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RESEARCH PAPER · Chemical Communications · 2020

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

Hongkun Liu, Bingbing Zhang, Ying Wang

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Second-order nonlinear optical materials with a benzene-like conjugated π systemOriginalFrom centrosymmetric to noncentrosymmetric: effect of the cation on the crystal structures and birefringence values of (NH 4 ) n−2 AE(PO 2 F 2 ) n (AE = Mg, Sr and Ba; n = 2, 3 and 4)9Prediction of unexpected B n P n structures: promising materials for non-linear optical devices and photocatalytic activities15Structural parameters versus third-order optical susceptibility of zinc porphyrin molecules18Cyanurates consisting of intrinsic planar π-conjugated 6-membered rings: An emerging source of optical functional materials111From Centrosymmetry to Noncentrosymmetry: Tailoring the Structural Arrangements of Carbonates with Strong Nonlinear Optical Response through Partial Anion Substitution33Centrosymmetric or Noncentrosymmetric? Transition Metals Talking in K 2 TGe 3 S 8 (T = Co, Fe)25Finding a Series of BaBOF3 Fluorooxoborate Polymorphs with Tunable Symmetries: A Simple but Flexible Case37Noncentrosymmetric Ba6In2Q10 (Q = S, Se): Structural Chemistry and Nonlinear-Optical Activity11Synergistic Effect of π-Conjugated [C(NH 2 ) 3 ] Cation and Sb(III) Lone Pair Stereoactivity on Structural Transformation and Second Harmonic Generation58Ba2B13O19(OH)5·5H2O: A promising nonlinear optical material with a unique 2[B13O19(OH)5]∞ two-dimensional layer9[C 3 N 6 H 7 ] 2 [B 3 O 3 F 4 (OH)]: a new hybrid birefringent crystal with strong optical anisotropy induced by mixed functional units85A 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 structure28PNO: a promising deep-UV nonlinear optical material with the largest second harmonic generation effect17Two layered galloborates from centric to acentric structures: syntheses and NLO properties27α-LiMB 9 O 15 (M = Sr, Pb): flexible [B 3 O 7 ] units leading to the low temperature phase of β-LiMB 9 O 15 (M = Sr, Pb)11Li2PbB2O5: A Pyroborate with Large Birefringence Induced by the Synergistic Effect of Stereochemical Active Lone Pair Cations and π-Conjugated [B2O5] Groups14Postsynthetic Modification of NU-1000 for Designing a Polyoxometalate-Containing Nanocomposite with Enhanced Third-Order Nonlinear Optical Performance86d6versus d10, Which Is Better for Second Harmonic Generation Susceptibility? A Case Study of K2TGe3Ch8 (T = Fe, Cd; Ch = S, Se)18Nonlinear properties of benzothiadiazole-based intramolecular charge-transfer compounds10Two UV optical crystals with strong optical anisotropy, large band gaps and an α-BBO type structure7Electronic Structures and NLO Properties of a Series of TMDs Lateral‐Core–Shell Heterostructures Quantum Dots3Fluorooxoborates: A precious treasure of deep-ultraviolet nonlinear optical materials24Structural design and characterization of a new chalcone molecular derivative crystal DMNC with high second-order nonlinear coefficient3External electric field driven conformation of the wing-shaped nanographene to close: enhancing and tuning nonlinear optical properties1Discovery of a new bimetallic borate with strong optical anisotropy activated by π-conjugated [B 2 O 5 ] units3External electric field driven electronic structures: tunable nonlinear optical properties of helical bilayer nanographenes2From BaAlBO 3 F 2 to BaAlB 3 O 6 F 2 and BaAl 2 (B 3 O 6 ) 2 F 2 : the enhancement of birefringence and band gap by extending the π-conjugated system combined with [Al–O/F] functional groups13New antimony fluorooxoborates with strong birefringence and unprecedented structural characterisation19Physical properties of nanosystems with π-conjugated intermolecular bonds01,3‐Diynes as Precursors for the Synthesis of Triazene‐ and Diethylaniline‐Bearing Push‐Pull NLOphores3Solvent effects and self-assembled aggregation modulate nonlinear optical effects in indocyanine green-like dyes5Theoretical investigation of the electronic and second-order non-linear optical properties of [n]helicene derivatives4Synthesis, crystal structure and nonlinear optical property of 1-((propan-2-ylideneamino)oxy)propan-2-yl-4-methylbenzenesulfonate, C13H19O4NS0[H2dab][GaB5O10]: an Acentric Galloborate with a 4-Connected Uninodal Framework6Smart design of highly luminescent octupolar mesogenic tetra styryl-alkynyl bipyrimidine-based chromophores presenting non-linear optical properties2Quantum Chemical Prediction of Nonlinear Optical and Photovoltaic Properties in Linear and Bent Configurations of Carbazole/Borole Derivatives6Impressive nonlinear optical response of π-conjugated, photoluminescent soft nanoparticles in polymer matrix6DFT Study on the Second-Order NLO Responses of 2-Phenyl Benzoquinoline Ir(III) Complexes by Substituents and Redox Effects1Nonlinear optical cyanurate crystals15Influence of monosaccharides and lipids on protein structure and solubility—Reaction simulation of sludge thermal hydrolysis system7Novel antimony-based mixed halides exhibiting an excellent SHG response and a broad transmission range20Two mixed P–O anionic phosphates with a distinctive structural transformation and deep ultraviolet cutoff edge0Design and Synthesis of Two Sn-Centered Mixed Halide Crystals with Enhanced Birefringence8Phase-Matching Second-Harmonic Generation in Zero-Dimensional Zinc Thiocyanates Ligated with Chiral Amino Acids6Quantum Chemical Insights into Metal-Ion Enhanced NLO Response of a Fluorescent Probe for Advanced Sensing Application8Modulation of Crystal Structure and Birefringence: Cation Size Effect in Alkali Metal Fluoroaluminoborates4A Cobalt Borate Built by {B 12 } and {Co 3 } Clusters for Photothermal Conversion1Zn(C 2 H 4 NO 2 ) 2 (SO 2 CH 3 NH 2 ) 2 and Zn(C 2 H 4 NO 2 ) 2 [SO 2 (NH 2 ) 2 ]: Regulation of Unique ZnO(C 2 H 4 NO 2 ) 2 Units by Polar Tetrahedrons for Balanced UV Nonlinear Optical Performance0MAlB3O6F2 (M = Ca and Pb): Two New Fluoroaluminoborates Featuring π-Conjugated [BO3] and [AlO4F2] Units with Large Birefringence0

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  1. From centrosymmetric to noncentrosymmetric: effect of the cation on the crystal structures and birefringence values of (NH 4 ) n−2 AE(PO 2 F 2 ) n (AE = Mg, Sr and Ba; n = 2, 3 and 4)

    Dalton Transactions · 2021-01-01

    Wenyao Zhang, Wenqi Jin, Meng Cheng, Ruonan Zhang, Zhihua Yang, Shilie Pan

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  2. Prediction of unexpected B n P n structures: promising materials for non-linear optical devices and photocatalytic activities

    Nanoscale Advances · 2021-01-01

    Zabiollah Mahdavifar

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  3. Structural parameters versus third-order optical susceptibility of zinc porphyrin molecules

    Journal of Materials Chemistry C · 2021-01-01

    Amina Yasin, Vijayakumar Sadasivan Nair, Mohd Hasbi Ab. Rahim, Yoshihisa Yamaoka, Chandra S. Yelleswarapu, Rajan Jose

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  4. Cyanurates consisting of intrinsic planar π-conjugated 6-membered rings: An emerging source of optical functional materials

    Coordination Chemistry Reviews · 2021-04-14

    Xianghe Meng, Wenlong Yin, Mingjun Xia

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  5. From Centrosymmetry to Noncentrosymmetry: Tailoring the Structural Arrangements of Carbonates with Strong Nonlinear Optical Response through Partial Anion Substitution

    Advanced Optical Materials · 2021-05-22

    Xianghe Meng, Pifu Gong, Chunlan Tang, Wenlong Yin, Zheshuai Lin, Mingjun Xia

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

    Inorganic Chemistry · 2021-06-29

    Bingheng Ji, K. C. Pandey, Colin P. Harmer, Fei Wang, Kui Wu, Jin Hu, Jian Wang

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  7. Finding a Series of BaBOF3 Fluorooxoborate Polymorphs with Tunable Symmetries: A Simple but Flexible Case

    Chemistry of Materials · 2021-09-30

    Kaitong Liu, Jian Wei Han, Tuohetijiang Baiheti, Fuming Li, Zhonglei Wei, Zhihua Yang, Miriding Mutailipu, Shilie Pan

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  8. Noncentrosymmetric Ba6In2Q10 (Q = S, Se): Structural Chemistry and Nonlinear-Optical Activity

    Inorganic Chemistry · 2021-11-05

    Xiao Fen Huang, Sihan Yang, Wenlong Liu, Sheng‐Ping Guo

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  9. Synergistic Effect of π-Conjugated [C(NH 2 ) 3 ] Cation and Sb(III) Lone Pair Stereoactivity on Structural Transformation and Second Harmonic Generation

    Inorganic Chemistry · 2021-11-19

    Man Zhang, Bingbing Zhang, Daqing Yang, Ying Wang

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  10. Ba2B13O19(OH)5·5H2O: A promising nonlinear optical material with a unique 2[B13O19(OH)5]∞ two-dimensional layer

    Journal of Alloys and Compounds · 2021-12-09

    Kaitong Liu, Jian Wei Han, Fuming Li, Congcong Jin, Zhihua Yang, Miriding Mutailipu, Shilie Pan

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  11. [C 3 N 6 H 7 ] 2 [B 3 O 3 F 4 (OH)]: a new hybrid birefringent crystal with strong optical anisotropy induced by mixed functional units

    Journal of Materials Chemistry C · 2022-01-01

    Congcong Jin, Fuming Li, Zhihua Yang, Shilie Pan, Miriding Mutailipu

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  12. 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

    Dalton Transactions · 2022-01-01

    Bingheng Ji, Arka Sarkar, Kui Wu, Andrew Swindle, Jian Wang

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  13. PNO: a promising deep-UV nonlinear optical material with the largest second harmonic generation effect

    Chemical Communications · 2022-01-01

    Congwei Xie, Abudukadi Tudi, Артем Ромаевич Оганов

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  14. Two layered galloborates from centric to acentric structures: syntheses and NLO properties

    Chemical Communications · 2022-01-01

    Chong‐An Chen, Wenfang Liu, Guo‐Yu Yang

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  15. α-LiMB 9 O 15 (M = Sr, Pb): flexible [B 3 O 7 ] units leading to the low temperature phase of β-LiMB 9 O 15 (M = Sr, Pb)

    Inorganic Chemistry Frontiers · 2022-01-01

    Kaitong Liu, Jian Wei Han, Fuming Li, Shujuan Han, Zhihua Yang, Xuping Wang, Shilie Pan

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  16. Li2PbB2O5: A Pyroborate with Large Birefringence Induced by the Synergistic Effect of Stereochemical Active Lone Pair Cations and π-Conjugated [B2O5] Groups

    Inorganic Chemistry · 2022-11-04

    Jingdong Yan, Dongdong Chu, Zilong Chen, Jian Wei Han

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  17. Postsynthetic Modification of NU-1000 for Designing a Polyoxometalate-Containing Nanocomposite with Enhanced Third-Order Nonlinear Optical Performance

    Inorganic Chemistry · 2022-11-14

    Yangdan Pan, Soheila Sanati, Marzieh Nadafan, Reza Abazari, Junkuo Gao, Alexander M. Kirillov

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  18. d6versus d10, Which Is Better for Second Harmonic Generation Susceptibility? A Case Study of K2TGe3Ch8 (T = Fe, Cd; Ch = S, Se)

    Inorganic Chemistry · 2022-12-27

    Bingheng Ji, Fei Wang, Kui Wu, Bingbing Zhang, Jian Wang

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

    New Journal of Chemistry · 2023-01-01

    Xiangzhao Zhu, Hong-Dan Hu, Songhua Chen, Yuanming Li, Jianfeng Yan, Yaofeng Yuan

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  20. Two UV optical crystals with strong optical anisotropy, large band gaps and an α-BBO type structure

    Dalton Transactions · 2023-01-01

    Lehui Liu, Feifei Yuan, Yisheng Huang, Zhoubin Lin, Lizhen Zhang

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  21. Electronic Structures and NLO Properties of a Series of TMDs Lateral‐Core–Shell Heterostructures Quantum Dots

    Advanced Theory and Simulations · 2023-02-03

    Danting Li, Yadong Wei, Yang‐Yang Hu, Guiling Zhang, Weiqi Li, Jianqun Yang, Xingji Li, Wei Quan Tian

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  22. Fluorooxoborates: A precious treasure of deep-ultraviolet nonlinear optical materials

    Chinese Journal of Structural Chemistry · 2023-02-03

    Hongkang Su, Ziting Yan, Xueling Hou, Min Zhang

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  23. Structural design and characterization of a new chalcone molecular derivative crystal DMNC with high second-order nonlinear coefficient

    Chinese Journal of Structural Chemistry · 2023-03-01

    Jinkang Ma, Siyuan Hu, Xueting Mu, Rui Chen, Kun Meng, Bing Teng, Lifeng Cao, Degao Zhong

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  24. External electric field driven conformation of the wing-shaped nanographene to close: enhancing and tuning nonlinear optical properties

    Journal of Molecular Structure · 2023-05-29

    Ping-yao Gan, Xiao Huang, Wenbo Liu, Xue Min Bai, Xingjian Zhang, Fengwei Gao, Hong‐Liang Xu, Zhong‐Min Su

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  25. Discovery of a new bimetallic borate with strong optical anisotropy activated by π-conjugated [B 2 O 5 ] units

    Dalton Transactions · 2024-01-01

    Meihui Chen, Wei Wei, Jiawei Zhao, Donghai An, Yanna Chen

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  26. External electric field driven electronic structures: tunable nonlinear optical properties of helical bilayer nanographenes

    New Journal of Chemistry · 2024-01-01

    Ping-yao Gan, Xiao Huang, Fengwei Gao, Hong‐Liang Xu

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  27. From BaAlBO 3 F 2 to BaAlB 3 O 6 F 2 and BaAl 2 (B 3 O 6 ) 2 F 2 : the enhancement of birefringence and band gap by extending the π-conjugated system combined with [Al–O/F] functional groups

    Inorganic Chemistry Frontiers · 2024-01-01

    Cheng Chen, Danyang Dou, Yunjie Bai, Bingbing Zhang, Ying Wang

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  28. New antimony fluorooxoborates with strong birefringence and unprecedented structural characterisation

    Chemical Communications · 2024-01-01

    Chenhui Hu, Mengfan Wu, Jian Wei Han, Zhihua Yang, Shujuan Han, Shilie Pan

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  29. Physical properties of nanosystems with π-conjugated intermolecular bonds

    Unknown journal · 2024-01-01

    O. L. Pavlenko, Oksana Petrivna Dmytrenko, Mykola P. Kulish, Vyacheslav V. Lizunov, O.D. Kachkovsky

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  30. 1,3‐Diynes as Precursors for the Synthesis of Triazene‐ and Diethylaniline‐Bearing Push‐Pull NLOphores

    ChemistrySelect · 2024-02-16

    Fevzi Can Inyurt, Cagatay Dengiz

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  31. Solvent effects and self-assembled aggregation modulate nonlinear optical effects in indocyanine green-like dyes

    Optical Materials · 2024-03-12

    Xiaoxiao Li, Minjie Zhou, Shuhan Li, Fan Zhang, Zijing Li, Zhiqiang Li, Bing Jin

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  32. Theoretical investigation of the electronic and second-order non-linear optical properties of [n]helicene derivatives

    Computational and Theoretical Chemistry · 2024-06-15

    Chengxiang Liu, Lijing Gong, Binzhuo Gong

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  33. Synthesis, crystal structure and nonlinear optical property of 1-((propan-2-ylideneamino)oxy)propan-2-yl-4-methylbenzenesulfonate, C13H19O4NS

    Zeitschrift für Kristallographie - New Crystal Structures · 2024-06-19

    Guo-Ling Li, Ran Zhang

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  34. [H2dab][GaB5O10]: an Acentric Galloborate with a 4-Connected Uninodal Framework

    Chemical Research in Chinese Universities · 2024-07-12

    Wenfang Liu, Chongan Chen, Guo‐Yu Yang

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  35. Smart design of highly luminescent octupolar mesogenic tetra styryl-alkynyl bipyrimidine-based chromophores presenting non-linear optical properties

    Dyes and Pigments · 2024-07-18

    Deniz Vardar, Stéphania Abdallah, Rana Mhanna, Prescillia Nicolas, Ahmet Dok, Yovan de Coene, Stijn Van Cleuvenbergen, Olivier Jeannin, Jean‐Pierre Malval, Thierry Verbiest, Koen Clays, Nathalie Bellec, Belkis Bilgin‐Eran, Franck Camerel, H. Akdas

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  36. Quantum Chemical Prediction of Nonlinear Optical and Photovoltaic Properties in Linear and Bent Configurations of Carbazole/Borole Derivatives

    Arabian Journal for Science and Engineering · 2024-08-13

    Shamsa Bibi, Sameena, Shabbir Muhammad, Shafiq urRehman, Aijaz Rasool Chaudhry, Abdullah Godran Al-Sehemi, Sajjad Hussain, Shamraiz Hussain Talib

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  37. Impressive nonlinear optical response of π-conjugated, photoluminescent soft nanoparticles in polymer matrix

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  38. DFT Study on the Second-Order NLO Responses of 2-Phenyl Benzoquinoline Ir(III) Complexes by Substituents and Redox Effects

    The Journal of Physical Chemistry A · 2024-09-30

    Hequn Wang, Liting Sun, Yuanyuan Zhao, Yong‐Qing Qiu

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  39. Nonlinear optical cyanurate crystals

    Journal of Crystal Growth · 2024-10-09

    Xianghe Meng, Haotian Tian, Qian Wu, Mingjun Xia

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  40. Influence of monosaccharides and lipids on protein structure and solubility—Reaction simulation of sludge thermal hydrolysis system

    Bioresource Technology · 2024-12-04

    Ning Yang, Hua Ji, Shu-Cheng Yang

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  41. Novel antimony-based mixed halides exhibiting an excellent SHG response and a broad transmission range

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    Luli Wang, Han Luo, Siyu Chen, Ling Huang, Liling Cao, Xuehua Dong, Guohong Zou

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  42. Two mixed P–O anionic phosphates with a distinctive structural transformation and deep ultraviolet cutoff edge

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    Lei Wu, Hongyu Huang, Jialong Wang, Qun Jing, Yi Huang, Xuebin Yu, Zhaohui Chen

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  43. Design and Synthesis of Two Sn-Centered Mixed Halide Crystals with Enhanced Birefringence

    Inorganic Chemistry · 2025-01-21

    Hongkun Liu, Gangji Yi, Jiarong Lv, Xuehua Dong, Hongmei Zeng, Ling Huang, Zhien Lin, Guohong Zou

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  44. Phase-Matching Second-Harmonic Generation in Zero-Dimensional Zinc Thiocyanates Ligated with Chiral Amino Acids

    Inorganic Chemistry · 2025-04-17

    Qinglan Zhong, Gangji Yi, Juan Cheng, Xin Wang, Guohong Zou, Ling Huang, Zhien Lin

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  45. Quantum Chemical Insights into Metal-Ion Enhanced NLO Response of a Fluorescent Probe for Advanced Sensing Application

    Journal of Fluorescence · 2025-06-10

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  46. Modulation of Crystal Structure and Birefringence: Cation Size Effect in Alkali Metal Fluoroaluminoborates

    Inorganic Chemistry · 2025-08-02

    Chao Wei, Danyang Dou, Bingbing Zhang, Ying Wang

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  47. A Cobalt Borate Built by {B 12 } and {Co 3 } Clusters for Photothermal Conversion

    Inorganic Chemistry · 2025-11-21

    Chong‐An Chen, Zhenwen Wang, Guo‐Yu Yang

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  48. Zn(C 2 H 4 NO 2 ) 2 (SO 2 CH 3 NH 2 ) 2 and Zn(C 2 H 4 NO 2 ) 2 [SO 2 (NH 2 ) 2 ]: Regulation of Unique ZnO(C 2 H 4 NO 2 ) 2 Units by Polar Tetrahedrons for Balanced UV Nonlinear Optical Performance

    Advanced Science · 2026-05-08

    Cui Chenjie, Yuchen Yan, Xin Wen, Jindong Chen, Yi-Xiang Wang, Zhanggui Hu, Ning Ye, Guang Peng

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  49. MAlB3O6F2 (M = Ca and Pb): Two New Fluoroaluminoborates Featuring π-Conjugated [BO3] and [AlO4F2] Units with Large Birefringence

    Crystal Growth & Design · 2026-10-02

    Yaozu Li, Chao Wei, Wenjing Zhang, Huiyi Zhang, Bo Zhao, Bingbing Zhang, Ying Wang

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