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RESEARCH PAPER · Coordination Chemistry Reviews · 2020

A review on phase transition and structure-performance relationship of second-order nonlinear optical polymorphs

Kui Wu, Ya Feng Yang, Lihua Gao

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A review on phase transition and structure-performance relationship of second-order nonlinear optical polymorphsOriginalA review of the AI2B II C IV DVI4 family as infrared nonlinear optical materials: the effect of each site on the structure and optical properties59Experimental and theoretical studies of the ternary thiophosphate PbPS 3 featuring ethane-like [P 2 S 6 ] 4− units15Second-order nonlinear optical materials with a benzene-like conjugated π system49Inherent laws between tetrahedral arrangement pattern and optical performance in tetrahedron-based mid-infrared nonlinear optical materials130Chalcophosphates: A Treasure House of Infrared Nonlinear Optical Materials75Temperature-dependent behaviours of electro-elastic constants for the Bi 2 ZnB 2 O 7 piezoelectric crystal5A New Nonlinear Optical Selenide Crystal AgLiGa 2 Se 4 with Good Comprehensive Performance in Mid‐Infrared Region44A 3 Mn 2 Sb 3 S 8 (A = K and Rb): a new type of multifunctional infrared nonlinear optical material based on unique three-dimensional open frameworks53A series of M 3 PS 4 (M = Ag, Cu and Ag/Cu) thiophosphates with diamond-like structures exhibiting large second harmonic generation responses and moderate ion conductivities28Aliovalent-cation-substitution-induced structure transformation: a new path toward high-performance IR nonlinear optical materials47Recent advances of oxyfluorides for nonlinear optical applications69Recent progress in oxychalcogenides as IR nonlinear optical materials79Structural Variation and Switchable Nonlinear Optical Behavior of Metal–Organic Frameworks50New Polymorphism for Ba3Zn2(BO3)3F with Two Polymorphs Exhibiting Anomalous Phase Transition2A Series of Pentanary Salt-Inclusion Chalcogenoborates Containing a B12Q12 (Q = S, Se) Cluster Exhibiting a Kleinman-Forbidden Frequency-Doubling Effect25α-Ca2CdP2 and β-Ca2CdP2: Two Polymorphic Phosphide-Based Infrared Nonlinear Crystals with Distorted NLO-Active Tetrahedral Motifs Realizing Large Second Harmonic Generation Effects and Suitable Band Gaps30ASb5S8 (A = K, Rb, and Cs): Thermal Switching of Infrared Nonlinear Optical Properties across the Crystal/Glass Transformation39Structure-performance relationship in tri-coordinated nonlinear optical materials toward optimal second harmonic generation and phase matching31Cs2ZnSn3S8: A Sulfide Compound Realizes a Large Birefringence by Modulating the Dimensional Structure24AZn4Ga5Se12 (A = K, Rb, or Cs): Infrared Nonlinear Optical Materials with Simultaneous Large Second Harmonic Generation Responses and High Laser-Induced Damage Thresholds34Recent advances in nonlinear optical rare earth structures63Investigation of the Anisotropic Thermal Expansion Mechanism of Ag x Ga x Ge 1– x Se 2 Crystals9Deuteration triggered downward shift of dielectric phase transition temperature in a hydrogen-bonded molecular crystal16Transition-metal-based chalcogenides: A rich source of infrared nonlinear optical materials184The Rise of Infrared Nonlinear Optical Pnictides: Advances and Outlooks36Synthesis, structure, and nonlinear optical property of Bi0.33Sb0.67SI1Designing A New Infrared Nonlinear Optical Material, β‐BaGa 2 Se 4 Inspired by the Phase Transition of the BaB 2 O 4 (BBO) Crystal75Designing A New Infrared Nonlinear Optical Material, β‐BaGa2Se4 Inspired by the Phase Transition of the BaB2O4 (BBO) Crystal13Halogen-Ion-Induced Structural Phase Transition Giving a Polymorph of HgBr2 with Balanced Nonlinear Optical Properties8Structural Chemistry and Excellent Nonlinear Optical Properties of a Series of Ternary Selenides GaxIn2–xSe322Phase Matchability Transformation in the Infrared Nonlinear Optical Materials with Diamond‐Like Frameworks63A DFT study of the second-order nonlinear optical properties of Ru( ii ) polypyridine complexes9Aligned chromophores in a host–guest MOF crystal for switchable polarized nonlinear optical response24KAg3Ga8S14: An Mid- and Far-infrared Nonlinear Optical Material Exhibiting High Laser-induced Damage Threshold※3The exploration of new infrared nonlinear optical crystals based on the polymorphism of BaGa 4 S 731Two host–guest grown ether supramolecules show switchable phase transition, dielectric and second-harmonic generation effect11Two porous-layered borates built by B 7 O 13 (OH) clusters and AlO 4 /GaO 4 tetrahedra7Lead Tellurite Crystals BaPbTe2O6 and PbVTeO5F with Large Nonlinear-/Linear-Optical Responses due to Active Lone Pairs and Distorted Octahedra20Ba2B10O16(OH)2·(H3BO3)(H2O): A Possible Deep-Ultraviolet Nonlinear-Optical Barium Borate36Ti0.85Eu3SiS7: The rare-earth/Ti based quaternary sulfide containing two variable valence elements4NaGa3Se5: An Infrared Nonlinear Optical Material with Balanced Performance Contributed by Complex {[Ga3Se5]−}∞ Anionic Network14Ba2MAsQ5 (Q = S and Se) Family of Polar Structures with Large Second Harmonic Generation and Phase Matchability23RbBiP2S6: A Promising IR Nonlinear Optical Material with a Giant Second-Harmonic Generation Response Designed by Aliovalent Substitution80A comprehensive review on metal chalcogenides with three-dimensional frameworks for infrared nonlinear optical applications114Hybrid Germanium Bromide Perovskites with Tunable Second Harmonic Generation122Hybrid Germanium Bromide Perovskites with Tunable Second Harmonic Generation8Chiral 2D Cu(I) Halide Frameworks52Li x Ag 1– x GaSe 2 : Interplay Between Lithium and Silver in Mid‐Infrared Nonlinear Optical Chalcogenides33LiAlS2: A promising infrared frequency-conversion material with ultrawide band gap and high laser-induced damage threshold19AeMg6Ga6S16 (Ae = Ca, Sr, Ba): The First Double Alkaline‐Earth Metal Chalcogenides with Excellent Performances29Rb 2 CdSi 4 S 10 : novel [Si 4 S 10 ] T2-supertetrahedra-contained infrared nonlinear optical material with large band gap79Stabilization of the Polar Structure and Giant Second‐Order Nonlinear Response of Single Crystal γ‐NaAs0.95Sb0.05Se219A new stable polymorph of Li 2 TeMo 3 O 12 with wide mid-infrared transparency and a large Raman response17Recent progress on sulfide infrared nonlinear optical materials with large SHG response and wide band gap26Two pairs of chiral Yb III enantiomers presenting distinct NIR luminescence and circularly polarized luminescence performances with giant differences in second-harmonic generation responses20Two temperature-induced 1D Cu II chain enantiomeric pairs showing different magnetic properties and nonlinear optical responses14Recent progress in the design of IR nonlinear optical materials by partial chemical substitution: Structural evolution and performance optimization133Alignment of Λ-Shaped Basic Building Units to Construct One New KMoO3(IO3) Polar Polymorph11[K2PbX][Ga7S12] (X = Cl, Br, I): The First Lead‐Containing Cationic Moieties with Ultrahigh Second‐Harmonic Generation and Band Gaps Exceeding the Criterion of 2.33 eV46Optimal Design of Mid-Infrared Nonlinear-Optical Crystals: From SrZnSnSe 4 to SrZnSiSe 422Recent advances in IR nonlinear optical chalcogenides with well-balanced comprehensive performance56From Centrosymmetry to Noncentrosymmetry: Precise Structural Regulation and Characterization on ZnHPO3·2H2O Polymorphs13Multinuclear Pd(II) oligomeric nanohoop complexes with 2,2′‐bipyridyl‐embedded cycloparaphenylenes ligands exhibiting ultrahigh third‐order nonlinear optical performance2A ll HgM IV S 4 (A ll = Sr, Ba, M IV = Si, Ge): A Series of Materials with Large Second Harmonic Generation Response and Wide Band Gaps27Ga-based IR nonlinear optical materials: Synthesis, structures, and properties65Greatly enhanced optical anisotropy in thiophosphates inspired by rational coupling of tetrahedra and ethane-like [P 2 S 6 ] 4− groups7Rare-earth-based chalcogenides and their derivatives: an encouraging IR nonlinear optical material candidate70Two chiral Co III and Ni II complexes with identical ligands presenting different nonlinear optical responses4Superfast Phase Transformation Driven by Dual Chemical Equilibrium Enabling Enhanced Electrochemical Energy Storage13Novel polymorph of 2-amino-6-methyl pyridinium-4-methyl benzoate (2A6MP4MB) single crystals: Synthesis, crystal structure, optical, spectroscopic and self-defocusing capabilities for nonlinear optical applications2Sr2[B5O8(OH)]2 ⋅ [B(OH)3] ⋅ H2O: A Strontium Borate That Shows Deep‐Ultraviolet‐Transparent Nonlinear Optical Properties17Mixed Anionic M(S/X)6 Polyhedra as Symmetry-Breaking Motifs to Enhance the Infrared Nonlinear Optical Response in Y–M–S–X (M = Ga, Ge; X = Cl, Br)5Room-Temperature Phase Transition Material with Switchable Second-Order Nonlinear Optical Properties9Recent advances and future perspectives on rare-earth-based nonlinear optical materials with π-conjugated [XO3] (X = B, C, N) units66Chiral mono- and dinuclear CoII and CuII enantiomeric pairs with distinct enantiopure N-donor ligands: Presenting highly enhanced third-harmonic generation responses6Breaking Symmetry for SHG Response: Lanthanide Acetate Crystals via Water Molecule Regulation Strategy5Elevating Nonlinear Optical Response Through D‐Electron Modulation in Metal–Organic Frameworks3SbO(OH)2(IO3): The First Polar Sb5+‐Iodate with a Strong Second‐Harmonic Generation Response and a Wide Bandgap8Alkynyl bipyridine Pt(II) metallacycles with various combinations of dehydrobenzo[12]annulenes unit ligands showing high third-order nonlinear optical responses0Balanced IR Nonlinear Optical Performance Achieved by Cation–Anion Module Cosubstitution in V-Based Salt-Inclusion Oxychalcogenides22Aliovalent Al 3+ substituted ultra-wide bandgap CuAlX 4 (X = Cl, Br) for infrared nonlinear optics6Designing infrared nonlinear optical crystals, Sr 2 MgSn 2 OS 6 and Sr 2 SnGa 2 OS 6 , with hybrid anionic frameworks via a double substitution strategy4Enhanced second harmonic generation in a Fdd 2 polymorph of C 12 H 8 N 2 O 4 Zn for UV nonlinear optical applications1Exploring new horizons in mid-to-far infrared nonlinear optical crystals: the significant potential of trigonal pyramidal [TeS 3 ] 2− functional units18Impact of Microstructural Units Configuration and Arrangement on Phase-Matching in Nonlinear Optical KGa5Se8 Crystals9Crystal Structures, Phase Transition, and Optical Properties of Two Rare Earth Borate Fluorides: α- and β-BaGdBO3F26pH‐Dependent Switching Between Nonlinear‐Optical‐Active Nitrate‐Based Supramolecular Polymorphs27pH‐Dependent Switching Between Nonlinear‐Optical‐Active Nitrate‐Based Supramolecular Polymorphs2Machine Learning Prediction on Birefringence of Nonlinear Optical Crystals and Polymorphs with Different Birefringence Activities2Hydrogen‐Bond‐Directed Modular Assembly of Polar Chains for Rational Construction of UV Nonlinear Optical Crystals14Hydrogen‐Bond‐Directed Modular Assembly of Polar Chains for Rational Construction of UV Nonlinear Optical Crystals3Structure-property relationships in IR nonlinear optical chalcogenides with stereochemically active lone pairs29Modulating Nonlinear Optical Performances in α/β-SnGa2GeS6 Polymorphs via Atomic Coordination Engineering1Structural Evolution and Optical Tunability of Diamond-Like Semiconductors Li 2 Zn 1– x Cd x SnS 4 , Li 2 CdSn(S 1– y Se y ) 4 , and Li 2 ZnSn(S 1– y Se y ) 44Pressure-induced phase transitions and structural stability in K2SiF6 and Na2SiF60Nd-doped LYSB: A new multifunctional crystal for efficient multi-wavelength laser emission and frequency conversion0Halogen-ion-driven polymorphs for high-performance nonlinear optical crystalline materials3To dissipate is to stabilize: Mechanical loss in methane hydrates4C 6 H 7 NCl·X (X = Cl, Br): Outstanding Multifunctional Nonlinear Optical and Birefringent Crystals Enabled by Incorporation of π‐Conjugated Moieties2The Achievement of a Strong Second Harmonic Generation Response and a Large Birefringence in Sulfates4Hydrogen-Bond-Directed Assembly of an Intramolecular Charge-Transfer Compound for Second-Order Nonlinear Optics1CdY 2 Si 2 S 8 : A Wide Bandgap IR NLO Material with d 10 Metal-Induced Structure Transformation from CS to NCS1Electronic Structure and Elastic Properties of Polymorphic Phases of Lithium Oxothallate (LiTlO2)0Structure–property correlation in brucinium bromide hydrate crystal for NLO applications: insights from Hirshfeld surface, DFT, and dielectric studies0Solution-Grown Cs2HgI4 Bulk Crystals: Achieving Strong SHG and High Damage Threshold Synergistically for IR Nonlinear Optics1Entropy‐Driven Precursor Symmetry Breaking for Phase‐Selective Synthesis of Noncentrosymmetric Rb 2 CdCl 2 I 20NaGa2PS6: A Noncentrosymmetric Thiophosphate with Wide Band Gap and High Laser-Induced Damage Threshold0

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  2. Experimental and theoretical studies of the ternary thiophosphate PbPS 3 featuring ethane-like [P 2 S 6 ] 4− units

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  3. Second-order nonlinear optical materials with a benzene-like conjugated π system

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  4. Inherent laws between tetrahedral arrangement pattern and optical performance in tetrahedron-based mid-infrared nonlinear optical materials

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  5. Chalcophosphates: A Treasure House of Infrared Nonlinear Optical Materials

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  6. Temperature-dependent behaviours of electro-elastic constants for the Bi 2 ZnB 2 O 7 piezoelectric crystal

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  7. A New Nonlinear Optical Selenide Crystal AgLiGa 2 Se 4 with Good Comprehensive Performance in Mid‐Infrared Region

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  8. A 3 Mn 2 Sb 3 S 8 (A = K and Rb): a new type of multifunctional infrared nonlinear optical material based on unique three-dimensional open frameworks

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  9. A series of M 3 PS 4 (M = Ag, Cu and Ag/Cu) thiophosphates with diamond-like structures exhibiting large second harmonic generation responses and moderate ion conductivities

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  10. Aliovalent-cation-substitution-induced structure transformation: a new path toward high-performance IR nonlinear optical materials

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  11. Recent advances of oxyfluorides for nonlinear optical applications

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  12. Recent progress in oxychalcogenides as IR nonlinear optical materials

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  13. Structural Variation and Switchable Nonlinear Optical Behavior of Metal–Organic Frameworks

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  15. A Series of Pentanary Salt-Inclusion Chalcogenoborates Containing a B12Q12 (Q = S, Se) Cluster Exhibiting a Kleinman-Forbidden Frequency-Doubling Effect

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  16. α-Ca2CdP2 and β-Ca2CdP2: Two Polymorphic Phosphide-Based Infrared Nonlinear Crystals with Distorted NLO-Active Tetrahedral Motifs Realizing Large Second Harmonic Generation Effects and Suitable Band Gaps

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  34. KAg3Ga8S14: An Mid- and Far-infrared Nonlinear Optical Material Exhibiting High Laser-induced Damage Threshold※

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  36. Two host–guest grown ether supramolecules show switchable phase transition, dielectric and second-harmonic generation effect

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  37. Two porous-layered borates built by B 7 O 13 (OH) clusters and AlO 4 /GaO 4 tetrahedra

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  38. Lead Tellurite Crystals BaPbTe2O6 and PbVTeO5F with Large Nonlinear-/Linear-Optical Responses due to Active Lone Pairs and Distorted Octahedra

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  39. Ba2B10O16(OH)2·(H3BO3)(H2O): A Possible Deep-Ultraviolet Nonlinear-Optical Barium Borate

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  41. NaGa3Se5: An Infrared Nonlinear Optical Material with Balanced Performance Contributed by Complex {[Ga3Se5]−}∞ Anionic Network

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  42. Ba2MAsQ5 (Q = S and Se) Family of Polar Structures with Large Second Harmonic Generation and Phase Matchability

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  43. RbBiP2S6: A Promising IR Nonlinear Optical Material with a Giant Second-Harmonic Generation Response Designed by Aliovalent Substitution

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  44. A comprehensive review on metal chalcogenides with three-dimensional frameworks for infrared nonlinear optical applications

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  45. Hybrid Germanium Bromide Perovskites with Tunable Second Harmonic Generation

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  46. Hybrid Germanium Bromide Perovskites with Tunable Second Harmonic Generation

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  47. Chiral 2D Cu(I) Halide Frameworks

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  48. Li x Ag 1– x GaSe 2 : Interplay Between Lithium and Silver in Mid‐Infrared Nonlinear Optical Chalcogenides

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  49. LiAlS2: A promising infrared frequency-conversion material with ultrawide band gap and high laser-induced damage threshold

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  50. AeMg6Ga6S16 (Ae = Ca, Sr, Ba): The First Double Alkaline‐Earth Metal Chalcogenides with Excellent Performances

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