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RESEARCH PAPER · Journal of the American Chemical Society · 2011

Inorganic Supramolecular Compounds with 3-D Chiral Frameworks Show Potential as Both Mid-IR Second-Order Nonlinear Optical and Piezoelectric Materials

Xiao‐Ming Jiang, Ming‐Jian Zhang, Hui‐Yi Zeng, Guo‐Cong Guo, Jin‐Shun Huang

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Inorganic Supramolecular Compounds with 3-D Chiral Frameworks Show Potential as Both Mid-IR Second-Order Nonlinear Optical and Piezoelectric MaterialsOriginalThe Frontier of Inorganic Synthesis and Preparative Chemistry (I)—Biomimetic Synthesis3A sixfold interpenetrated microporous MOF constructed from heterometallic tetranuclear cluster exhibiting selective gas adsorption29ChemInform Abstract: Inorganic Supramolecular Compounds with 3‐D Chiral Frameworks Show Potential as Both Mid‐IR Second‐Order Nonlinear Optical and Piezoelectric Materials.0NaGe 3 P 3 : a new ternary germanium phosphide featuring an unusual [Ge 3 P 7 ] ring22BaGa2MQ6 (M = Si, Ge; Q = S, Se): a new series of promising IR nonlinear optical materials199Large Crystal Growth and New Crystal Exploration of Mid-Infrared Second-Order Nonlinear Optical Materials56Synthesis and characterization of cobalt(iii) cyanide complexes: cobalt participation in the decomposition of radical anion of TCNQ4The first homochiral coordination polymer with temperature-independent piezoelectric and dielectric properties76Noncentrosymmetric Inorganic Open-Framework Chalcohalides with Strong Middle IR SHG and Red Emission: Ba3AGa5Se10Cl2 (A = Cs, Rb, K)257A new 1D Cd(II) pyridinate polymer: Structure, second-harmonic generation response, dielectric and potential ferroelectric properties13Coordination polymers constructed by diverse metal centers and the rigid ligand 3,5-di(1H-imidazol-1-yl)pyridine: Synthesis, structure and properties22Synthesis, Crystal Structure, and Optical Properties of a Three-Dimensional Quaternary Hg–In–S–Cl Chalcohalide: Hg7InS6Cl539Novel single-crystal's voltage-dependent effect and magnetic order of Ln2ZrQ5 (Ln = La, Sm, Gd; Q = S, Se) semiconductors31New Ce(iii) sulfate–tartrate-based MOFs: an insight into the controllable self-assembly of acentric metal–organic complexes10New mercury-contained cationic frameworks stabilized by (GaCl4)− unit via weak electrostatic forces in supramolecular compounds (Hg11P4)(GaCl4)4 and (Hg3AsS)(GaCl4)8Syntheses, crystal and electronic structures, and characterizations of the mixed anions compounds Ba4In2Te2Q5 (Q = S, Se)6Three unprecedent polycational templated cuprous thiocyanate networks: synthesis, structure, and properties15Mercury Bismuth Chalcohalides, Hg3Q2Bi2Cl8 (Q = S, Se, Te): Syntheses, Crystal Structures, Band Structures, and Optical Properties21Controlled Supramolecular Assembly of Helical Silica Nanotube–Graphene Hybrids for Chiral Transcription and Separation60Ab initio study of elasticity, piezoelectricity, and nonlinear optical performance in monoclinic NaAsSe226Chiral Coordination Polymers with SHG-Active and Luminescence: An Unusual Homochiral 3D MOF Constructed from Achiral Components164Large Mid-IR Second-Order Nonlinear-Optical Effects Designed by the Supramolecular Assembly of Different Bond Types without IR Absorption33Metal Chalcogenides: A Rich Source of Nonlinear Optical Materials680Ferroelectric Transition in the Inorganic Supramolecular Complex (Hg6P4)(CuCl3)210Five New Chalcohalides, Ba3GaS4X (X = Cl, Br), Ba3MSe4Cl (M = Ga, In), and Ba7In2Se6F8: Syntheses, Crystal Structures, and Optical Properties50The subtle effect of methyl substituent in C2-symmetric template on the formation of halocluster hybrids33Thallium Mercury Chalcobromides, TlHg6Q4Br5 (Q = S, Se)15Two new Cu(II) m-hydroxybenzoato complexes with chloro- and carboxylato-bridged dinuclear [Cu(µ2−Cl)(µ2−COO)Cu] cores6Three‐Dimensional Mercury Pnictide [Hg4Z2]2+ Cationic Frameworks Stabilized by Tetravalent Metal Halide Anions in Supramolecular Complexes: [Hg4Z2][MCl6] (Z = P, As; M = Zr, Hf)4Synthesis, structure and property of Ni(II) coordination polymers with mixed dicarboxylate and benzoimidazol-containing ligands11Syntheses, structural characterizations and ferroelectric properties of new Ce(III) coordination polymers via isomeric tartaric acid ligands12A novel 3D self-catenated coordination polymer with multiform helical chains8Noncentrosymmetric chalcohalide NaBa 4 Ge 3 S 10 Cl with large band gap and IR NLO response104Six cation-templated halometal complexes and C–H activation of alkylene-bridged azoles3A Highly Stable 3D Acentric Zinc Metal–Organic Framework Based on Two Symmetrical Flexible Ligands: High Second-Harmonic-Generation Efficiency and Tunable Photoluminescence32Three new chalcohalides, Ba4Ge2PbS8Br2, Ba4Ge2PbSe8Br2 and Ba4Ge2SnS8Br2: Syntheses, crystal structures, band gaps, and electronic structures4Large and Fast Single‐Crystal Resistive Humidity Sensitivity of Metal Pnictide Halides Containing van der Waals Host–Guest Interactions10Auxiliary ligand-assisted two novel one-dimensional indium coordination polymers: Synthesis, crystal structures and photoluminescence characterization effected by solvent and temperature4Self-assembly of five new organic–inorganic hybrids based on two new flexible tricationic templates7A study on K 2 SbF 2 Cl 3 as a new mid-IR nonlinear optical material: new synthesis and excellent properties55Recent advances on second-order NLO materials based on metal iodates328Combined Effect of Hydrogen Bonding and π···π Stacking Interactions in the Assembly of Indium(III) Metal–Organic Materials: Structure-Directing and Aggregation-Induced Emission Behavior35Hg5AsS2I3 – A Narrow‐Band‐Gap 2D Layered Compound with Different Trapped I– Anions4Five hybrid thiocyanate networks oriented by polyvalent cationic templates: Synthesis, structure and properties10Sm3S3BO3: The First Sulfide Borate without S–O and B–S Bonds46Partial Geometric Frustration in Inorganic Supramolecular Spin Systems with One-Dimensional Trigonally Aligned Magnetic Chains ∞1(MCl4)2− (M = Fe2+, Co2+)4Manifestation of helicity in one-dimensional iodobismuthate26Self-assembly of two supramolecular indium( iii ) metal–organic frameworks for reversible iodine capture and large band gap change semiconductor behavior21Synthesis, crystal structure and second-order nonlinear optical property of a novel pentanary selenide (K 3 I)[InB 12 (InSe 4 ) 3 ]48Ba 3 FeS 4 Br: A 0D Iron‐Based Chalcohalide with Unusual Magnetic Properties9Strong Infrared NLO Tellurides with Multifunction: CsXII4In5Te12 (XII = Mn, Zn, Cd)58Na 2 ZnGe 2 S 6 : A New Infrared Nonlinear Optical Material with Good Balance between Large Second-Harmonic Generation Response and High Laser Damage Threshold302Direct Gap Semiconductors Pb2BiS2I3, Sn2BiS2I3, and Sn2BiSI544Cooperation of Three Chromophores Generates the Water‐Resistant Nitrate Nonlinear Optical Material Bi3TeO6OH(NO3)2113Cooperation of Three Chromophores Generates the Water‐Resistant Nitrate Nonlinear Optical Material Bi3TeO6OH(NO3)220Non‐centrosymmetric Selenides AZn4In5Se12 (A=Rb, Cs): Synthesis, Characterization and Nonlinear Optical Properties47Phase Transition and Second Harmonic Generation in Thiophosphates Ag2Cd(P2S6) and AgCd3(PS4)S2 Containing Two Second-Order Jahn–Teller Distorted Cations47Recent achievements on middle and far-infrared second-order nonlinear optical materials433Frontier of Inorganic Synthesis and Preparative Chemistry (I) Biomimetic Synthesis8Li 2 CdGeSe 4 and Li 2 CdSnSe 4 : biaxial nonlinear optical materials with strong infrared second-order responses and laser-induced damage thresholds influenced by photoluminescence54Thioborates: potential nonlinear optical materials with rich structural chemistry51Two excellent phase-matchable infrared nonlinear optical materials based on 3D diamond-like frameworks: RbGaSn 2 Se 6 and RbInSn 2 Se 639Superpolyhedron-Built Second Harmonic Generation Materials Exhibit Large Mid-Infrared Conversion Efficiencies and High Laser-Induced Damage Thresholds101Unusually Flexible Indium(III) Metal–Organic Polyhedra Materials for Detecting Trace Amounts of Water in Organic Solvents and High Proton Conductivity32A review of the structural chemistry and physical properties of metal chalcogenide halides147Controlled Zn 2+ -Triggered Drug Release by Preferred Coordination of Open Active Sites within Functionalization Indium Metal Organic Frameworks70Large Second-Harmonic Generation Responses Achieved by the Dimeric [Ge2Se4(μ-Se2)]4– Functional Motif in Polar Polyselenides A4Ge4Se12 (A = Rb, Cs)49Metal-inorganic frameworks with pnictogen linkers17Absorption and Mid-IR SHG in Two-Dimensional Halogen and Hydrogen Saturated Silicene Series12Investigation on synthesis, growth, structure and physical properties of AgGa0.5In0.5S2 single crystals for Mid-IR application6A new pnictidehalide with van der Waals host–guest interactions exhibiting both geometric spin frustration and resistive humidity sensitivity2Four new quaternary chalcogenides A 2 Ba 7 Sn 4 Q 16 (A = Li, Na; Q = S, Se): syntheses, crystal structures determination, nonlinear optical performances investigation26From AgGaS2 to Li2ZnSiS4: Realizing Impressive High Laser Damage Threshold Together with Large Second-Harmonic Generation Response134Novel tetracationic template and application in construction metal thiocyanate polymers4MgSiAs: An Unexplored System with Promising Nonlinear Optical Properties53Recent advances and future perspectives on infrared nonlinear optical metal halides223Modulating photoelectronic performance of metal–organic frameworks for premium photocatalysis155Molecular tectonics: from a rigid achiral organic tecton to 3D chiral Co and Fe coordination networks18ASbF3Cl (A = Rb, Cs): Structural Evolution from Centrosymmetry to Noncentrosymmetry16KBiCl2SO4: The First Bismuth Chloride Sulfate Being Second-Order Nonlinear Optical Active44Mixed-Anion Inorganic Compounds: A Favorable Candidate for Infrared Nonlinear Optical Materials140Synthesis, crystal structure, and optical properties of Ba2SbO2SX (X = Br, I) oxy-chalcohalides4LiBa2MIIIQ4 (MIII = Al, Ga, In; Q = S, Se): A Series of Metal Chalcogenides with a Structural Transition12Ba 13 In 12 Zn 7 S 38 and Ba 12 In 12 Zn 8 Se 38 : infrared nonlinear optical chalcogenides designed by zinc-induced non-centrosymmetry transformation22Li 2 CdSiS 4 , a promising IR NLO material with a balanced E g and SHG response originating from the effect of Cd with d 10 configuration36LiGa0.54In0.46S2: A new infrared nonlinear optical material with large laser damage threshold designed by gallium substitution in LiInS223Lead Mixed Oxyhalides Satisfying All Fundamental Requirements for High‐Performance Mid‐Infrared Nonlinear Optical Materials164Lead Mixed Oxyhalides Satisfying All Fundamental Requirements for High‐Performance Mid‐Infrared Nonlinear Optical Materials55Structure-property survey and computer-assisted screening of mid-infrared nonlinear optical chalcohalides114Hierarchical Contribution of Anions to Second Harmonic Generation in A2HgI4 (A = Na, Ag, Cu) Regulated Dramatically by Metal Cations4Chiral Template‐Driven Macroscopic Chirality Control: Structure‐Second‐Harmonic Generation Properties Relationship24Recent Achievements in Lone-Pair Cation-Based Infrared Second-Order Nonlinear Optical Materials95RbPb 8 O 4 Cl 9 : the first alkali metal lead oxyhalide with distorted [PbO 3 Cl 3 ] and [PbOCl 5 ] mixed-anion groups6Synthesis, characterization and theoretical investigation of a new chalcohalide, Ba 4 GaS 4 F 311Indium(III) in the “Periodic Table” of Di(2-pyridyl) Ketone: An Unprecedented Transformation of the Ligand and Solid-State 115In NMR Spectroscopy as a Valuable Structural Tool9A supertetrahedral T2 [Mn4Ce6] cluster showing second-harmonic generation response0Zero dimensional iodobismuthate: Synthesis and optical property0Achieving a strong second harmonic generation response and a wide band gap in a Hg-based material41AIn 4 S 6 Cl (A = Rb and Cs) and Pb 5 Sn 3 Q 10 Cl 2 (Q = S and Se): quaternary chalcohalides with mixed anionic coordination exhibit photocurrent responses11Material research from the viewpoint of functional motifs103Boosting Electrocatalytic Hydrogen Evolution with Anodic Oxidative Upgrading of Formaldehyde over Trimetallic Carbides15RbBiP2S6: A Promising IR Nonlinear Optical Material with a Giant Second-Harmonic Generation Response Designed by Aliovalent Substitution80Coordination metal effect on the nonlinear optical properties and biological activity of double selenates8[Ba2F2][Ge2O3S2]: An Unprecedented Heteroanionic Infrared Nonlinear Optical Material Containing Three Typical Anions47LiAlS2: A promising infrared frequency-conversion material with ultrawide band gap and high laser-induced damage threshold19AIB3IIC3IIIQ8VI: A New Family for the Design of Infrared Nonlinear Optical Materials by Coupling Octahedra and Tetrahedra Units152Trade-Off for Better Balanced Nonlinear Optical Performance with Disordered Si in ZnGeP217The first polyanion-substitution-driven centrosymmetric-to-noncentrosymmetric structural transformation realizing an excellent nonlinear optical supramolecule [Cd 4 P 2 ][CdBr 4 ]17Polar Phosphorus Chalcogenide Cage Molecules: Enhancement of Nonlinear Optical Properties in Adducts39Polar Phosphorus Chalcogenide Cage Molecules: Enhancement of Nonlinear Optical Properties in Adducts1HgB2S4: A d10 Metal Thioborate with Giant Birefringence and Wide Band Gap31Flexible Anionic Groups‐Activated Structure Dissymmetry for Strong Nonlinearity in Ln 2 Ae 3 M IV 3 S 12 Family16Na 2 CeF 6 : A Highly Laser Damage‐Tolerant Double Perovskite Type Ce(IV) Fluoride Exhibiting Strong Second‐Harmonic Generation Effect30Halogen-assisted octet binding electrons construction of pnictogens towards wide-bandgap nonlinear optical pnictides17EuSi7P10: An Inorganic Supramolecular Nonlinear Optical Crystal Exhibiting Strong Second-Harmonic Generation Response4Structure‐Prediction‐Oriented Synthesis of Thiophosphates as Promising Infrared Nonlinear Optical Materials24Structure‐Prediction‐Oriented Synthesis of Thiophosphates as Promising Infrared Nonlinear Optical Materials1Non-centrosymmetric structures designed rationally via a “dimensionality addition” strategy toward the promising nonlinear optical family [A–X][In–Se] (A = K/Ba and Rb/Ba; X = Cl and Br)13One-Dimensional Perovskite RbGeI3 with Large Optical Anisotropy3Design of rare earth borate short-wave UV nonlinear optical crystals with strengthened second harmonic generation activities via cationic modification strategy11Relativistic Effect Engineered Ag 2 Hg 1– x Cd x I 4 Crystals: Achieving Optimal Balance between Bandgap and Nonlinear Optical Performance2Structural Symmetry and Mixed‐anion Engineering in Halopnictides for Extraordinary Second‐Harmonic Generation6Structural Symmetry and Mixed‐anion Engineering in Halopnictides for Extraordinary Second‐Harmonic Generation4Strategic Integration Between Trigonal Architecture Construction and Molecular Polarization Enhancement for Record SHG Effect in Selenates4Strategic Integration Between Trigonal Architecture Construction and Molecular Polarization Enhancement for Record SHG Effect in Selenates0Modulation of single order nonlinear optical materials to multi-order multi-functional nonlinear optical materials based on bis-(styryl)benzene derivatives1Exploration of the influence of exchange-correlation functionals and hydrostatic pressure on the physical properties of recently synthesized nonlinear optical material Na2CeF60Chiral Piezoelectric Inorganic and Inorganic Hybrid Nanomaterials for Flexible Electronics and Optoelectronic Applications0Hierarchical Ordering Decouples the SHG–Birefringence–LIDT Trade‐Off in a Single‐Phase Mid‐Infrared Nonlinear Optical Crystal0Hierarchical Ordering Decouples the SHG–Birefringence–LIDT Trade‐Off in a Single‐Phase Mid‐Infrared Nonlinear Optical Crystal0Solution-Grown Cs2HgI4 Bulk Crystals: Achieving Strong SHG and High Damage Threshold Synergistically for IR Nonlinear Optics1Beyond the bandgap bottleneck: structure–property design principles for infrared nonlinear optical phosphides0

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  44. Five hybrid thiocyanate networks oriented by polyvalent cationic templates: Synthesis, structure and properties

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  47. Manifestation of helicity in one-dimensional iodobismuthate

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