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RESEARCH PAPER · CrystEngComm · 2017

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

Weiguo Zhang, P. Shiv Halasyamani

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Crystal growth and optical properties of a UV nonlinear optical material KSrCO 3 FOriginalViewpoint: Inorganic Materials for UV and Deep-UV Nonlinear-Optical Applications207Synthesis, Structure, and Properties of Nonlinear Optical Crystal Na2SiF622Theoretical study on Pb2VO2F5: large birefringence derived from optical anisotropies of VO2F4 groups15Crystal Growth and Optical Properties of Beryllium-Free Nonlinear Optical Crystal K3Ba3Li2Al4B6O20F35Tailoring nonlinear optical crystal borophosphate through the introduction of transition metal d orbitals for improving optical anisotropy and SHG response: a first-principles investigation1NaCa4V5O17 with isolated V2O7 dimer and V3O10 trimer exhibiting a large birefringence18Na4Yb(CO3)3F: A New UV Nonlinear Optical Material with a Large Second Harmonic Generation Response8The linear and nonlinear optical response of CsGeX3 (X=Cl, Br, and I): The finite field and first-principles investigation26Designing an Excellent Deep-Ultraviolet Birefringent Material for Light Polarization533In situ visualization of the quasi-periodic crystal growth interface fluctuation by growth interface electromotive force spectrum in a Czochralski system11BaB8O12F2: a promising deep-UV birefringent material60CO(NH 2 ) 2 ·NH 4 Cl: an ultraviolet birefringent material with conjugated CO groups16Synthesis, characterization, and theoretical analysis of three new nonlinear optical materials K7MRE2B15O30 (M= Ca and Ba, RE= La and Bi)28Atom-Resolved Analysis of Birefringence of Nonlinear Optical Crystals by Bader Charge Integration55Emergent Deep‐Ultraviolet Nonlinear Optical Candidates324Neue Kandidaten für die nichtlineare Optik im Tief‐UV‐Bereich43Rb3Na(H2C3N3O3)4·3H2O with Large Birefringence28Structural Diversity and Giant Birefringence in Cyanates BaCNOX (X = Cl, Br, I, and CNO) Containing Linear π-Conjugated Units: A Combined Experimental and Theoretical Study13(NH 4 ) 3 [B(OH) 3 ] 2 (COOH) 3 : a graphite-like UV nonlinear optical material with a large birefringence via structural optimization31Hydroisocyanurates X 2 Y(H 2 C 3 N 3 O 3 ) 4 ·4H 2 O (X = K, Cs; Y = Zn, Cd) with large birefringence stemming from π-conjugated (H 2 C 3 N 3 O 3 ) − anions28Inorganic planar π-conjugated groups in nonlinear optical crystals: review and outlook145Structure-property relationship in nonlinear optical materials with π-conjugated CO3 triangles146CsHgNO3Cl2: A New Nitrate UV Birefringent Material Exhibiting an Optimized Layered Structure49NaZnCO 3 (OH): A High-Performance Carbonate Ultraviolet Nonlinear Optical Crystal Derived from KBe 2 BO 3 F 2194Synergism of multiple functional chromophores significantly enhancing the birefringence in layered non-centrosymmetric chalcohalides20The synthesis, characterization, and theoretical analysis of (NH 4 ) 3 PbCl 52Hydrogen-Bond-Assisted Alignment of [MCu(SeO 3 ) 4 Cl(H 2 O)] 4– (M = Fe, Ga) Anionic Layers to Form Two Polar Oxychlorides: Pb 2 MCu(SeO 3 ) 4 Cl(H 2 O)10BaTi(BO 3 ) 2 : an excellent birefringent material with highly coplanar isolated [BO 3 ] groups16K 2 Pb(H 2 C 3 N 3 O 3 ) 4 (H 2 O) 4 : a potential UV nonlinear optical material with large birefringence50Zn(NH 3 )CO 3 : a “three-in-one” UV nonlinear optical crystal built by a polar molecule bonding strategy18Different mechanism of stereochemical activity and birefringence in post-transition metal halides: A first-principles investigation1Cyanurates consisting of intrinsic planar π-conjugated 6-membered rings: An emerging source of optical functional materials111KCs2[Pb2Br5(HCOO)2]: A Polar 3D Lead‐Bromide Framework Exhibiting Strong Second‐Harmonic Generation Response10Structure, growth, characterization and anti-microbial activities of L-Isoleucinium-4-methylbenzenesulfonate monohydrate single crystals2Hierarchical Modulation of Optical Anisotropy Driven by Metal Cation Polyhedra in Fluorooxoborates MIIB4O6F2 (MII=Be, Mg, Pb, Zn, Cd)6KLi 2 CO 3 F: a beryllium-free KBBF-type deep-UV carbonate with an enhanced interlayer interaction and large birefringence20Potential optical functional crystals with large birefringence: Recent advances and future prospects322Inorganic nonlinear optical materials7Decentering the Symmetry via Docking B and F in the KBe2BO3F2-Family Structure0K 3 C 6 N 7 O 3 ·2H 2 O: A Multifunctional Nonlinear Optical Cyamelurate Crystal with Colossal π-Conjugated Orbitals44Li0.5Na0.5AlB2O4F2: Fluoroaluminoborate with Aligned 1∞[BO2] Chain Induced by Unprecedented [AlO3F3]6− Species Features Enhanced Birefringence30M(NH2SO3)2·xH2O (M = Ca, Pb, x = 0, 1, 4): Effect of Hydrogen Bonding on Structural Transformations and Second Harmonic Generation of Metal Sulfamates26Evaluating refractive index and birefringence of nonlinear optical crystals: Classical methods and new developments45Two Carboxylate-Cyanurates with Strong Optical Anisotropy and Large Band Gaps6Strategy for a Rational Design of Deep-Ultraviolet Nonlinear Optical Materials from Zeolites2(SO3CF3)−: A Non‐π‐Conjugated Motif for Nonlinear Optical Crystals Transparent into the Deep‐Ultraviolet Region23Sr(NH2SO3)(NO3)·H2O: An Ultraviolet Nonlinear Optical Material Exhibiting Strong Second-Harmonic Generation Response and Sufficient Birefringence10Mg(C 3 O 4 H 2 )(H 2 O) 2 : A New Ultraviolet Nonlinear Optical Material Derived from KBe 2 BO 3 F 2 with High Performance and Excellent Water‐Resistance7Mg(C3O4H2)(H2O)2: A New Ultraviolet Nonlinear Optical Material Derived from KBe2BO3F2 with High Performance and Excellent Water‐Resistance43Approach for quality deep-ultraviolet nonlinear optical crystals via a substitution strategy of channel species in zeolite3Strategically designed metal-free deep-ultraviolet birefringent crystals with superior optical properties18新型深紫外非线性光学晶体研究进展（特邀）9Two Short-Wave UV Antimony(III) Sulfates Exhibiting Large Birefringence18Rational Combination of π‐Conjugated and Non‐π‐Conjugated Groups Achieving Strong Nonlinear Optical Response, Large Optical Anisotropy, and UV Light‐Switchable Fluorescence65Nonlinear optical, dielectric, and piezoelectric properties of hexagonal fluorocarbonates ABCO3F (A: K, Rb, Cs; B: Mg, Ca, Sr, Zn, Cd, Pb) from first principles3Na3K6(CO3)3(NO3)2X·6H2O (X = NO3, Cl, Br): Exploring High-Performance UV Birefringent Crystals Induced by Coplanar π-Conjugated CO3 and NO3 Groups15Sulfate Derivatives with Heteroleptic Tetrahedra: New Deep‐Ultraviolet Birefringent Materials in which Weak Interactions Modulate Functional Module Ordering61Sulfate Derivatives with Heteroleptic Tetrahedra: New Deep‐Ultraviolet Birefringent Materials in which Weak Interactions Modulate Functional Module Ordering4Functional Modules Map of Unexplored Chemical Space: Guiding the Discovery of Giant Birefringent Materials76From B 3 O 3 (OH) 3 to B 3 O 3 F 3 : Uncovering Series of New Functional Units Based on [BO 2 F] Beneficial for Deep‐Ultraviolet Birefringence1Unveiling Noncentrosymmetric Pyridine Carboxylates from Centrosymmetric Templates through Motif Configuration Modulation in Zero-Dimensional System7Chiral-driven formation of hybrid cyanurates with large birefringence2The impact of anionic group arrangement on the optical properties of the arsenate series0层状结构深紫外非线性光学晶体研究进展（特邀）2Sr2Zn(C3N3O3)2: An Alkaline Earth and d10 Transition Metal Based Ultraviolet Cyanurate with Large Birefringence6[C 2 N 4 H 7 O][NH 2 SO 3 ]: High‐Performance Ultraviolet Nonlinear Optical Crystal with Ditrigon Coupled Guanylurea Group9[C 2 N 4 H 7 O][NH 2 SO 3 ]: High‐Performance Ultraviolet Nonlinear Optical Crystal with Ditrigon Coupled Guanylurea Group48K 7 MgY 2 (B 5 O 10 ) 3 : a novel ultraviolet nonlinear optical crystal based on the [B 5 O 10 ] functional unit2Layered perovskite-like nitrates A 2 Ca(NO 3 ) 2 Cl 2 (A = Rb, Cs) as ultraviolet birefringent optical materials3Synthesis and characterization of hydrated alkali metal calcium nitrates ACa(NO 3 ) 3 ·2H 2 O (A = NH 4 , Rb, Cs) as short ultraviolet birefringent materials0An Ultraviolet Transparent Nonlinear Optical Crystal Assembled from a Polarizable Tetrahedral Unit1Accelerating the discovery of athermal deep-ultraviolet nonlinear optical crystals via physics-informed herarchical graph learning1MZnCO3OH: A family of hydroxycarbonate nonlinear optical crystals in the UV and DUV regions0

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  1. Viewpoint: Inorganic Materials for UV and Deep-UV Nonlinear-Optical Applications

    Inorganic Chemistry · 2017-09-26

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

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

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  3. Theoretical study on Pb2VO2F5: large birefringence derived from optical anisotropies of VO2F4 groups

    Journal of Materials Science · 2017-11-13

    Zhaohui Chen, Zhizhong Zhang, Ronglan Wu, Xiaoyu Dong, Yunjing Shi, Qun Jing

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  4. Crystal Growth and Optical Properties of Beryllium-Free Nonlinear Optical Crystal K3Ba3Li2Al4B6O20F

    Crystal Growth & Design · 2017-12-28

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  5. Tailoring nonlinear optical crystal borophosphate through the introduction of transition metal d orbitals for improving optical anisotropy and SHG response: a first-principles investigation

    Materials Research Express · 2018-08-06

    Jinyu Hu, Jing Wei, Yongfan Zhang, Qiaohong Li, Kechen Wu

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  6. NaCa4V5O17 with isolated V2O7 dimer and V3O10 trimer exhibiting a large birefringence

    Journal of Solid State Chemistry · 2018-09-12

    Zhiqing Xie, Shichao Cheng, Shuwei Li, Hanqin Ding

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  7. Na4Yb(CO3)3F: A New UV Nonlinear Optical Material with a Large Second Harmonic Generation Response

    Crystals · 2018-09-30

    Qiaoling Chen, Min Luo, Chensheng Lin

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  8. 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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  9. Designing an Excellent Deep-Ultraviolet Birefringent Material for Light Polarization

    Journal of the American Chemical Society · 2018-11-12

    Xinglong Chen, Bingbing Zhang, Fangfang Zhang, Ying Wang, Min Zhang, Zhihua Yang, Kenneth Reinhard Poeppelmeier, Shilie Pan

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  10. In situ visualization of the quasi-periodic crystal growth interface fluctuation by growth interface electromotive force spectrum in a Czochralski system

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  11. BaB8O12F2: a promising deep-UV birefringent material

    Inorganic Chemistry Frontiers · 2018-12-25

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  12. CO(NH 2 ) 2 ·NH 4 Cl: an ultraviolet birefringent material with conjugated CO groups

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  13. Synthesis, characterization, and theoretical analysis of three new nonlinear optical materials K7MRE2B15O30 (M= Ca and Ba, RE= La and Bi)

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  14. Atom-Resolved Analysis of Birefringence of Nonlinear Optical Crystals by Bader Charge Integration

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  15. Emergent Deep‐Ultraviolet Nonlinear Optical Candidates

    Angewandte Chemie International Edition · 2019-12-10

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  16. Neue Kandidaten für die nichtlineare Optik im Tief‐UV‐Bereich

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  17. Rb3Na(H2C3N3O3)4·3H2O with Large Birefringence

    ACS Omega · 2019-12-13

    Mukeremu Aibibula, Li Wang, Shuzhao Huang

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  18. Structural Diversity and Giant Birefringence in Cyanates BaCNOX (X = Cl, Br, I, and CNO) Containing Linear π-Conjugated Units: A Combined Experimental and Theoretical Study

    Crystal Growth & Design · 2019-12-27

    Jian Tang, Xianghe Meng, Fei Liang, Kaijin Kang, Tixian Zeng, Mingjun Xia, Wenlong Yin, Zheshuai Lin, Bin Kang

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  19. (NH 4 ) 3 [B(OH) 3 ] 2 (COOH) 3 : a graphite-like UV nonlinear optical material with a large birefringence via structural optimization

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  20. Hydroisocyanurates X 2 Y(H 2 C 3 N 3 O 3 ) 4 ·4H 2 O (X = K, Cs; Y = Zn, Cd) with large birefringence stemming from π-conjugated (H 2 C 3 N 3 O 3 ) − anions

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  21. Inorganic planar π-conjugated groups in nonlinear optical crystals: review and outlook

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

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  23. CsHgNO3Cl2: A New Nitrate UV Birefringent Material Exhibiting an Optimized Layered Structure

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  24. NaZnCO 3 (OH): A High-Performance Carbonate Ultraviolet Nonlinear Optical Crystal Derived from KBe 2 BO 3 F 2

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  25. Synergism of multiple functional chromophores significantly enhancing the birefringence in layered non-centrosymmetric chalcohalides

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  26. The synthesis, characterization, and theoretical analysis of (NH 4 ) 3 PbCl 5

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  27. Hydrogen-Bond-Assisted Alignment of [MCu(SeO 3 ) 4 Cl(H 2 O)] 4– (M = Fe, Ga) Anionic Layers to Form Two Polar Oxychlorides: Pb 2 MCu(SeO 3 ) 4 Cl(H 2 O)

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  28. BaTi(BO 3 ) 2 : an excellent birefringent material with highly coplanar isolated [BO 3 ] groups

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  29. K 2 Pb(H 2 C 3 N 3 O 3 ) 4 (H 2 O) 4 : a potential UV nonlinear optical material with large birefringence

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  30. Zn(NH 3 )CO 3 : a “three-in-one” UV nonlinear optical crystal built by a polar molecule bonding strategy

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  31. Different mechanism of stereochemical activity and birefringence in post-transition metal halides: A first-principles investigation

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  32. Cyanurates consisting of intrinsic planar π-conjugated 6-membered rings: An emerging source of optical functional materials

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  33. KCs2[Pb2Br5(HCOO)2]: A Polar 3D Lead‐Bromide Framework Exhibiting Strong Second‐Harmonic Generation Response

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  34. Structure, growth, characterization and anti-microbial activities of L-Isoleucinium-4-methylbenzenesulfonate monohydrate single crystals

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  35. Hierarchical Modulation of Optical Anisotropy Driven by Metal Cation Polyhedra in Fluorooxoborates MIIB4O6F2 (MII=Be, Mg, Pb, Zn, Cd)

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  36. KLi 2 CO 3 F: a beryllium-free KBBF-type deep-UV carbonate with an enhanced interlayer interaction and large birefringence

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  37. Potential optical functional crystals with large birefringence: Recent advances and future prospects

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  38. Inorganic nonlinear optical materials

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  39. Decentering the Symmetry via Docking B and F in the KBe2BO3F2-Family Structure

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  40. K 3 C 6 N 7 O 3 ·2H 2 O: A Multifunctional Nonlinear Optical Cyamelurate Crystal with Colossal π-Conjugated Orbitals

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  41. Li0.5Na0.5AlB2O4F2: Fluoroaluminoborate with Aligned 1∞[BO2] Chain Induced by Unprecedented [AlO3F3]6− Species Features Enhanced Birefringence

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  42. M(NH2SO3)2·xH2O (M = Ca, Pb, x = 0, 1, 4): Effect of Hydrogen Bonding on Structural Transformations and Second Harmonic Generation of Metal Sulfamates

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  43. Evaluating refractive index and birefringence of nonlinear optical crystals: Classical methods and new developments

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  44. Two Carboxylate-Cyanurates with Strong Optical Anisotropy and Large Band Gaps

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  45. Strategy for a Rational Design of Deep-Ultraviolet Nonlinear Optical Materials from Zeolites

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  46. (SO3CF3)−: A Non‐π‐Conjugated Motif for Nonlinear Optical Crystals Transparent into the Deep‐Ultraviolet Region

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  47. Sr(NH2SO3)(NO3)·H2O: An Ultraviolet Nonlinear Optical Material Exhibiting Strong Second-Harmonic Generation Response and Sufficient Birefringence

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  48. Mg(C 3 O 4 H 2 )(H 2 O) 2 : A New Ultraviolet Nonlinear Optical Material Derived from KBe 2 BO 3 F 2 with High Performance and Excellent Water‐Resistance

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  49. Mg(C3O4H2)(H2O)2: A New Ultraviolet Nonlinear Optical Material Derived from KBe2BO3F2 with High Performance and Excellent Water‐Resistance

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  50. Approach for quality deep-ultraviolet nonlinear optical crystals via a substitution strategy of channel species in zeolite

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