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RESEARCH PAPER · CrystEngComm · 2011

Crystal growth and optical properties of a noncentrosymmetric haloid borate, K3B6O10Br

Min Zhang, Shi-Lie Pan, Xiao-Yun Fan, Zhou Zhong-Xiang, Kenneth Reinhard Poeppelmeier, Yun Mo Yang

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Crystal growth and optical properties of a noncentrosymmetric haloid borate, K3B6O10BrOriginalGrowth, thermal and optical properties of a novel nonlinear optical material K 3 B 6 O 10 Cl57Top seeded solution growth and optical properties of a bromic borate crystal: K3B6O10Br31Cation Effect in Doped BBO and Halogen Anion Effect in Pb2B5O9X (X− = I−, Br−, Cl−)1Li5Rb2B7O14: a new congruently melting compound with two kinds of B–O one-dimensional chains and short UV absorption edge25Structure, growth and properties of a novel polar material, KSr4B3O921New nonlinear optical potassium iodate K[IO3] and borates K3[B6O10]Br, KTa[B4O6(OH)4](OH)2·1.33H2O—Synthesis, structures and relation to the properties35Li2Sr4B12O23: A new alkali and alkaline-earth metal mixed borate with [B10O18]6− network and isolated [B2O5]4− unit22New Borate‐citrate: Synthesis, Structure, and Properties of Sr[B(C6H5O7)2](H2O)4·3H2O3Synthesis, structure and characterization of layered Ca[B(C6H6O7)2](H2O)4⋅HCl3Synthesis, growth, crystal structure and optical properties of BaBiBO49Pb2B5O9Cl: a chloride borate with second harmonic generation effect40BaClBF4: a new noncentrosymmetric pseudo-Aurivillius type material with transparency range from deep UV to middle IR and a high laser damage threshold43Crystal growth and efficient second-harmonic-generation of the monoclinic LaCa4O(BO3)3 crystal24New tartratoborates: synthesis, structure, and characterization of non-centrosymmetric ASr[C4H2O6B(OH)2]·4H2O (A = K+, Rb+)29Synthesis, crystal growth and characterization of a new noncentrosymmetric borophosphate: RbPbBP2O836New Molybdenum(VI) Phosphates: Synthesis, Characterization, and Calculations of Centrosymmetric RbMoO2PO4and Noncentrosymmetric Rb4Mo5P2O2239Exploration of a new compound in the M–B–O–X (M: alkali metals; X: halogen) system: Preparation, crystal and electronic structures, and optical properties of Na3B6O10Br20Synthesis and Structure of KPbBP 2 O 8 – A Congruent Melting Borophosphate with Nonlinear Optical Properties35Sr3B6O11F2: a promising polar fluoroborate with short UV absorption edge and moderate second harmonic generation response30Synthesis, crystal structure, optical properties and theoretical calculations of a new potassium lead pentaborate, KPbB5O92Crystal and local structure refinement in Ca 2 Al 3 O 6 F explored by X-ray diffraction and Raman spectroscopy45Pb3B6O11F2: the first non-centrosymmetric lead borate fluoride with a large second harmonic generation response61Computational design of inorganic nonlinear optical crystals based on a genetic algorithm93Noncentrosymmetric versus Centrosymmetric: Influence of the Na+ Substitution on Structural Transition and Second-Harmonic Generation Property50Linear and Nonlinear Optical Properties of K3B6O10Br Single Crystal: Experiment and Calculation81Growth and nonlinear optical properties of K3B6O10Br crystal33The interaction between cations and anionic groups inducing SHG enhancement in a series of apatite-like crystals: A first-principles study23Effect of Halogen (Cl, Br) on the Symmetry of Flexible Perovskite-Related Framework37Effect of the cation size on the framework structures of magnesium tungstate, A 4 Mg(WO 4 ) 3 (A = Na, K), R 2 Mg 2 (WO 4 ) 3 (R = Rb, Cs)31Na 3 B 4 O 7 X (X = Cl, Br): two new borate halides with a 1D Na-X (X = Cl, Br) chain formed by the face-sharing XNa 6 octahedra14Synthesis and optical properties of the first lead borate bromide with isolated BO 3 groups: Pb 2 Ba 3 (BO 3 ) 3 Br26The synergistic effect between effective mass and built-in electric field for the transfer of carriers in nonlinear optical materials17Simulated pressure-induced blue-shift of phase-matching region and nonlinear optical mechanism for K3B6O10X (X = Cl, Br)165Second-harmonic generation at 532 nm in K_3B_6O_10Br crystal15The lone-pairs enhanced birefringence and SHG response: A DFT investigation on M2B5O9Cl (M=Sr, Ba, and Pb)47Recent development of metal borate halides: Crystal chemistry and application in second-order NLO materials341“XA 6 ” octahedra influencing the arrangement of anionic groups and optical properties in inverse-perovskite [B 6 O 10 ]XA 3 (X = Cl, Br; A = alkali metal)19Chemical engineering of mixed halide hexaborates as nonlinear optical materials5Nonlinear optical response mechanism of noncentrosymmetric lead borate Pb 6 [B 4 O 7 (OH) 2 ] 3 with three crystallographically independent [B 4 O 7 (OH) 2 ] 4− chains8Thermo-physical properties of nonlinear optical crystal K3B6O10Br19Top-Seeded Solution Crystal Growth, Morphology, Optical and Thermal Properties of Ba3(ZnB5O10)PO442A Deep-Ultraviolet Nonlinear Optical Crystal: Strontium Beryllium Borate Fluoride with Planar Be(O/F)3 Groups49Deep Ultraviolet Nonlinear Optical Materials647Positive and negative contribution to birefringence in a family of carbonates: A Born effective charges analysis36Ba n+2 Zn n (BO 3 ) n (B 2 O 5 )F n (n = 1, 2): new members of the zincoborate fluoride series with two kinds of isolated B–O units33Bulk growth and magneto-optical property of K3B6O10Br polar crystal4Experimental and ab initio studies of Cd 5 (BO 3 ) 3 Cl: the first cadmium borate chlorine NLO material with isolated BO 3 groups21New lead( ii ) borates in the PbO/PbF 2 /H 3 BO 3 ternary phase diagram: syntheses and structures of β-Pb 6 B 10 O 21 and Pb 4 B 8 O 164Theoretical perspectives on the structure, electronic, and optical properties of titanosilicates Li 2 M 4 [(TiO)Si 4 O 12 ] (M = K + , Rb + )13Two haloid borate crystals with large nonlinear optical response32Two tartratoborates with hybrid anionic groups from unusual condensation reactions9Broadband optical parametric chirped pulse amplification in K 3 B 6 O 10 Br crystal near 800 nm5Frequency-doubled green picosecond laser based on K3B6O10Br nonlinear optical crystal7Pb 2 BO 3 Br: a novel nonlinear optical lead borate bromine with a KBBF-type structure exhibiting strong nonlinear optical response113Structural insights into T 2 -cluster-containing chalcogenides with vertex-, edge- and face-sharing connection modes of NaQ 6 ligands: Na 3 ZnM III Q 4 (M III = In, Ga; Q = S, Se)13A Joint Strategy To Evaluate the Microscopic Origin of the Second-Harmonic-Generation Response in Nonpolar ABCO3F Compounds32Pb8M(BO3)6 (M = Mg, Ca): Two new borates with large birefringence activated by the ∞[Pb8B6O18]2- double layers6Recent advances in ultraviolet and deep-ultraviolet second-order nonlinear optical crystals256Deep-ultraviolet nonlinear optical materials: Development trend and innovative exploration16The relationship between covalent bonds and the optical response in a nonpolar family ATeMoO 6 (A=Mg, Zn, Cd): A Berry-phase investigation14Li3.366Mg0.317B2O5: The first pyroborate in the Li2O-MgO-B2O3 system1Second-order nonlinear optical crystals with mixed anions251Improved photo-dechlorination at polar photocatalysts K 3 B 6 O 10 X (X = Cl, Br) by halogen atoms-modulated polarization9Modulation of perovskite-related frameworks induced by alkaline earth metals in phosphate fluorides A 2 MPO 4 F (A = K, Rb; M = Ba, Ca)8Crystal structure of Ba2Co(BO3)23Transformation of Optical Anisotropy Origins in Perovskite-Related Materials: A First-Principles Study23355 nm Ultraviolet Nanosecond Lasers Produced by Frequency Doubling in K3B6O10Br Nonlinear Optical Crystal2Femtosecond green and ultraviolet lasers generated using second-harmonic generation based on K3B6O10Br nonlinear optical crystals2Sn2B5O9Br as an Outstanding Bifunctional Material with Strong Second‐Harmonic Generation Effect and Large Birefringence84Sn3B8O15: A Ternary Tin(II) Borate with Flexible [B8O18]12– Fundamental Building Block Formed by [B7O16]11– and [BO3]3– Groups10Computationally assisted multistage design and prediction driving the discovery of deep-ultraviolet nonlinear optical materials41Pb 2 TiFO(SeO 3 ) 2 Br: a new polar compound with the strongest second harmonic generation in the selenite bromide family29An Overview on Recent Trends in Deep‐Ultraviolet (DUV) and Ultraviolet (UV) Nonlinear Optical Crystals25Flux Growth and Properties of Volatile Bromine-Containing UV Nonlinear Optical Crystal K3B6O10Br3CsAB 8 O 12 F 2 ·CsI (A = K + , NH 4 + ): design of two fluorooxoborates with benign layered structures via a salt-inclusion strategy28Where the extraordinaries meet: a cascade of isosymmetrical superionic phase transitions and negative thermal expansion in a novel silver salt-inclusion borate halide16Two Mixed Alkali-Metal Borates Templated from Cations to Clusters10The Antiperovskite‐Type Oxychalcogenides Ae3Q[GeOQ3] (Ae = Ba, Sr; Q = S, Se) with Large Second Harmonic Generation Responses and Wide Band Gaps68Noncentrosymmetric versus Centrosymmetric: Halogen Induced Variable Coordination Modes of Sn2+ and Structural Transition in Sn3B3O7X (X = Cl and Br)17Li3B8O13X (X = Cl and Br): Two New Noncentrosymmetric Crystals with Large Birefringence Induced by BO3 Units18Ultraviolet Crystal with Strong Optical Nonlinearity by Creating Halogen-Centered Secondary Building Blocks15A novel contribution to the M3B6O10X hexaborate family: The new silver compound Ag3B6O10Br and thermal behavior of Ag3B6O10(NO3) and Na3B6O10I10Crystal growth and spontaneous polarization mechanism of polar metal borate halides: Mn 3 B 7 O 13 Cl2Exploration of antimony( iii ) oxyhalides via single-site substitution in quest of large birefringence10K3B6O10Br紫外非线性光学晶体研究进展（特邀）7Recent advances in rational structure design for nonlinear optical crystals: leveraging advantageous templates153Effects of magnesia and borax on the compressive strength and microstructure of phosphoric acid-activated metakaolin geopolymer14The synergistic enhancement of bending and compression properties of phosphate-activated metakaolin geopolymer by glass fiber and borax3Syntheses, Structures, and Characterization of Alkali-Metal Molybdates, A3Cl[Mo2O7] (A = K, Rb and Cs)3Heterocationic strategy to design a nonlinear optical crystal with a polar anti-perovskite structure7Λ‐Shaped Dimers Enables Polar Antiperovskites Through A‐Site Displacement Mechanism0

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  1. Growth, thermal and optical properties of a novel nonlinear optical material K 3 B 6 O 10 Cl

    CrystEngComm · 2011-10-19

    Hongping Wu, Shilie Pan, Hongwei Yu, Dianzeng Jia, Aiming Chang, Hongyi Li, Fangfang Zhang, Xia Huang

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  2. Top seeded solution growth and optical properties of a bromic borate crystal: K3B6O10Br

    Materials Letters · 2011-11-10

    Xiaoyun Fan, Min Zhang, Shilie Pan, Yun Mo Yang, Wenwu Zhao

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  3. Cation Effect in Doped BBO and Halogen Anion Effect in Pb2B5O9X (X− = I−, Br−, Cl−)

    Structure and bonding · 2012-01-01

    Yi‐Zhi Huang, Li‐Ming Wu, Maochun Hong

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  4. Li5Rb2B7O14: a new congruently melting compound with two kinds of B–O one-dimensional chains and short UV absorption edge

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  5. Structure, growth and properties of a novel polar material, KSr4B3O9

    Journal of Solid State Chemistry · 2012-01-20

    Wenwu Zhao, Shilie Pan, Yongjiang Wang, Zhihua Yang, Xian Wang, Jian Wei Han

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  6. New nonlinear optical potassium iodate K[IO3] and borates K3[B6O10]Br, KTa[B4O6(OH)4](OH)2·1.33H2O—Synthesis, structures and relation to the properties

    Journal of Solid State Chemistry · 2012-01-30

    Elena L. Belokoneva, S. Yu. Stefanovich, Olga V. Dimitrova

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  7. Li2Sr4B12O23: A new alkali and alkaline-earth metal mixed borate with [B10O18]6− network and isolated [B2O5]4− unit

    Journal of Solid State Chemistry · 2012-02-14

    Min Zhang, Shilie Pan, Jian Wei Han, Zhihua Yang, Xin Su, Wenwu Zhao

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  8. New Borate‐citrate: Synthesis, Structure, and Properties of Sr[B(C6H5O7)2](H2O)4·3H2O

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  9. Synthesis, structure and characterization of layered Ca[B(C6H6O7)2](H2O)4⋅HCl

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  10. Synthesis, growth, crystal structure and optical properties of BaBiBO4

    Inorganic Chemistry Communications · 2012-06-23

    Xiaoyu Dong, Shilie Pan, Feng Li, Yunjing Shi, Zhongxiang Zhou, Wenwu Zhao, Zhenjun Huang

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  11. Pb2B5O9Cl: a chloride borate with second harmonic generation effect

    Journal of Materials Science · 2012-12-05

    Zhaohui Chen, Shilie Pan, Zhihua Yang, Xiaoyu Dong, Xin Su, Yun Mo Yang

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  12. BaClBF4: a new noncentrosymmetric pseudo-Aurivillius type material with transparency range from deep UV to middle IR and a high laser damage threshold

    Journal of Materials Chemistry C · 2013-01-01

    Min Zhang, Shilie Pan, Zhihua Yang, Ying Wang, Xin Su, Yun Mo Yang, Zhenjun Huang, Shujuan Han, Kenneth Reinhard Poeppelmeier

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  13. Crystal growth and efficient second-harmonic-generation of the monoclinic LaCa4O(BO3)3 crystal

    CrystEngComm · 2013-01-01

    Yanqing Liu, Lei Wei, Fapeng Yu, Zhengping Wang, Yongguang Zhao, Shuo Han, Xian Zhao, Xinguang Xu

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  14. New tartratoborates: synthesis, structure, and characterization of non-centrosymmetric ASr[C4H2O6B(OH)2]·4H2O (A = K+, Rb+)

    Journal of Materials Chemistry A · 2013-01-01

    Xiaoyun Fan, Shilie Pan, Jing Kun Guo, Xueling Hou, Jian Wei Han, Fangfang Zhang, Feng Li, Kenneth Reinhard Poeppelmeier

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  15. Synthesis, crystal growth and characterization of a new noncentrosymmetric borophosphate: RbPbBP2O8

    CrystEngComm · 2013-01-01

    Ying Wang, Shilie Pan, Min Zhang, Shujuan Han, Xin Su, Lingyun Dong

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  16. New Molybdenum(VI) Phosphates: Synthesis, Characterization, and Calculations of Centrosymmetric RbMoO2PO4and Noncentrosymmetric Rb4Mo5P2O22

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    Ying Wang, Shilie Pan, Xin Su, Zhihua Yang, Lingyun Dong, Min Zhang

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  17. Exploration of a new compound in the M–B–O–X (M: alkali metals; X: halogen) system: Preparation, crystal and electronic structures, and optical properties of Na3B6O10Br

    Inorganica Chimica Acta · 2013-05-06

    Zhaohui Chen, Shilie Pan, Xiaoyu Dong, Zhihua Yang, Min Zhang, Xin Su

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  18. Synthesis and Structure of KPbBP 2 O 8 – A Congruent Melting Borophosphate with Nonlinear Optical Properties

    European Journal of Inorganic Chemistry · 2013-05-10

    Hongyi Li, Yi Zhao, Shilie Pan, Hongping Wu, Hongwei Yu, Fangfang Zhang, Zhihua Yang, Kenneth Reinhard Poeppelmeier

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  19. Sr3B6O11F2: a promising polar fluoroborate with short UV absorption edge and moderate second harmonic generation response

    Scripta Materialia · 2013-05-31

    Zhenjun Huang, Xin Su, Shilie Pan, Xiaoyu Dong, Shujuan Han, Hongwei Yu, Min Zhang, Yun Mo Yang, Sifang Cui, Zhihua Yang

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  20. Synthesis, crystal structure, optical properties and theoretical calculations of a new potassium lead pentaborate, KPbB5O9

    Journal of Molecular Structure · 2013-07-09

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  21. Crystal and local structure refinement in Ca 2 Al 3 O 6 F explored by X-ray diffraction and Raman spectroscopy

    Physical Chemistry Chemical Physics · 2013-11-05

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  22. Pb3B6O11F2: the first non-centrosymmetric lead borate fluoride with a large second harmonic generation response

    Journal of Materials Chemistry C · 2013-11-22

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  23. Computational design of inorganic nonlinear optical crystals based on a genetic algorithm

    CrystEngComm · 2014-01-01

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  24. Noncentrosymmetric versus Centrosymmetric: Influence of the Na+ Substitution on Structural Transition and Second-Harmonic Generation Property

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  25. Linear and Nonlinear Optical Properties of K3B6O10Br Single Crystal: Experiment and Calculation

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  26. Growth and nonlinear optical properties of K3B6O10Br crystal

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  27. The interaction between cations and anionic groups inducing SHG enhancement in a series of apatite-like crystals: A first-principles study

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  28. Effect of Halogen (Cl, Br) on the Symmetry of Flexible Perovskite-Related Framework

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  29. Effect of the cation size on the framework structures of magnesium tungstate, A 4 Mg(WO 4 ) 3 (A = Na, K), R 2 Mg 2 (WO 4 ) 3 (R = Rb, Cs)

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  30. Na 3 B 4 O 7 X (X = Cl, Br): two new borate halides with a 1D Na-X (X = Cl, Br) chain formed by the face-sharing XNa 6 octahedra

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  31. Synthesis and optical properties of the first lead borate bromide with isolated BO 3 groups: Pb 2 Ba 3 (BO 3 ) 3 Br

    Dalton Transactions · 2015-01-01

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  32. The synergistic effect between effective mass and built-in electric field for the transfer of carriers in nonlinear optical materials

    Physical Chemistry Chemical Physics · 2015-01-01

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  33. Simulated pressure-induced blue-shift of phase-matching region and nonlinear optical mechanism for K3B6O10X (X = Cl, Br)

    Applied Physics Letters · 2015-01-19

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  34. Second-harmonic generation at 532 nm in K_3B_6O_10Br crystal

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  35. The lone-pairs enhanced birefringence and SHG response: A DFT investigation on M2B5O9Cl (M=Sr, Ba, and Pb)

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  36. Recent development of metal borate halides: Crystal chemistry and application in second-order NLO materials

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  37. “XA 6 ” octahedra influencing the arrangement of anionic groups and optical properties in inverse-perovskite [B 6 O 10 ]XA 3 (X = Cl, Br; A = alkali metal)

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  38. Chemical engineering of mixed halide hexaborates as nonlinear optical materials

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  39. Nonlinear optical response mechanism of noncentrosymmetric lead borate Pb 6 [B 4 O 7 (OH) 2 ] 3 with three crystallographically independent [B 4 O 7 (OH) 2 ] 4− chains

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  40. Thermo-physical properties of nonlinear optical crystal K3B6O10Br

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    Mingjun Xia, Bo Xu, Lijuan Liu, Xiaoyang Wang, Rukang K. Li, Chuangtian Chen

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  41. Top-Seeded Solution Crystal Growth, Morphology, Optical and Thermal Properties of Ba3(ZnB5O10)PO4

    Crystal Growth & Design · 2016-05-23

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  42. A Deep-Ultraviolet Nonlinear Optical Crystal: Strontium Beryllium Borate Fluoride with Planar Be(O/F)3 Groups

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  43. Deep Ultraviolet Nonlinear Optical Materials

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  44. Positive and negative contribution to birefringence in a family of carbonates: A Born effective charges analysis

    Journal of Solid State Chemistry · 2016-09-09

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  45. Ba n+2 Zn n (BO 3 ) n (B 2 O 5 )F n (n = 1, 2): new members of the zincoborate fluoride series with two kinds of isolated B–O units

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  46. Bulk growth and magneto-optical property of K3B6O10Br polar crystal

    Journal of Crystal Growth · 2016-12-05

    Mingjun Xia, Changsheng Li, Rukang K. Li

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  47. Experimental and ab initio studies of Cd 5 (BO 3 ) 3 Cl: the first cadmium borate chlorine NLO material with isolated BO 3 groups

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  48. New lead( ii ) borates in the PbO/PbF 2 /H 3 BO 3 ternary phase diagram: syntheses and structures of β-Pb 6 B 10 O 21 and Pb 4 B 8 O 16

    New Journal of Chemistry · 2017-01-01

    Lingyun Dong, Liangliang Jia, Lijun Wang

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  49. Theoretical perspectives on the structure, electronic, and optical properties of titanosilicates Li 2 M 4 [(TiO)Si 4 O 12 ] (M = K + , Rb + )

    Physical Chemistry Chemical Physics · 2017-01-01

    Jinyu Hu, Zuju Ma, Rongjian Sa, Yongfan Zhang, Kechen Wu

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  50. Two haloid borate crystals with large nonlinear optical response

    Physical Chemistry Chemical Physics · 2017-01-01

    A.H. Reshak, S. Auluck

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