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RESEARCH PAPER · Applied Physics Letters · 2015

Simulated pressure-induced blue-shift of phase-matching region and nonlinear optical mechanism for K3B6O10X (X = Cl, Br)

Bingbing Zhang, Ming‐Hsien Lee, Zhihua Yang, Qun Jing, Shilie Pan, Min Zhang, Hongping Wu, Xin Su, Chengshun Li

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Simulated pressure-induced blue-shift of phase-matching region and nonlinear optical mechanism for K3B6O10X (X = Cl, Br)OriginalEffect 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 618Synthesis and optical properties of the first lead borate bromide with isolated BO 3 groups: Pb 2 Ba 3 (BO 3 ) 3 Br26Synthesis, characterization and theoretical studies of nonlinear optical crystal Sr 2 B 5 O 9 (OH)·H 2 O29The synergistic effect between effective mass and built-in electric field for the transfer of carriers in nonlinear optical materials17Theoretical perspective of the lone pair activity influence on band gap and SHG response of lead borates24Polar Polymorphism: α-, β-, and γ-Pb2Ba4Zn4B14O31–Synthesis, Characterization, and Nonlinear Optical Properties79Linear optical and thermo-physical properties of polar K3B6O10Cl crystal21Effect of the tetrahedral groups on the optical properties of LaBRO5 (R = Si and Ge): A first-principles study11Li 3 AlSiO 5 : the first aluminosilicate as a potential deep-ultraviolet nonlinear optical crystal with the quaternary diamond-like structure54Electronic structure and optical properties of Fe-doped SnS 2 from first-principle calculations35Recent development of metal borate halides: Crystal chemistry and application in second-order NLO materials340“XA 6 ” octahedra influencing the arrangement of anionic groups and optical properties in inverse-perovskite [B 6 O 10 ]XA 3 (X = Cl, Br; A = alkali metal)19Active performance of tetrahedral groups to SHG response: theoretical interpretations of Ge/Si-containing borate crystals3An effective strategy to achieve deeper coherent light for LiB 3 O 529Experimental and theoretical studies on the linear and nonlinear optical properties of lead phosphate crystals LiPbPO 474Hierarchized band gap and enhanced optical responses of trivalent rare-earth metal nitrates due to (d–p)π conjugation interactions22Influence of original and simulated microscopic units on SHG response in semiorganic NLO materials9KPb 2 (PO 3 ) 5 : a novel nonlinear optical lead polyphosphate with a short deep-UV cutoff edge109Nonlinear optical response mechanism of noncentrosymmetric lead borate Pb 6 [B 4 O 7 (OH) 2 ] 3 with three crystallographically independent [B 4 O 7 (OH) 2 ] 4− chains8Role of the metal cation types around VO 4 groups on the nonlinear optical behavior of materials: experimental and theoretical analysis19NaBa4(GaB4O9)2X3 (X = Cl, Br) with NLO-Active GaO4 Tetrahedral Unit: Experimental and ab Initio Studies25Hierarchical active factors to band gap and nonlinear optical response in Ag-containing quaternary-chalcogenide compounds9New understandings of third harmonic generation coefficient of bulk silicon: Implementation and application of the full ab initio band structure sum-over-states method14DFT Based Theoretical Study about the Contributions of Fluorine to Nonlinear Optical Properties in Borate Fluoride Crystals27K3B3O4(OH)4·2H2O: A UV Nonlinear Optical Crystal with Isolated [B3O4(OH)4]3– Anion Groups21Band structure and optical transitions in the Hg 3 Se 2 Cl 2 crystals6LiRb 2 PO 4 : a new deep-ultraviolet nonlinear optical phosphate with a large SHG response95BaCu 2 M IV Q 4 (M IV = Si, Ge, and Sn; Q = S, Se): synthesis, crystal structures, optical performances and theoretical calculations54Enhancing optical anisotropy of crystals by optimizing bonding electron distribution in anionic groups236Theoretical investigation on the balance between large band gap and strong SHG response in BMO 4 (M = P and As) crystals22Two haloid borate crystals with large nonlinear optical response32Fluorooxoborates: Beryllium‐Free Deep‐Ultraviolet Nonlinear Optical Materials without Layered Growth892Fluorooxoborates: Beryllium‐Free Deep‐Ultraviolet Nonlinear Optical Materials without Layered Growth99First-Principles Assisted Prediction of the Nonlinear Optical Behavior of Mg3B7O13Cl Crystal6DFT-Based Comparative Study about the Influence of Fluorine and Hydroxyl Anions on Opto-Electric Properties of Borate Crystals: Choice for Better Anion13First theoretical framework of di-substituted donor moieties of triphenylamine and carbazole for NLO properties: quantum paradigms of interactive molecular computation63Synthesis, Structure, and Properties of Nonlinear Optical Crystal Na2SiF622Ion-induced structural and optical performance evolution in LBO-like crystals: experimental and theoretical investigation13Oxygen adsorption on the Al 0.25 Ga 0.75 N (0001) surface: A first-principles study6A Joint Strategy To Evaluate the Microscopic Origin of the Second-Harmonic-Generation Response in Nonpolar ABCO3F Compounds32Effect of Element Substitution on Structural Transformation and Optical Performances in I2BaMIVQ4 (I = Li, Na, Cu, and Ag; MIV = Si, Ge, and Sn; Q = S and Se)63Deep-ultraviolet nonlinear optical materials: Development trend and innovative exploration16Crystal structures and theoretical studies of polyphosphate LiZnP3O9 for nonlinear optical applications18CaB5O7F3: A Beryllium-Free Alkaline-Earth Fluorooxoborate Exhibiting Excellent Nonlinear Optical Performances192Polar Fluorooxoborate, NaB4O6F: A Promising Material for Ionic Conduction and Nonlinear Optics494Polar Fluorooxoborate, NaB4O6F: A Promising Material for Ionic Conduction and Nonlinear Optics67LiGa 2 PS 6 and LiCd 3 PS 6 : Molecular Designs of Two New Mid-Infrared Nonlinear Optical Materials88Combination of d 10 -cations and fluorine anion as active participants to design novel borate/carbonate nonlinear optical materials24Non-centrosymmetric BaNaP3O9 with a short deep-ultraviolet cutoff edge14Prediction and Characterization of NaGaS2, A High Thermal Conductivity Mid-Infrared Nonlinear Optical Material for High-Power Laser Frequency Conversion38Expanding Frontiers of Ultraviolet Nonlinear Optical Materials with Fluorophosphates265Module-Guided Design Scheme for Deep-Ultraviolet Nonlinear Optical Materials195Cation substitution inducing gap changes and covalent interaction flexibility enhancing second harmonic generation responses in d10 metal chalcogenides11Tailoring nonlinear optical crystal borophosphate through the introduction of transition metal d orbitals for improving optical anisotropy and SHG response: a first-principles investigation1The First Examples of Lithium‐Containing Mixed‐Alkali Strontium Borates with Different Dimensional Anionic Architectures and Short Cutoff Edges16Second-order nonlinear optical properties of CuGa In1-Se2 (x = 0.54): Experimental and theoretical investigations4Excellent Infrared Nonlinear Optical Crystals BaMO(IO3)5 (M = V, Ta) Predicted by First Principle Calculations9The linear and nonlinear optical response of CsGeX3 (X=Cl, Br, and I): The finite field and first-principles investigation26Experimental characterization and first principles calculations of linear and nonlinear optical properties of two orthophosphates A 3 Al 2 (PO 4 ) 3 (A = Rb, K)36Adjustable optical nonlinearity in d 10 cations containing chalcogenides via dp hybridization interaction13Ba 3 Ca 4 (BO 3 ) 3 (SiO 4 )Cl: a new non-centrosymmetric complex alkaline-earth metal borosilicate chloride with a deep-ultraviolet cut-off edge19LiGeBO 4 : a nonlinear optical material with a balance between deep-ultraviolet cut-off edge and large SHG response induced by hand-in-hand tetrahedra21Theoretical investigation on the promotion of second harmonic generation from chalcopyrite family A I GaS 2 to A II Ga 2 S 47Hierarchy in nonlinear optical responses induced by metal cation tailoring effect in the In-containing chalcogenide compounds4Synthesis, characterization, and theoretical analysis of three new nonlinear optical materials K7MRE2B15O30 (M= Ca and Ba, RE= La and Bi)28K9[B4O5(OH)4]3(CO3)X·7H2O (X = Cl, Br): Syntheses, Characterizations, and Theoretical Studies of Noncentrosymmetric Halogen Borate–Carbonates with Short UV Cutoff Edges16Prediction of Fluorooxoborates with Colossal Second Harmonic Generation (SHG) Coefficients and Extremely Wide Band Gaps: Towards Modulating Properties by Tuning the BO 3 /BO 3 F Ratio in Layers99Prediction of Fluorooxoborates with Colossal Second Harmonic Generation (SHG) Coefficients and Extremely Wide Band Gaps: Towards Modulating Properties by Tuning the BO3/BO3F Ratio in Layers24Nontoxic KBBF Family Member Zn2BO3(OH): Balance between Beneficial Layered Structure and Layer Tendency81Designing excellent mid-infrared nonlinear optical materials with fluorooxo-functional group of d0 transition metal oxyfluorides63NaRb3B6O9(OH)3(HCO3): A Borate-Bicarbonate Nonlinear Optical Material18Coinage metalides: a new class of excess electron compounds with high stability and large nonlinear optical responses36Tellurium–oxygen group enhanced birefringence in tellurium phosphates: a first-principles investigation4Three non-centrosymmetric bismuth phosphates, Li 2 ABi(PO 4 ) 2 (A = K, Rb, and Cs): effects of cations on the crystal structure and SHG response23La3B6O13(OH): The First Acentric High‐Pressure Borate Displaying Edge‐Sharing BO4 Tetrahedra25A Promising Fluorooxoborate Framework with Flexibile Capability for Diverse Cations to Enhance the Second Harmonic Generation14PbB5O7F3: A High-Performing Short-Wavelength Nonlinear Optical Material120BaF 2 TeF 2 (OH) 2 : A UV Nonlinear Optical Fluorotellurite Material Designed by Band-Gap Engineering157Volume Modulation of Nonlinear Optical Properties by Cation Substitution8Two Pyrophosphates with Large Birefringences and Second‐Harmonic Responses as Ultraviolet Nonlinear Optical Materials137Two Pyrophosphates with Large Birefringences and Second‐Harmonic Responses as Ultraviolet Nonlinear Optical Materials29Structure-property survey and computer-assisted screening of mid-infrared nonlinear optical chalcohalides113First-Principles High-Throughput Screening Pipeline for Nonlinear Optical Materials: Application to Borates106CsZn2BO3X2 (X2=F2, Cl2, and FCl): A Series of Beryllium‐Free Deep‐Ultraviolet Nonlinear‐Optical Crystals with Excellent Properties142CsZn2BO3X2 (X2=F2, Cl2, and FCl): A Series of Beryllium‐Free Deep‐Ultraviolet Nonlinear‐Optical Crystals with Excellent Properties29Ba2[MoO3(OH)(IO3)2]IO3: A Promising SHG Material Featuring a Λ-Shaped Functional Motif Achieved by Universal Mono-Site Substitution50Finding Optimal Mid-Infrared Nonlinear Optical Materials in Germanates by First-Principles High-Throughput Screening and Experimental Verification79Hierarchical Contribution of Anions to Second Harmonic Generation in A2HgI4 (A = Na, Ag, Cu) Regulated Dramatically by Metal Cations4Different mechanism of response of asymmetric lone pair electrons around ns2 cations to birefringence and second harmonic generation7Intense d ‑ p Hybridization Induced a Vast SHG Response Disparity between Tetrahedral Vanadates and Arsenates13Role of Fluorooxo-Functional Units in Symmetry Breaking and Second Harmonic Generation Response Contribution in Fluorooxoborate Nonlinear Optical Crystals15Second Harmonic Generation Susceptibilities from Symmetry Adapted Wannier Functions178From silicates to oxonitridosilicates: improving optical anisotropy for phase-matching as ultraviolet nonlinear optical materials47Synergism of multiple functional chromophores significantly enhancing the birefringence in layered non-centrosymmetric chalcohalides20Computationally assisted multistage design and prediction driving the discovery of deep-ultraviolet nonlinear optical materials41Distinctive modulation of optical anisotropy by halogens in α/β-Cd–P–X (X = Cl, Br, and I)2Enhanced birefringence and suppressed second harmonic generation response mechanism in nonlinear optical materials via structural fine-tuning9Revisiting thiophosphate Pb 3 P 2 S 8 : a multifunctional material combining a nonlinear optical response and photocurrent response23Na 6 MQ 4 (M=Zn, Cd; Q=S, Se): Promising New Ternary Infrared Nonlinear Optical Materials24Molecular Engineering toward an Enlarged Optical Band Gap in a Bismuth Sulfate via Homovalent Cation Substitution26LiB2O3F: A Beryllium-Free Deep-Ultraviolet Nonlinear Optical Material Designed Based on a Boron-Rich Strategy61The application and development of the first principles calculation in nonlinear optical materials1Finding a Series of BaBOF3 Fluorooxoborate Polymorphs with Tunable Symmetries: A Simple but Flexible Case37Achieving Short‐Wavelength Phase‐Matching Second Harmonic Generation in Boron‐Rich Borosulfate with Planar [BO3] Units102Achieving Short‐Wavelength Phase‐Matching Second Harmonic Generation in Boron‐Rich Borosulfate with Planar [BO3] Units9A first-principle investigate about the different response of birefringence and SHG from AB3O6 (A = Bi, Sb) compounds5Na4B8O9F10: A Deep‐Ultraviolet Transparent Nonlinear Optical Fluorooxoborate with Unexpected Short Phase‐Matching Wavelength Induced by Optimized Chromatic Dispersion133Na4B8O9F10: A Deep‐Ultraviolet Transparent Nonlinear Optical Fluorooxoborate with Unexpected Short Phase‐Matching Wavelength Induced by Optimized Chromatic Dispersion13K 2 S 4 O 6 : improving birefringence and nonlinear optical properties with the [O 3 S–S–S–SO 3 ] 2− group5Linear unit BN 2 : a novel birefringence-enhanced fundamental module with sp orbital hybridization9Phosphogermanate Crystal: A New Ultraviolet–Infrared Nonlinear Optical Crystal with Excellent Optical Performances16Uncovering the Structural Diversity and Excellent Performance of a Deep Ultraviolet Nonlinear Optical System Li(B2O3)nF (n= 1, 1.5, 2, and 3) by Multicomponent Prediction26The Combination of Structure Prediction and Experiment for the Exploration of Alkali‐Earth Metal‐Contained Chalcopyrite‐Like IR Nonlinear Optical Material104A Theoretical Perspective to Study the Optical Properties of Tetrafluoroborates4Molecular Structure Design, Crystal Growth, and Characterization of New Types of Organic Nonlinear Optical Chalcone Crystals24Design of Infrared Nonlinear Optical Compounds with Diamond-like Structures and Balanced Optical Performance9From Phosphate Fluoride to Fluorophosphate: Design of Novel Ultraviolet/Deep-Ultraviolet Nonlinear Optical Materials for BePO3F with Optical Property Enhancement34Design of novel deep-UV nonlinear optical materials with one-dimensional functional module [BO2]∞ chain and fluorine-driven short phase-matching43Predicting Diamond-like Nitrides as Infrared Nonlinear Optical Materials with High Thermal Conductivity20CaBO2F: A novel deep-UV structural template with high nonlinear optical performance induced by electron delocalization25Modulating optical performance by phase transition in a nonlinear optical material β-Li 2 RbBi(PO 4 ) 28Li3B8O13X (X = Cl and Br): Two New Noncentrosymmetric Crystals with Large Birefringence Induced by BO3 Units18An interlinked prediction-experiment paradigm discovering deep-ultraviolet fluorooxoborates with desired optical nonlinearity and birefringence76Target‐Driven Design of Deep‐UV Nonlinear Optical Materials via Interpretable Machine Learning125CaB2O2F4: A Novel [BOF2]∞-Based Structural Template with a Strong Second Harmonic Generation Response and Large Band Gap2Ultraviolet Crystal with Strong Optical Nonlinearity by Creating Halogen-Centered Secondary Building Blocks15NaCl·CH4N2O·H2O: An Organic–Inorganic Hybrid Ultraviolet Nonlinear Optical Crystal with Optimized Comprehensive Properties8New Organic Nonlinear Optical Pyridinium-Based Hydrate Crystals: Trimethoxy-Induced Noncentrosymmetric Alignment6A Sharp Improvement of Sulfate's Birefringence Induced by the Synergistic Effect of Heteroleptic and Dimeric Strategies14Discovery of excellent ultraviolet nonlinear optical materials in chlorates and bromates with highly stereochemically active lone pairs12Exploration of antimony( iii ) oxyhalides via single-site substitution in quest of large birefringence10Recent advances in rational structure design for nonlinear optical crystals: leveraging advantageous templates153Shooting short-wavelength nonlinear optical materials with targeted balance performances in hydroxyborates through first-principles high-throughput screening4Screening Large Birefringent Materials via Halogen Regulation in Ternary d0-Transition Metal Oxyhalides8A Machine-Learning-Assisted Crystalline Structure Prediction Framework To Accelerate Materials Discovery19Structure and optical properties of alkali rare-earth double phosphates of M3RE(PO4)2 (M = K, Rb; RE = Y, La, and Lu)4First-principles study of three isomers of the large birefringent crystal Sb4O4F4: electronic structure and optical properties0SbO(OH)2(IO3): The First Polar Sb5+‐Iodate with a Strong Second‐Harmonic Generation Response and a Wide Bandgap8Computer‐Aided Development of New Nonlinear Optical Materials38Computer‐Aided Development of New Nonlinear Optical Materials14Anion ratio-directed design of CaB 4 O 5 F 4 and CaB 6 O 8 F 4 : [BO 3 ]/[BO 2 F 2 ] hybridization tailoring deep-ultraviolet nonlinear optical performance2新型非线性光学晶体和双折射晶体的研究进展（特邀）4First-Principles High-Throughput Screening and Experimental Verification of III-VIB Transition Metal Chalcogenides Nonlinear Optical Crystals15Prediction of New Functional Fluorooxoborates with Expected Anionic Framework: A Case of CaB3O5F4A Promising Short-Wave UV NLO Crystal with an Optimized KBBF-like Structure and Well-Balanced Properties Achieved via a Chemical Substitution Strategy6Origin of second harmonic generation in noncentrosymmetric crystal structures containing lone pair electrons5NaAg3Ga8S14: A new diamond-like framework infrared nonlinear optical material derived from AgGaS26High‐Throughput Discovery of Large Birefringence Materials in Mixed‐N Hf‐O Systems0Novel [BO 2 ] superhalogen module-enabled deep-ultraviolet nonlinear optical material: rational design for tailored birefringence and phase matching0Navigating the Landscape of Next-Generation Nonlinear Optical Materials Discovery: Opportunities and Challenges Driven by Artificial Intelligence4

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  1. Effect 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 6

    Physical Chemistry Chemical Physics · 2015-01-01

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  2. Synthesis and optical properties of the first lead borate bromide with isolated BO 3 groups: Pb 2 Ba 3 (BO 3 ) 3 Br

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  3. Synthesis, characterization and theoretical studies of nonlinear optical crystal Sr 2 B 5 O 9 (OH)·H 2 O

    Physical Chemistry Chemical Physics · 2015-01-01

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  4. The synergistic effect between effective mass and built-in electric field for the transfer of carriers in nonlinear optical materials

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  5. Theoretical perspective of the lone pair activity influence on band gap and SHG response of lead borates

    RSC Advances · 2015-01-01

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  6. Polar Polymorphism: α-, β-, and γ-Pb2Ba4Zn4B14O31–Synthesis, Characterization, and Nonlinear Optical Properties

    Chemistry of Materials · 2015-06-04

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  7. Linear optical and thermo-physical properties of polar K3B6O10Cl crystal

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  8. Effect of the tetrahedral groups on the optical properties of LaBRO5 (R = Si and Ge): A first-principles study

    Journal of Applied Physics · 2015-09-17

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  9. Li 3 AlSiO 5 : the first aluminosilicate as a potential deep-ultraviolet nonlinear optical crystal with the quaternary diamond-like structure

    Physical Chemistry Chemical Physics · 2015-12-12

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  10. Electronic structure and optical properties of Fe-doped SnS 2 from first-principle calculations

    RSC Advances · 2015-12-18

    Lili Sun, Wei Zhou, Yanyu Liu, Dandan Yu, Yinghua Liang, Ping Wu

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  11. Recent development of metal borate halides: Crystal chemistry and application in second-order NLO materials

    Coordination Chemistry Reviews · 2015-12-30

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  12. “XA 6 ” octahedra influencing the arrangement of anionic groups and optical properties in inverse-perovskite [B 6 O 10 ]XA 3 (X = Cl, Br; A = alkali metal)

    Physical Chemistry Chemical Physics · 2016-01-01

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  13. Active performance of tetrahedral groups to SHG response: theoretical interpretations of Ge/Si-containing borate crystals

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  14. An effective strategy to achieve deeper coherent light for LiB 3 O 5

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  15. Experimental and theoretical studies on the linear and nonlinear optical properties of lead phosphate crystals LiPbPO 4

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  16. Hierarchized band gap and enhanced optical responses of trivalent rare-earth metal nitrates due to (d–p)π conjugation interactions

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  17. Influence of original and simulated microscopic units on SHG response in semiorganic NLO materials

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  18. KPb 2 (PO 3 ) 5 : a novel nonlinear optical lead polyphosphate with a short deep-UV cutoff edge

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  19. Nonlinear optical response mechanism of noncentrosymmetric lead borate Pb 6 [B 4 O 7 (OH) 2 ] 3 with three crystallographically independent [B 4 O 7 (OH) 2 ] 4− chains

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  20. Role of the metal cation types around VO 4 groups on the nonlinear optical behavior of materials: experimental and theoretical analysis

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  21. NaBa4(GaB4O9)2X3 (X = Cl, Br) with NLO-Active GaO4 Tetrahedral Unit: Experimental and ab Initio Studies

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  22. Hierarchical active factors to band gap and nonlinear optical response in Ag-containing quaternary-chalcogenide compounds

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  23. New understandings of third harmonic generation coefficient of bulk silicon: Implementation and application of the full ab initio band structure sum-over-states method

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  24. DFT Based Theoretical Study about the Contributions of Fluorine to Nonlinear Optical Properties in Borate Fluoride Crystals

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  25. K3B3O4(OH)4·2H2O: A UV Nonlinear Optical Crystal with Isolated [B3O4(OH)4]3– Anion Groups

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  26. Band structure and optical transitions in the Hg 3 Se 2 Cl 2 crystals

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  27. LiRb 2 PO 4 : a new deep-ultraviolet nonlinear optical phosphate with a large SHG response

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  28. BaCu 2 M IV Q 4 (M IV = Si, Ge, and Sn; Q = S, Se): synthesis, crystal structures, optical performances and theoretical calculations

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  29. Enhancing optical anisotropy of crystals by optimizing bonding electron distribution in anionic groups

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  30. Theoretical investigation on the balance between large band gap and strong SHG response in BMO 4 (M = P and As) crystals

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  31. Two haloid borate crystals with large nonlinear optical response

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  32. Fluorooxoborates: Beryllium‐Free Deep‐Ultraviolet Nonlinear Optical Materials without Layered Growth

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  33. Fluorooxoborates: Beryllium‐Free Deep‐Ultraviolet Nonlinear Optical Materials without Layered Growth

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  34. First-Principles Assisted Prediction of the Nonlinear Optical Behavior of Mg3B7O13Cl Crystal

    Journal of the Physical Society of Japan · 2017-03-28

    Yanzhou Sun, Zhi Li, Ming‐Hsien Lee, Zhihua Yang, Shilie Pan, Sadeh Beysen

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  35. DFT-Based Comparative Study about the Influence of Fluorine and Hydroxyl Anions on Opto-Electric Properties of Borate Crystals: Choice for Better Anion

    Inorganic Chemistry · 2017-04-27

    Beenish Bashir, Bingbing Zhang, Ming‐Hsien Lee, Shilie Pan, Zhihua Yang

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  36. First theoretical framework of di-substituted donor moieties of triphenylamine and carbazole for NLO properties: quantum paradigms of interactive molecular computation

    Molecular Simulation · 2017-06-05

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

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

    Wenyao Zhang, Qun Jing, Yuan Fang, Zhaohui Chen

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  38. Ion-induced structural and optical performance evolution in LBO-like crystals: experimental and theoretical investigation

    Inorganic Chemistry Frontiers · 2018-01-01

    Yun Mo Yang, Shilie Pan

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  39. Oxygen adsorption on the Al 0.25 Ga 0.75 N (0001) surface: A first-principles study

    Solid State Communications · 2018-01-12

    Jiaqi Fu, Tielei Song, Xixia Liang, Guojun Zhao

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  40. A Joint Strategy To Evaluate the Microscopic Origin of the Second-Harmonic-Generation Response in Nonpolar ABCO3F Compounds

    Inorganic Chemistry · 2018-01-17

    Qun Jing, Guang Yang, Zhaohui Chen, Xiaoyu Dong, Yunjing Shi

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  41. Effect of Element Substitution on Structural Transformation and Optical Performances in I2BaMIVQ4 (I = Li, Na, Cu, and Ag; MIV = Si, Ge, and Sn; Q = S and Se)

    Inorganic Chemistry · 2018-03-06

    Leyan Nian, Kui Wu, Guijie He, Zhihua Yang, Shilie Pan

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  42. Deep-ultraviolet nonlinear optical materials: Development trend and innovative exploration

    Chinese Science Bulletin (Chinese Version) · 2018-03-22

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