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RESEARCH PAPER · Physical Chemistry Chemical Physics · 2017

The activity of lone pair contributing to SHG response in bismuth borates: a combination investigation from experiment and DFT calculation

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The activity of lone pair contributing to SHG response in bismuth borates: a combination investigation from experiment and DFT calculationOriginalOxyhalides: prospecting ore for optical functional materials with large laser damage thresholds76Advantageous Units in Antimony Sulfides: Exploration and Design of Infrared Nonlinear Optical Materials95Intriguing Structural Transition Inducing Variable Birefringences in ABa2MS4Cl (A = Rb, Cs; M = Ge, Sn)32Ce(IO3)2F2⋅H2O: The First Rare‐Earth‐Metal Iodate Fluoride with Large Second Harmonic Generation Response66Lone pair effects on ternary infrared nonlinear optical materials19Structural modulation induced by M IIIA metals in Ba 3 MQ 4 X (M = Al, Ga, In; Q = S, Se; X = Cl, Br): an experimental and computational analysis7Bismuth-Based Oxyborate Piezoelectric Crystals: Growth and Electro-Elastic Properties12Crystal Growth of Multifunctional Borates and Related Materials0Lone pair electron effect induced differences in linear and nonlinear optical properties of bismuth borates12Large optical polarizability causing positive effects on the birefringence of planar-triangular BO 3 groups in ternary borates18Directionality of Pb2+ lone pair electrons dictated hemi‐directed coordination mode of methyl‐ and ferrocenylcarboxylate complexes3Borates: A Rich Source for Optical Materials1089Significant second-harmonic generation and bulk photovoltaic effect in trigonal selenium and tellurium chains10Potential High-Temperature Piezoelectric Ceramics with Remarkable Performances Enhanced by the Second-Order Jahn–Teller Effect29Ψ-Polyhedral symbols for bismuth(III) with an active electron lone pair2Kyropoulos growth and characterization of monoclinic α-Bi 2 B 8 O 15 single crystal with a noncentrosymmetric structure4Photocatalytic and Photocurrent Responses to Visible Light of the Lone-Pair-Based Oxysulfide Sr6Cd2Sb6S10O728Towards the design of oxychalcogenide materials as candidates for solar water- splitting photocatalysis0Low Carrier Effective Masses in Photoactive Sr2Sb2O2Q3 (Q = S, Se): The Role of the Lone Pair17Chiral amino acid-templated tin fluorides tailoring nonlinear optical properties, birefringence, and photoluminescence17Stereochemically Active Lone Pairs: Unraveling the Electronic Origin of Dielectric Response in Nonlinear Optical TeO211Large second-harmonic generation and linear electro-optic effect in the bulk kagome lattice compound Nb3MX7 ( M=Se,S,Te ; X=I,Br )5The Chlorido-Bismuth Dication: A Potent Lewis Acid Captured in a Hepta-Coordinate Species with a Stereochemically Active Lone Pair7The influence of spin-orbit coupling on the electronic structure and optical properties of α-BiB3O6 crystals: a first-principles investigation3Maximizing the second-harmonic generation response via coordination-induced localization of nonbonding electrons12Persistent Second‐Harmonic Generation Enhancement Across an Unprecedented Pressure Range in a Hybrid Antimony Halide0Persistent Second‐Harmonic Generation Enhancement Across an Unprecedented Pressure Range in a Hybrid Antimony Halide0Synthetic Cosalite Pb2Bi2S5: Vibrational and Nonlinear Optical Properties0

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  1. Oxyhalides: prospecting ore for optical functional materials with large laser damage thresholds

    Journal of Materials Chemistry C · 2018-01-01

    Zhihua Yang, Cong Hu, Miriding Mutailipu, Yanzhou Sun, Kui Wu, Min Zhang, Shilie Pan

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  2. Advantageous Units in Antimony Sulfides: Exploration and Design of Infrared Nonlinear Optical Materials

    ACS Applied Materials & Interfaces · 2018-07-12

    Cong Hu, Bingbing Zhang, Bing‐Hua Lei, Shilie Pan, Zhihua Yang

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  3. Intriguing Structural Transition Inducing Variable Birefringences in ABa2MS4Cl (A = Rb, Cs; M = Ge, Sn)

    Inorganic Chemistry · 2018-08-24

    Yu Chu, Kui Wu, Xin Su, Jian Wei Han, Zhihua Yang, Shilie Pan

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  4. Ce(IO3)2F2⋅H2O: The First Rare‐Earth‐Metal Iodate Fluoride with Large Second Harmonic Generation Response

    Chemistry - A European Journal · 2018-11-08

    Tushagu Abudouwufu, Min Zhang, Shichao Cheng, Zhihua Yang, Shilie Pan

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  5. Lone pair effects on ternary infrared nonlinear optical materials

    Physical Chemistry Chemical Physics · 2019-01-01

    Ruonan Yin, Cong Hu, Bing‐Hua Lei, Shilie Pan, Zhihua Yang

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  6. Structural modulation induced by M IIIA metals in Ba 3 MQ 4 X (M = Al, Ga, In; Q = S, Se; X = Cl, Br): an experimental and computational analysis

    Dalton Transactions · 2019-01-01

    Abudukadi Tudi, Shujuan Han, Ailijiang Abudurusuli, Haohai Yu, Zhihua Yang, Shilie Pan

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  7. Bismuth-Based Oxyborate Piezoelectric Crystals: Growth and Electro-Elastic Properties

    Crystals · 2019-01-06

    Feifei Chen, Xiufeng Cheng, Fapeng Yu, Chunlei Wang, Xian Zhao

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  8. Crystal Growth of Multifunctional Borates and Related Materials

    MDPI eBooks · 2019-05-03

    Leonyuk, Nikolay I

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  9. Lone pair electron effect induced differences in linear and nonlinear optical properties of bismuth borates

    New Journal of Chemistry · 2019-12-11

    Wenbing Cai, Qun Jing, Jun Zhang

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  10. Large optical polarizability causing positive effects on the birefringence of planar-triangular BO 3 groups in ternary borates

    Dalton Transactions · 2020-01-01

    Xinyuan Zhou, Junben Huang, Gemei Cai, Heng-Wei Zhou, Yineng Huang, Xin Su

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  11. Directionality of Pb2+ lone pair electrons dictated hemi‐directed coordination mode of methyl‐ and ferrocenylcarboxylate complexes

    Applied Organometallic Chemistry · 2020-01-23

    Masthan Thamim, Kabali Senthilkumar, Nisha Job, Nallasamy Palanisami, Krishnan Thirumoorthy

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  12. Borates: A Rich Source for Optical Materials

    Chemical Reviews · 2020-12-14

    Miriding Mutailipu, Kenneth Reinhard Poeppelmeier, Shilie Pan

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  13. Significant second-harmonic generation and bulk photovoltaic effect in trigonal selenium and tellurium chains

    Physical Chemistry Chemical Physics · 2021-01-01

    Meijuan Cheng, Xiaohong Shi, Shunqing Wu, Zi‐Zhong Zhu

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  14. Potential High-Temperature Piezoelectric Ceramics with Remarkable Performances Enhanced by the Second-Order Jahn–Teller Effect

    ACS Applied Materials & Interfaces · 2021-03-19

    Yunjing Shi, Xiaoyu Dong, Kunyu Zhao, Weiwei Yang, Kun Zhu, Rui Hu, Huarong Zeng, Bo Shen, Jiwei Zhai

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  15. Ψ-Polyhedral symbols for bismuth(III) with an active electron lone pair

    Acta Crystallographica Section C Structural Chemistry · 2021-11-16

    Seik Weng Ng

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  16. Kyropoulos growth and characterization of monoclinic α-Bi 2 B 8 O 15 single crystal with a noncentrosymmetric structure

    CrystEngComm · 2021-11-24

    Mengdi Fan, Guangda Wu, Xinle Wang, Fapeng Yu, Chun Wang, Xian Zhao

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  17. Photocatalytic and Photocurrent Responses to Visible Light of the Lone-Pair-Based Oxysulfide Sr6Cd2Sb6S10O7

    Inorganic Chemistry · 2022-11-07

    Sandy Al Bacha, Sébastien Saitzek, Emma E. McCabe, Houria Kabbour

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  18. Towards the design of oxychalcogenide materials as candidates for solar water- splitting photocatalysis

    Unknown journal · 2023-10-03

    Sandy Al Bacha

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  19. Low Carrier Effective Masses in Photoactive Sr2Sb2O2Q3 (Q = S, Se): The Role of the Lone Pair

    Chemistry of Materials · 2023-10-23

    Sandy Al Bacha, Sébastien Saitzek, Pascal Roussel, Marielle Huvé, Emma E. McCabe, Houria Kabbour

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  20. Chiral amino acid-templated tin fluorides tailoring nonlinear optical properties, birefringence, and photoluminescence

    Dalton Transactions · 2023-11-30

    Ahyung Jung, Yang Li, Kang Min Ok

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  21. Stereochemically Active Lone Pairs: Unraveling the Electronic Origin of Dielectric Response in Nonlinear Optical TeO2

    The Journal of Physical Chemistry C · 2024-01-18

    Hoa H. Nguyen, Robin T. Macaluso, Muhammad N. Huda

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  22. Large second-harmonic generation and linear electro-optic effect in the bulk kagome lattice compound Nb3MX7 ( M=Se,S,Te ; X=I,Br )

    Physical review. B./Physical review. B · 2024-03-11

    Zhiwen Chen, Yimei Fang, Meijuan Cheng, Tie‐Yu Lü, Xinrui Cao, Zi‐Zhong Zhu, Shunqing Wu

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  23. The Chlorido-Bismuth Dication: A Potent Lewis Acid Captured in a Hepta-Coordinate Species with a Stereochemically Active Lone Pair

    Inorganic Chemistry · 2024-06-20

    Ahmed Fetoh, Felipe Fantuzzi, Crispin Lichtenberg

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  24. The influence of spin-orbit coupling on the electronic structure and optical properties of α-BiB3O6 crystals: a first-principles investigation

    Physica Scripta · 2024-09-27

    Guang Yang, Peng Hu, Hongheng Chen, Qun Jing

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  25. Maximizing the second-harmonic generation response via coordination-induced localization of nonbonding electrons

    Chemical Science · 2025-11-17

    Jia-Xiang Zhang, A-Lan Xu, Yang Chi, Xin-Tao Wu, Hua Lin, Qi‐Long Zhu

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  26. Persistent Second‐Harmonic Generation Enhancement Across an Unprecedented Pressure Range in a Hybrid Antimony Halide

    Angewandte Chemie International Edition · 2026-04-01

    Wenbo Qiu, Weilong He, Xingxing Jiang, Yu Liu, Boyang Fu, Weizhao Cai

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  27. Persistent Second‐Harmonic Generation Enhancement Across an Unprecedented Pressure Range in a Hybrid Antimony Halide

    Angewandte Chemie · 2026-04-01

    Wenbo Qiu, Weilong He, Xingxing Jiang, Yu Liu, Boyang Fu, Weizhao Cai

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  28. Synthetic Cosalite Pb2Bi2S5: Vibrational and Nonlinear Optical Properties

    Journal of Raman Spectroscopy · 2026-04-29

    Elizaveta A. Pankrushina, Evgenii M. Roginskii, Irina PUZANOVA, Д. А. Чареев

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