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RESEARCH PAPER · Dalton Transactions · 2021

A review on the recently developed promising infrared nonlinear optical materials

Ailijiang Abudurusuli, Junjie Li, Shilie Pan

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A review on the recently developed promising infrared nonlinear optical materialsOriginalBa 2 BS 3 Cl and Ba 5 B 2 S 8 Cl 2 : first alkaline-earth metal thioborate halides with [BS 3 ] units21M 6 PS 5 X (M = Ag, Cu; X = Cl, Br) chalcohalides exhibiting strong nonlinear optical responses and high laser damage resistances9Barium nonlinear optical crystals for the mid-IR: characterization and some applications75Centrosymmetric or Noncentrosymmetric? Transition Metals Talking in K 2 TGe 3 S 8 (T = Co, Fe)25The Role of Acidity in the Synthesis of Novel Uranyl Selenate and Selenite Compounds and Their Structures2Transition-metal-based chalcogenides: A rich source of infrared nonlinear optical materials184Synthesis, structure, and magnetic properties of the quaternary oxysulfides Ln 5V3O7S6 (Ln = La, Ce)1La 3 Ga 3 Ge 2 S 3 O 10 : An Ultraviolet Nonlinear Optical Oxysulfide Designed by Anion‐Directed Band Gap Engineering63La3Ga3Ge2S3O10: An Ultraviolet Nonlinear Optical Oxysulfide Designed by Anion‐Directed Band Gap Engineering18Detection of Sub‐Terahertz Raman Response and Nonlinear Optical Effects for Luminescent Yb(III) Complexes31Optically active selenium vacancies in BaGa4Se7 crystals4Giant Non‐Resonant Infrared Second Order Nonlinearity in γ ‐NaAsSe229A 2 P 2 S 6 (A = Ba and Pb): a good platform to study the polymorph effect and lone pair effect to form an acentric structure28AAg 3 Ga 8 Se 14 (A = Rb, Cs): second-harmonic generation responses realized through the parallel arrangement of AgSe 4 and GaSe 4 tetrahedrons5Ba 2 [WO 3 F(IO 3 )][WO 3 F 2 ]: the first polar fluorinated tungsten iodate featuring a direct W–O–I bond7Homovalent Cation Substitutions Leading to New Lithium-Containing La3cusis7 Family Members Having Chiral, Uniaxial Structures and Exhibiting Second- and Third-Harmonic Generation7Na 4 Ga 8 S 14 : a Ga-enriched wide band gap ternary alkali-metal sulfide with unique [Ga 12 S 42 ] 12-membered rings2Non-linear optical behaviour and antibacterial activity of semi-organic picolinic acid zinc sulphate single crystal1Structural and thermal properties of ultralow thermal conductivity Ba 3 Cu 2 Sn 3 Se 106Unprecedented mid-infrared nonlinear optical materials achieved by crystal structure engineering, a case study of (KX)P 2 S 6 (X = Sb, Bi, Ba)59Ba6(CuxZy)Sn4S16 (Z = Mg, Mn, Zn, Cd, In, Bi, Sn): High Chemical Flexibility Resulting in Good Nonlinear-Optical Properties12Effect of rare-earth doping on the structural and optical properties of the Ag3AsS3 crystals11Synthesis, Crystal and Electronic Structures, and Nonlinear Optical Properties of Y4Si3S1212SnP2S6: A Promising Infrared Nonlinear Optical Crystal with Strong Nonresonant Second Harmonic Generation and Phase-Matchability32Second-Harmonic Generation-Positive Na 2 Ga 2 SiS 6 with a Broad Band Gap and a High Laser Damage Threshold14The Kurtz-Perry powder technique revisited: A case study on the importance of reference quality and broadband nonlinear optical measurements using LiInSe232Li2Mg2Si2S6 and Li2Mg2Ge2S6: Two nonlinear optical sulfides featuring a unique, polar trigonal structure incorporating ethane‐like anions5Crystal Growth and Chirality - Technologies and Applications12New Frontiers in Novel Optical Materials and Devices7A comprehensive review on metal chalcogenides with three-dimensional frameworks for infrared nonlinear optical applications114Ag4SnGe2S7: A Noncentrosymmetric Chalcogenide in I4–II–IV2–VI7 System with Non-Diamond-Like Structure Featuring 1D ∞[SnGe2S8]6– Infinite Chain2Chalcohalides: A Rising Type of Second‐Order Nonlinear Optical Materials28Post-2000 nonlinear optical materials and measurements: data tables and best practices76In Situ Kinetic Observations on Crystal Nucleation and Growth385A DFT Study on New Photovoltaic Dyes to Investigate their NLO Tuning at Near Infrared Region (NIR) as Pull–push Effect by End Capped Acceptors44Recent Advances in Infrared Nonlinear Optical Crystal7d6versus d10, Which Is Better for Second Harmonic Generation Susceptibility? A Case Study of K2TGe3Ch8 (T = Fe, Cd; Ch = S, Se)18[Sr 4 Cl 2 ][Si 3 S 9 ]: Ultrawide-bandgap salt-inclusion thiosilicate nonlinear optical material with unprecedented tri-polymerized [Si 3 S 9 ] clusters21A new infrared nonlinear optical material BaZnGeS 4 with a wide band gap and large nonlinear optical response34Nonlinear properties of benzothiadiazole-based intramolecular charge-transfer compounds10Piperonal chalcone derivative incorporating the pyrazolo[3,4- b ]pyridine moiety; crystal structure, spectroscopic characterization and quantum chemical investigations13Revisiting two thiophosphate compounds constituting d 0 transition metal HfP 2 S 6 and d 10 transition metal α-Ag 4 P 2 S 6 as multifunctional materials for combining second harmonic generation response and photocurrent response12Recent progress in the design of IR nonlinear optical materials by partial chemical substitution: Structural evolution and performance optimization133Floquet formulation of the dynamical Berry-phase approach to nonlinear optics in extended systems2Band Structure Calculation and Optical Properties of Ag3AsS3 Crystals2The induced polarization enhanced birefringence in AlPS4 family: A first-principles investigation6The second-order nonlinear optical properties of novel triazolo[3,4-b] [1, 3, 4] thiadiazole derivative chromophores using DFT calculations13Na3SiS3F: A Wide Bandgap Fluorothiosilicate with Unique [SiS3F] Unit and High Laser‐Induced Damage Threshold39Recent Advances in 2D Material Theory, Synthesis, Properties, and Applications341Third-order nonlinear optical properties of choline chloride based deep eutectic solvents: Theoretical and experimental studies6Investigation on the Thermophysical Properties and Dielectric Analysis of Benzil Single Crystal for Optical and Photonic Applications3Using femtosecond laser pulses to explore the nonlinear optical properties of a CR-39 polymer after being exposed to alpha particles0Rb2Sn4Q9 (Q = S and Se): Low-Dimensional Noncentrosymmetric Chalcogenides with High Laser-Induced Damage Threshold10Convenient and facile theoretical design strategy to amplify NLO response of N‐doped‐indolo [3,2,1‐jk]carbazole push–pull A‐π‐D‐π‐A switches19ZnGa 2 S 4 : an infrared nonlinear optical material with large second‐harmonic generation response and wide band gap28Synthesis, crystal and electronic structures, linear and nonlinear optical properties, and photocurrent response of oxyhalides CeHaVIO 4 (Ha = Cl, Br; VI = Mo, W)10Ga-based IR nonlinear optical materials: Synthesis, structures, and properties65Delving into the bandgap tuning and nonlinear optical properties of hydrothermally synthesized pristine and boron doped molybdenum trioxide nanorods7Exploration of antimony( iii ) oxyhalides via single-site substitution in quest of large birefringence10Hg 3 AsS 4 X (X = Cl and Br): two Hg-based chalcogenides as long-wave infrared nonlinear optical crystals with superior comprehensive performances33Pb 6 Ba 3 Si 2 S 8 I 10 : a new thiohalide with a quasi-two-dimensional structure and wide band gap2Rare-earth oxychalcogenide Eu 2 ZnGe 2 OS 6 : a phase-matching infrared nonlinear optical material with [GeOS 3 ] units7Structurally influenced optical nonlinearities and ultrafast dynamics in β-acroleyl- and β-dicyanobutadienyl-appended cobalt corroles6Structure-based screening of sp2 hybridized small donor bridges as donor: acceptor switches for optical and photovoltaic applications: DFT way31Stereochemically Active Lone Pairs: Unraveling the Electronic Origin of Dielectric Response in Nonlinear Optical TeO211How much length of boron-nitride incorporated benzene like structures can produce efficient harmonic generation at their low-lying excited states?2Realizing the effect of s-block metals on a charge transfer crystal of indol-2-one for enhanced NLO responses with efficient energetic offsets5Optical Phenomena in Molecule-Based Magnetic Materials154Sr2HgGe2OS6: A Hg-Based Oxychalcogenide Infrared Nonlinear Optical Material Exhibiting Favorable Balance between a Large Band Gap and Strong Second Harmonic Generation Response10Enhanced nonlinear optical responses of doped superalkali metal salts with fluorinated/non-fluorinated planar boron sheets: A theoretical study3Optical materials discovery and design with federated databases and machine learning9Advancements in Nonlinear Optical Materials: Paving the Way for Future Photonic Devices4Bridgman growth and characterizations of nonlinear optical crystal La3Ga5.5Nb0.5O140K2HgGe3Se8: A Quaternary Hg-Based Selenide with Nonlinear Optical Properties6Synthesis, crystal structure, spectral analysis and NLO studies of five-coordinate Zn(II) complexes of hydrazochromandione1Exploring the electronic and NLO properties of hydrazinylthiazoles based carboxylates: Synthesis, spectroscopic and DFT studies43Pb 8 O 7 I 2 ·2CsI: the salt-inclusion strategy enriches the structural chemistry in lead oxyhalides1BaAs 2 : an arsenide with giant second harmonic generation enabled by interesting As–As bonds1Cd 5 Te 4 O 12 X 2 (X = Cl, Br, I): a new oxyhalide family with [CdO 4 X] mixed anionic units and adjustable optical properties4Exploring the role of H-migration in the aromaticity, spectroscopic, photovoltaic and optical properties of planar heterocyclic compounds: a DFT study26Optoelectronic and NLO potential of styryl-functionalized nitroisoxazoles for OLED technologies6Cd5As2Br4: A Ternary Arsenide with Nonlinear Optical Property3Rate-Dependent Mechanoluminescence in SrZn2S2O:Mn2+ for Time-Characterized Optoelectronic Devices8AI4NLO: An Integrated Data Platform for Machine Learning-Driven Exploration of Inorganic Nonlinear Optical Materials8Probing azobenzene-like boron nitride triazoles for their photoswitching attributes through long range push–pull effects: a DFT study0A Machine Learning Study to Explore the Structural Basis of Non‐Conjugated Compounds for Their Optical Activity Features8Predicting the Experimental Emission Spectra of Fluorescent Organic Semiconductors by Ensemble Machine Learning Analysis0Theoretical research of electronic, optical, and vibrational properties of nonlinear Li 2 K 4 TiOGe 4 O12 crystal0Structural, spectral, dielectric, and nonlinear optical properties of 2,4,6-Trinitrophenol with optical limiting behavior3Bridging meta-optics to quantum-optics: manipulating nonclassical light with structured materials [Invited]4ABCQ4型硫属化物红外非线性光学材料的构效关系（特邀）0Ba 4 Al 4 SnS 12 : balancing bandgap and nonlinear optical performance in thioaluminate via multifunctional group engineering0Synthesis, photophysical, and electrochemical properties of β-substituted imidazole-appended metalloporphyrins and their NLO application2Synthesis, Structural Characterization, and Nonlinear Optical Properties of a Zwitterionic Glycine-Coordinated Copper(II) Complex for Efficient Optical Limiting1Exploring the effect of La3+ and K+ Co-doping on optical and nonlinear optical properties of Zinc tris-thiourea sulphate crystals1Evaluation of Electronic, Optoelectronic, and Nonlinear Optical Responses in Functionalized Pyrazine Chromophores: A Density Functional Theory Study1{[Ge 2 S 7 ] 6– } ∞ Chains-Mediated Framework Reorganization Triggers Dimensional Upgrade and Infrared Nonlinear Optical Response3Crystal chemical aspects of solid solutions – natural resources, applications and basic research1Structural, Optical, and Electrical Studies of Maleic Acid Single Crystals for Nonlinear Optical Applications2Synthesis, structural characterization, and hyperpolarizability studies of novel barbituric acid and coumarin derivatives2Frontiers of Bright CEP‐Stable Broadband Infrared Sources0Spin-Resolved Second-Harmonic Generation from Europium 4f/5d States in a Weakly Stabilized Metastable Polymorph of Eu 2 P 2 S 60First‐Principles Investigation of the Structural, Electronic, Optical, Elastic, and Thermal Properties of Defect Diamond‐Like Hg 3 P 2 S 80

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  1. Ba 2 BS 3 Cl and Ba 5 B 2 S 8 Cl 2 : first alkaline-earth metal thioborate halides with [BS 3 ] units

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  2. M 6 PS 5 X (M = Ag, Cu; X = Cl, Br) chalcohalides exhibiting strong nonlinear optical responses and high laser damage resistances

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    Lihua Gao, Xiaowen Wu, Daqing Yang, Xinyu Tian, Jingjing Xu, Bingbing Zhang, Kui Wu

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  3. Barium nonlinear optical crystals for the mid-IR: characterization and some applications

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  4. Centrosymmetric or Noncentrosymmetric? Transition Metals Talking in K 2 TGe 3 S 8 (T = Co, Fe)

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  5. The Role of Acidity in the Synthesis of Novel Uranyl Selenate and Selenite Compounds and Their Structures

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  6. Transition-metal-based chalcogenides: A rich source of infrared nonlinear optical materials

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  7. Synthesis, structure, and magnetic properties of the quaternary oxysulfides Ln 5V3O7S6 (Ln = La, Ce)

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  8. La 3 Ga 3 Ge 2 S 3 O 10 : An Ultraviolet Nonlinear Optical Oxysulfide Designed by Anion‐Directed Band Gap Engineering

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  9. La3Ga3Ge2S3O10: An Ultraviolet Nonlinear Optical Oxysulfide Designed by Anion‐Directed Band Gap Engineering

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  10. Detection of Sub‐Terahertz Raman Response and Nonlinear Optical Effects for Luminescent Yb(III) Complexes

    Advanced Optical Materials · 2021-11-01

    Kunal Kumar, Olaf Stefańczyk, Koji Nakabayashi, Kenta Imoto, Yurie Oki, Shin‐ichi Ohkoshi

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  11. Optically active selenium vacancies in BaGa4Se7 crystals

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  12. Giant Non‐Resonant Infrared Second Order Nonlinearity in γ ‐NaAsSe2

    Advanced Optical Materials · 2021-11-09

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  13. A 2 P 2 S 6 (A = Ba and Pb): a good platform to study the polymorph effect and lone pair effect to form an acentric structure

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  14. AAg 3 Ga 8 Se 14 (A = Rb, Cs): second-harmonic generation responses realized through the parallel arrangement of AgSe 4 and GaSe 4 tetrahedrons

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  15. Ba 2 [WO 3 F(IO 3 )][WO 3 F 2 ]: the first polar fluorinated tungsten iodate featuring a direct W–O–I bond

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  16. Homovalent Cation Substitutions Leading to New Lithium-Containing La3cusis7 Family Members Having Chiral, Uniaxial Structures and Exhibiting Second- and Third-Harmonic Generation

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  17. Na 4 Ga 8 S 14 : a Ga-enriched wide band gap ternary alkali-metal sulfide with unique [Ga 12 S 42 ] 12-membered rings

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  18. Non-linear optical behaviour and antibacterial activity of semi-organic picolinic acid zinc sulphate single crystal

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  19. Structural and thermal properties of ultralow thermal conductivity Ba 3 Cu 2 Sn 3 Se 10

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  20. Unprecedented mid-infrared nonlinear optical materials achieved by crystal structure engineering, a case study of (KX)P 2 S 6 (X = Sb, Bi, Ba)

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  21. Ba6(CuxZy)Sn4S16 (Z = Mg, Mn, Zn, Cd, In, Bi, Sn): High Chemical Flexibility Resulting in Good Nonlinear-Optical Properties

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  31. Ag4SnGe2S7: A Noncentrosymmetric Chalcogenide in I4–II–IV2–VI7 System with Non-Diamond-Like Structure Featuring 1D ∞[SnGe2S8]6– Infinite Chain

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  32. Chalcohalides: A Rising Type of Second‐Order Nonlinear Optical Materials

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  33. Post-2000 nonlinear optical materials and measurements: data tables and best practices

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  34. In Situ Kinetic Observations on Crystal Nucleation and Growth

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  38. [Sr 4 Cl 2 ][Si 3 S 9 ]: Ultrawide-bandgap salt-inclusion thiosilicate nonlinear optical material with unprecedented tri-polymerized [Si 3 S 9 ] clusters

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  40. Nonlinear properties of benzothiadiazole-based intramolecular charge-transfer compounds

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  42. Revisiting two thiophosphate compounds constituting d 0 transition metal HfP 2 S 6 and d 10 transition metal α-Ag 4 P 2 S 6 as multifunctional materials for combining second harmonic generation response and photocurrent response

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  45. Band Structure Calculation and Optical Properties of Ag3AsS3 Crystals

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  46. The induced polarization enhanced birefringence in AlPS4 family: A first-principles investigation

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  47. The second-order nonlinear optical properties of novel triazolo[3,4-b] [1, 3, 4] thiadiazole derivative chromophores using DFT calculations

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  48. Na3SiS3F: A Wide Bandgap Fluorothiosilicate with Unique [SiS3F] Unit and High Laser‐Induced Damage Threshold

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  49. Recent Advances in 2D Material Theory, Synthesis, Properties, and Applications

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