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RESEARCH PAPER · Journal of the American Chemical Society · 2010

Pb 2 B 5 O 9 I: An Iodide Borate with Strong Second Harmonic Generation

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Pb 2 B 5 O 9 I: An Iodide Borate with Strong Second Harmonic GenerationOriginalBiosynthesis and biological activity of enniatins49ChemInform Abstract: Pb2B5O9I: An Iodide Borate with Strong Second Harmonic Generation.0Bulk crystal growth and characterization of a new polar polymorph of BaTeMo2O9: α-BaTeMo2O998New Second-Order NLO Materials Based on Polymeric Borate Clusters and GeO4 Tetrahedra: A Combined Experimental and Theoretical Study69Synthesis, crystal structure and optical properties of a new lead fluoride borate with isolated [B9O21]15− unit25In-Phase Alignments of Asymmetric Building Units in Ln 4 GaSbS 9 (Ln = Pr, Nd, Sm, Gd−Ho) and Their Strong Nonlinear Optical Responses in Middle IR212Explorations of New Second-Order Nonlinear Optical Materials in the Potassium Vanadyl Iodate System268Structures and properties of functional metal iodates72Polymorphism of BaTeMo 2 O 9 : A New Polar Polymorph and the Phase Transformation186“A” Cation Polarity Control in ACuTe2O7 (A = Sr2+, Ba2+, or Pb2+)52Synthesis, crystal structure and optical properties of the new lead fluoride borate—Pb2BO3F41Growth, thermal and optical properties of a novel nonlinear optical material K 3 B 6 O 10 Cl57Synthesis, structure characterization and optical properties of a new lead cadmium borate27A new congruent-melting oxyborate, Pb 4 O(BO 3 ) 2 with optimally aligned BO 3 triangles adopting layered-type arrangement112Anisotropic thermal properties of the polar crystal Cs2TeMo3O1224A novel deep UV nonlinear optical crystal Ba3B6O11F2, with a new fundamental building block, B6O14 group180Cadmium-rare earth oxyborates Cd4ReO(BO3)3 (Re = Y, Gd, Lu): congruently melting compounds with large SHG responses65Cation Effect in Doped BBO and Halogen Anion Effect in Pb2B5O9X (X− = I−, Br−, Cl−)1Electronic structures and optical properties of AAl2C4 (A=Zn, Cd, Hg; C=S, Se) semiconductors1PbPt(IO3)6(H2O): a new polar material with two types of stereoactive lone-pairs and a very large SHG response80Second-Order Nonlinear Optical Materials Based on Metal Iodates, Selenites, and Tellurites60Crystal structures and second-order NLO properties of borogermanates59Noncentrosymmetric Inorganic Open-Framework Chalcohalides with Strong Middle IR SHG and Red Emission: Ba3AGa5Se10Cl2 (A = Cs, Rb, K)257UV Nonlinear Optical Crystal Ba2[B6O9(OH)4] Featuring Unique Chiral Layers with a New B18O42 Circle Based on BO3 and BO4 Units97New 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 properties35Synthesis, crystal structure and properties of a new lead fluoride borate, Pb3OBO3F17Two New Noncentrosymmetric (NCS) Polar Oxides: Syntheses, Characterization, and Structure–Property Relationships in BaMTe2O7 (M = Mg2+ or Zn2+)50First-principles studies on linear and nonlinear optical effects in Ln4GaSbS9 (Ln=Ce–Nd, Sm, Gd–Tm, Lu)9Growth and optical properties of Na3Gd2(BO3)3 crystal11Leucostaurite, Pb2[B5O9]Cl{middle dot}0.5H2O, from the Atacama Desert: The first Pb-dominant member of the hilgardite group, and micro-determination of boron in minerals by PIGE8Exploratory Investigation of New SHG Materials Based on Galloborates46Strain-induced improvements on linear and nonlinear optical properties of SrB4O7 crystal19Na3Cd3B(PO4)4: A New Noncentrosymmetric Borophosphate with Zero-Dimensional Anion Units81An unusual seven-connected lead borate constructed by different cluster building units of {B 6 } and {Pb 6 }19M2Cd3B16O28 (M = Rb, Cs): Two Isostructural Alkali Cadmium Borates with a New Type of Borate Layer29Pb2B5O9Cl: a chloride borate with second harmonic generation effect40A combination of multiple chromophores enhances second-harmonic generation in a nonpolar noncentrosymmetric oxide: CdTeMoO681Electronic Structures and Optical Properties of Organic DAST and DSTMS Crystal Materials6Growth, optical and electrical properties of a nonlinear optical crystal NaBa4Al2B8O18Cl315Na2Cd7B8O20: a new noncentrosymmetric compound with special [B3O7] units20Pb2TiOF(SeO3)2Cl and Pb2NbO2(SeO3)2Cl: small changes in structure induced a very large SHG enhancement117Synthesis, crystal growth and characterization of a new noncentrosymmetric borophosphate: RbPbBP2O836Synthesis, structure, and characterization of a new promising nonlinear optical crystal: Cd5(BO3)3F42Cs2B4SiO9: A Deep‐Ultraviolet Nonlinear Optical Crystal278Cs2B4SiO9: A Deep‐Ultraviolet Nonlinear Optical Crystal224Boric acid flux synthesis, structure and magnetic property of MB12O14(OH)10 (M=Mn, Fe, Zn)12Synthesis, crystal structure and optical properties of a new lithium dilead pentaborate, LiPb2B5O105Crystal structure, growth and characterization of LiPbB9O15: A new congruent melting nonlinear optical crystal26Ab initio study of elasticity, piezoelectricity, and nonlinear optical performance in monoclinic NaAsSe226Zn2(VO4)(IO3): A Novel Polar Zinc(II) Vanadium(V) Iodate with a Large SHG Response94New Salt-Inclusion Borate, Li3Ca9(BO3)7·2[LiF]: A Promising UV NLO Material with the Coplanar and High Density BO3 Triangles56Ba2Cd(B3O6)2: A Congruent‐Melting Compound with Isolated B3O6 Units8Na 11 B 21 O 36 X 2 (X=Cl, Br): Halogen Sodium Borates with a New Graphene‐Like Borate Double Layer38Exploration 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 Na3B6O10Br19Facile Assembly of an Unusual Lead Borate with Different Cluster Building Units via a Hydrothermal Process38Syntheses, crystal structures, and optical properties of Pb6B3O10X (X=F, Cl, Br)16Pb2B3O5.5(OH)2 and [Pb3(B3O7)](NO3): Facile Syntheses of New Lead(II) Borates by Simply Changing the pH Values of the Reaction Systems55Synthesis, crystal structure, optical properties and theoretical calculations of a new potassium lead pentaborate, KPbB5O92Chiral and Noncentrosymmetric Metal–Organic Frameworks Featuring a 2D → 3D Parallel/Parallel Inclined Subpolycatenation27Syntheses, Structures, and Nonlinear Optical Properties of Quaternary Chalcogenides: Pb4Ga4GeQ12 (Q = S, Se)60Functionalization Based on the Substitutional Flexibility: Strong Middle IR Nonlinear Optical Selenides AXII4XIII5Se12219SrGe2B2O8 and Sr3Ge2B6O16: Novel Strontium Borogermanates with Three-Dimensional and Layered Anionic Architectures50Synthesis, structure, and characterization of a new rubidium cadmium borate: RbCdB3O68CsPbCO3F: A Strong Second-Harmonic Generation Material Derived from Enhancement via p−π Interaction272Deep-Ultraviolet Nonlinear Optical Crystals: Ba3P3O10X (X = Cl, Br)459Ba4(BO3)3(SiO4)·Ba3X (X = Cl, Br): new salt-inclusion borosilicate halides as potential deep UV nonlinear optical materials58Incorporating [GaB 4 O 11 (OH)] 8− clusters to construct luminescent galloborate with open-framework layers18Sodium–rare earth carbonates with shorite structure and large second harmonic generation response44Synthesis and characterization of Cd 4 YbO(BO 3 ) 3 – a congruent melting cadmium–ytterbium oxyborate with large nonlinear optical properties11Syntheses, characterization and nonlinear optical properties of a bismuth subcarbonate Bi2O2CO363A New UV Nonlinear Optical Material CsZn2B3O7: ZnO4 Tetrahedra Double the Efficiency of Second-Harmonic Generation121Investigation of the second-order nonlinear optical properties of Cs2TeMo3O12 single crystal31A Nitrate Nonlinear Optical Crystal Pb16(OH)16(NO3)16 with a Large Second-Harmonic Generation Response57Li2CdGeS4, A Diamond-Like Semiconductor with Strong Second-Order Optical Nonlinearity in the Infrared and Exceptional Laser Damage Threshold193Series of Lead Oxide Hydroxide Nitrates Obtained by Adjusting the pH Values of the Reaction Systems32Linear and Nonlinear Optical Properties of K3B6O10Br Single Crystal: Experiment and Calculation81First-principles materials applications and design of nonlinear optical crystals259Pb 4 V 6 O 16 (SeO 3 ) 3 (H 2 O), Pb 2 VO 2 (SeO 3 ) 2 Cl, and PbVO 2 (SeO 3 )F: New Lead(II)–Vanadium(V) Mixed-Metal Selenites Featuring Novel Anionic Skeletons67Synthesis and Characterization of the New Strontium Borogermanate Sr3–x/2B2–xGe4+xO14 (x = 0.32)16Effect of Halogen (Cl, Br) on the Symmetry of Flexible Perovskite-Related Framework36An Acentric Calcium Borate Ca2[B5O9]·(OH)·H2O: Synthesis, Structure, and Nonliner Optical Property94Dispersion of the linear and nonlinear optical susceptibilities of Bismuth subcarbonate Bi2O2CO3: DFT calculations12Lanthanum Lead Oxide Hydroxide Nitrates with a Nonlinear Optical Effect30The electronic, optical and ferroelectric properties of BiFeO3 during polarization reversal: A first principle study29Synthesis and structural characterization of a new rubidium borosulfate, Rb5BS4O1616Anomalous second-harmonic generation response in SrBPO 5 and BaBPO 541An outstanding second-harmonic generation material BiB 2 O 4 F: exploiting the electron-withdrawing ability of fluorine92ACdCO 3 F (A = K and Rb): new noncentrosymmetric materials with remarkably strong second-harmonic generation (SHG) responses enhanced via π-interaction61Ba 4 AgGa 5 Pn 8 (Pn = P, As): new pnictide-based compounds with nonlinear optical potential30Effect of cation substitution on structural transition: synthesis, characterization and theoretical studies of NaCa 4 B 3 O 9 , NaCaBO 3 , NaSrBO 3 and Li 4 CaB 2 O 618Evidence of “new hot spots” from determining the nonlinear optical behavior of materials: mechanistic studies of the vanadium borate crystal, Na 3 VO 2 B 6 O 1116Hierarchical Ba 2 (B 5 O 9 )Cl·(H 2 O) 0.5 microspheres: surfactant-assisted facile hydrothermal synthesis, Tb 3+ doping and photoluminescence properties12Na 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 octahedra13Sr 2 (OH) 3 NO 3 : the first nitrate as a deep UV nonlinear optical material with large SHG responses166Synthesis and optical properties of the first lead borate bromide with isolated BO 3 groups: Pb 2 Ba 3 (BO 3 ) 3 Br26Theoretical perspective of the lone pair activity influence on band gap and SHG response of lead borates24Recent advances on second-order NLO materials based on metal iodates328A Facile Synthetic Route to a New SHG Material with Two Types of Parallel π‐Conjugated Planar Triangular Units287A Facile Synthetic Route to a New SHG Material with Two Types of Parallel π‐Conjugated Planar Triangular Units59Tailored Synthesis of a Nonlinear Optical Phosphate with a Short Absorption Edge241Tailored Synthesis of a Nonlinear Optical Phosphate with a Short Absorption Edge60Strong IR NLO Material Ba4MGa4Se10Cl2: Highly Improved Laser Damage Threshold via Dual Ion Substitution Synergy97Pb7O(OH)3(CO3)3(BO3): First Mixed Borate and Carbonate Nonlinear Optical Material Exhibiting Large Second-Harmonic Generation Response74Cs(TaO 2 ) 3 (SeO 3 ) 2 and Cs(TiOF) 3 (SeO 3 ) 2 : Structural and Second Harmonic Generation Changes Induced by the Different d 0 -TM Coordination Octahedra67The lone-pairs enhanced birefringence and SHG response: A DFT investigation on M2B5O9Cl (M=Sr, Ba, and Pb)48Ab-initio study on the electronic, optical and ferroelectric properties of LiOsO313Syntheses, Characterization, and Optical Properties of Centrosymmetric Ba3(BS3)1.5(MS3)0.5 and Noncentrosymmetric Ba3(BQ3)(SbQ3)47Pb2Ba3(BO3)3Cl: A Material with Large SHG Enhancement Activated by Pb-Chelated BO3 Groups279Linear optical and thermo-physical properties of polar K3B6O10Cl crystal21Synthesis, crystal structures and properties of lead phosphite compounds27Metal Thiophosphates with Good Mid-infrared Nonlinear Optical Performances: A First-Principles Prediction and Analysis441K2Pb3(CO3)3F2 and KCdCO3F: Novel Fluoride Carbonates with Layered and 3D Framework Structures42Sm3S3BO3: The First Sulfide Borate without S–O and B–S Bonds46Li 3 AlSiO 5 : the first aluminosilicate as a potential deep-ultraviolet nonlinear optical crystal with the quaternary diamond-like structure54Bidenticity-Enhanced Second Harmonic Generation from Pb Chelation in Pb3Mg3TeP2O14169Pb4(OH)4(BrO3)3(NO3): An Example of SHG Crystal in Metal Bromates Containing π-Conjugated Planar Triangle59Versatile Coordination Mode of LiNaB8O13 and α- and β-LiKB8O13 via the Flexible Assembly of Four-Connected B5O10 and B3O7 Groups19Synthesis and characterization of CsSrCO 3 F – a beryllium-free new deep-ultraviolet nonlinear optical material34Recent development of metal borate halides: Crystal chemistry and application in second-order NLO materials340Active performance of tetrahedral groups to SHG response: theoretical interpretations of Ge/Si-containing borate crystals3Chemical engineering of mixed halide hexaborates as nonlinear optical materials5Experimental and theoretical studies on the linear and nonlinear optical properties of lead phosphate crystals LiPbPO 474KPb 2 (PO 3 ) 5 : a novel nonlinear optical lead polyphosphate with a short deep-UV cutoff edge109Li 3 Cs 2 M 2 B 3 P 6 O 24 (M = Pb, Sr): borophosphates with double six-membered ring of [BP 2 O 8 ] 3−22New fluoroborate Cd 8 B 5 O 15 F with two different isolated borate anions prepared by an open high-temperature solution method7Structural variety in zinc telluro-phosphates: syntheses, crystal structures and characterizations of Sr 2 Zn 3 Te 2 P 2 O 14 , Pb 2 Zn 3 Te 2 P 2 O 14 and Ba 2 Zn 2 TeP 2 O 1119The effect of indium substitution on the structure and NLO properties of Ba 6 Cs 2 Ga 10 Se 20 Cl 446New Series of Polar and Nonpolar Platinum Iodates A2Pt(IO3)6 (A = H3O, Na, K, Rb, Cs)33NaBa4(GaB4O9)2X3 (X = Cl, Br) with NLO-Active GaO4 Tetrahedral Unit: Experimental and ab Initio Studies25Structure modulations in nonlinear optical (NLO) materials Cs2TB4O9(T= Ge, Si)14Synthesis and structure of a new halophosphate Sr 3 P 3 O 10 Cl with the flexible [P 3 O 10 ] 5− anions9Strong Infrared NLO Tellurides with Multifunction: CsXII4In5Te12 (XII = Mn, Zn, Cd)58Rb2Na(NO3)3: A Congruently Melting UV-NLO Crystal with a Very Strong Second-Harmonic Generation Response71Synthesis, Characterization, and Theoretical Studies of (Pb4O)Pb2B6O14: A New Lead(II) Borate with Isolated Oxygen-Centered Pb4O Tetrahedra and Large Second Harmonic Generation Response41Deep‐Ultraviolet Nonlinear Optics in a Borate Framework with 21‐Ring Channels109Ln2Ga[B3O6(OH)]2[B7O9(OH)2](CH3CO2)2 (Ln = Y, Sm, Eu, Gd, Dy): A Series of Lanthanide Galloborates Decorated by Acetate Anions26Pb2BO3Cl: A Tailor‐Made Polar Lead Borate Chloride with Very Strong Second Harmonic Generation382Pb2BO3Cl: A Tailor‐Made Polar Lead Borate Chloride with Very Strong Second Harmonic Generation129Deep-Ultraviolet Transparent Cs 2 LiPO 4 Exhibits an Unprecedented Second Harmonic Generation160LnBSb2O8 (Ln = Sm, Eu, Gd, Tb): A Series of Lanthanide Boroantimonates with Unusual 3D Anionic Structures15“All-Three-in-One”: A New Bismuth–Tellurium–Borate Bi3TeBO9 Exhibiting Strong Second Harmonic Generation Response223Cooperation 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)220A nanosized aluminoborate (PKU-5) with Cr-centered octahedral framework: Solid-phase synthesis, characterizations and catalytic ammoximation of cyclohexanone to cyclohexanone azine5Second-order nonlinear optical properties of bulk GeC polytypes, g-GeC and corresponding nanotubes: first-principles calculations23Synthesis, Crystal Structure, and Properties of Bi3TeBO9 or Bi3(TeO6)(BO3): A Non‐Centrosymmetric Borate–Tellurate(VI) of Bismuth20Na7[Ga2B13O24(OH)4]: A Luminescent Sodium Gallium Borate Containing Two Different Types of Oxoboron Framework Building Blocks4A new method for the preparation of a [Sn 2 (H 2 PO 2 ) 3 ]Br SHG-active polar crystal via surfactant-induced strategy12A promising lead-free fluoride carbonate SHG material designed from a theoretical perspective16Collaborative enhancement from Pb 2+ and F − in Pb 2 (NO 3 ) 2 (H 2 O)F 2 generates the largest second harmonic generation effect among nitrates91

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  2. ChemInform Abstract: Pb2B5O9I: An Iodide Borate with Strong Second Harmonic Generation.

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  5. Synthesis, crystal structure and optical properties of a new lead fluoride borate with isolated [B9O21]15− unit

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