan, Shujuan Han

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  42. From (C6H5N2)2CdCl4 to (C6H5N2)2ZnCl4, Chirality Transformation to Realize a Nonlinear Optical Organic–Inorganic Hybrid Halide with Balanced Comprehensive Performance

    Inorganic Chemistry · 2025-02-13

    Die-Xue Yang, Yi‐Lei Lv, Jiandong Guo, Wen-Ye Gao, Wenlong Liu, Ru‐Ling Tang

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