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RESEARCH PAPER · Materials Today Physics · 2023

Shooting mid-infrared nonlinear optical materials with targeted balance performances in ternary d0-transition metal oxides through first-principles

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Shooting mid-infrared nonlinear optical materials with targeted balance performances in ternary d0-transition metal oxides through first-principlesOriginal1D Van der Waals Polymers with Nonlinear Optical Performance Approaching Theoretical Upper Limit21Vanadate Crystals with an Enhanced Birefringence and a Broadened Transparency Spectrum through Controlled [VO3]∞ Chain Arrangements and Alkali Metal Cation Introduction4Theoretical Investigation of Structural, Electronic and Optical Properties of Cs3MoO4(HCO3) with NLO Active Functional Units2Polar and layered wide-bandgap semiconductors WO 2 Cl 2 and MoO 2 Br 2 with giant birefringence, large second harmonic and ferroelectric photovoltaic effects9Polymorphism of Niobium Phosphate Bronze Na4Nb8P4O32Deduced by the Packings of Structural Units: A Centrosymmetric Phase7Theoretical insight on structure, electronic, and optical properties of two d 0–d 10 electron transition-metal oxyhalides SHG materials2Emergent Mid‐Infrared Nonlinear Optical Candidates With Targeted Balance Performances17Multiscale tribomechanical analysis of wear mechanisms of monocrystalline silicon probe on functional KDP laser optics during ink-free DPN processes0A series of langasite-type compounds: size effect regulation for cation occupation and enhanced SHG response1ABCQ4型硫属化物红外非线性光学材料的构效关系(特邀)0高性能硫属化物红外非线性光学材料构效关系(特邀)0Room-Temperature Noncollinear Ferroelectricity in van der Waals WO 2 Cl 2 with a Wide Bandgap0Giant Birefringence and Ultrahigh Thermal Conductivity in Layered MgMoN 20

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  1. 1D Van der Waals Polymers with Nonlinear Optical Performance Approaching Theoretical Upper Limit

    Advanced Functional Materials · 2023-07-14

    Jingyu Yang, Jun Deng, Jinbo Pan, Yongqian Zhu, Yan‐Fang Zhang, Yuhui Li, Jia‐Tao Sun, Shixuan Du

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  2. Vanadate Crystals with an Enhanced Birefringence and a Broadened Transparency Spectrum through Controlled [VO3]∞ Chain Arrangements and Alkali Metal Cation Introduction

    Inorganic Chemistry · 2023-11-24

    Jinlei Cheng, Die Xu, Juanjuan Lu, Feng Zhang, Xueling Hou

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  3. Theoretical Investigation of Structural, Electronic and Optical Properties of Cs3MoO4(HCO3) with NLO Active Functional Units

    European Journal of Inorganic Chemistry · 2024-03-06

    Jinyu Hu, Yinsheng Huang, Hui Zhu, Huiyan Zhao, Chao He, Xihu Wang

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  4. Polar and layered wide-bandgap semiconductors WO 2 Cl 2 and MoO 2 Br 2 with giant birefringence, large second harmonic and ferroelectric photovoltaic effects

    Physical review. B./Physical review. B · 2024-04-16

    Hao Huo, Xiao Jiang, Lei Kang

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  5. Polymorphism of Niobium Phosphate Bronze Na4Nb8P4O32Deduced by the Packings of Structural Units: A Centrosymmetric Phase

    Inorganic Chemistry · 2024-04-22

    Jingfang Zhou, Pifu Gong, Aimin Ji, Mingjun Xia, Jiayi Jin, Qian Wu

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  6. Theoretical insight on structure, electronic, and optical properties of two d 0–d 10 electron transition-metal oxyhalides SHG materials

    Journal of Physics D Applied Physics · 2024-06-12

    Jinyu Hu, Jiamei Zhang, Huiyan Zhao, Chao He, Xihu Wang

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  7. Emergent Mid‐Infrared Nonlinear Optical Candidates With Targeted Balance Performances

    Small · 2024-12-23

    Junben Huang, Ailijiang Abudurusuli, Zhihua Yang, Shilie Pan

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  8. Multiscale tribomechanical analysis of wear mechanisms of monocrystalline silicon probe on functional KDP laser optics during ink-free DPN processes

    Tribology International · 2025-09-04

    Guang Chen, Enjie Dong, Yibo Liu, Linjie Zhao, Jixiang Chen, Hongqin Lei, Jian Ping Cheng, Mingjun Chen, Wenyu Ding, Qi Liu

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  9. A series of langasite-type compounds: size effect regulation for cation occupation and enhanced SHG response

    Inorganic Chemistry Frontiers · 2026-01-01

    Zhi Deng, Nian‐Tzu Suen, Zhen‐Cheng Wu, Huizhi Gao, Sheng‐Ping Guo

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  10. ABCQ4型硫属化物红外非线性光学材料的构效关系(特邀)

    Chinese Journal of Lasers · 2026-01-01

    王硕 Wang Shuo, 张成龙 Zhang Chenglong, 黄君本 Huang Junben, Ailijiang Abudurusuli, 吐沙姑·阿不都吾甫 Abudouwufu Tushagu

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  11. 高性能硫属化物红外非线性光学材料构效关系(特邀)

    Chinese Journal of Lasers · 2026-01-01

    张成龙 Zhang Chenglong, 王硕 Wang Shuo, Ailijiang Abudurusuli, 黄君本 Huang Junben

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  12. Room-Temperature Noncollinear Ferroelectricity in van der Waals WO 2 Cl 2 with a Wide Bandgap

    Physical Review Letters · 2026-06-16

    Yu Xing, Ning Ding, Zhipeng Wang, Zhiwen Pan, Lei Guo, Guowei Du, Yangrui Liu, Xiaoxing Cao, Ran Su, Mengting Jiang, Xuezhi Ma, Xiyu Chen, Junchao Zhang, Xinyu Yang, Haoran Ye, Honghong Yao, Rui Feng, Dexiang Chen, Le‐Ping Miao, YuMeng You, Zejun Li, Dongsheng Song, Linglong Li, Shuai Dong

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  13. Giant Birefringence and Ultrahigh Thermal Conductivity in Layered MgMoN 2

    Crystal Growth & Design · 2026-06-22

    Xu Liu, Ailijiang Abudurusuli, Zhaofeng Wu, Junben Huang

    Read original paper ↗ ·