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RESEARCH PAPER · Inorganic Chemistry · 2017

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

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DFT-Based Comparative Study about the Influence of Fluorine and Hydroxyl Anions on Opto-Electric Properties of Borate Crystals: Choice for Better AnionOriginalA new method for the preparation of a [Sn 2 (H 2 PO 2 ) 3 ]Br SHG-active polar crystal via surfactant-induced strategy12Cation‐Tuned Synthesis of Fluorooxoborates: Towards Optimal Deep‐Ultraviolet Nonlinear Optical Materials191Cation‐Tuned Synthesis of Fluorooxoborates: Towards Optimal Deep‐Ultraviolet Nonlinear Optical Materials714Combination of d 10 -cations and fluorine anion as active participants to design novel borate/carbonate nonlinear optical materials24Nitrate nonlinear optical crystals: A survey on structure-performance relationships146Chromium Single-Atom Catalyst with Graphyne Support: A Theoretical Study of NO Oxidation and Reduction74Ln3+ (Ln3+ = La, Nd, Eu, Yb) incorporation in synthetic tourmaline analogues: Towards tourmaline REE pattern explanation16Strain‐Induced Structure Evolution of Multimetallic Nanoplates22The synthesis of novel lanthanum hydroxyborate at extreme conditions3Enhancing direct hydroxylation of benzene to phenol on Fe 1 /PMA single-atom catalyst: a comparative study of H 2 O 2 vs. O 2 -assisted reactions4Improving the Efficiency of Water Splitting and Oxygen Reduction Via Single‐Atom Anchoring on Graphyne Support23From B 3 O 3 (OH) 3 to B 3 O 3 F 3 : Uncovering Series of New Functional Units Based on [BO 2 F] Beneficial for Deep‐Ultraviolet Birefringence1Targeted hydroxyl fluorination for first-principles design of deep-ultraviolet nonlinear optical crystals: multi-property optimization & chromatic dispersion modulation in Li 2 CsB 7 O 10 F 41

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  1. A new method for the preparation of a [Sn 2 (H 2 PO 2 ) 3 ]Br SHG-active polar crystal via surfactant-induced strategy

    Dalton Transactions · 2017-01-01

    Jie‐Ling Xie, Yu-Hua Zhou, Long-Hua Li, Jian‐Han Zhang, Jun‐Ling Song

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  2. Cation‐Tuned Synthesis of Fluorooxoborates: Towards Optimal Deep‐Ultraviolet Nonlinear Optical Materials

    Angewandte Chemie · 2018-01-10

    Ying Wang, Bingbing Zhang, Zhihua Yang, Shilie Pan

    Read original paper ↗ ·
  3. Cation‐Tuned Synthesis of Fluorooxoborates: Towards Optimal Deep‐Ultraviolet Nonlinear Optical Materials

    Angewandte Chemie International Edition · 2018-01-10

    Ying Wang, Bingbing Zhang, Zhihua Yang, Shilie Pan

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  4. Combination of d 10 -cations and fluorine anion as active participants to design novel borate/carbonate nonlinear optical materials

    Journal of Alloys and Compounds · 2018-05-18

    Beenish Bashir, Bingbing Zhang, Shilie Pan, Zhihua Yang

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  5. Nitrate nonlinear optical crystals: A survey on structure-performance relationships

    Coordination Chemistry Reviews · 2019-09-10

    Xiaomeng Liu, Pifu Gong, Yi Jin Yang, Gaomin Song, Zheshuai Lin

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  6. Chromium Single-Atom Catalyst with Graphyne Support: A Theoretical Study of NO Oxidation and Reduction

    ACS Catalysis · 2020-08-21

    Shamraiz Hussain Talib, Sajjad Hussain, Sambath Baskaran, Zhansheng Lu, Jun Li

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  7. Ln3+ (Ln3+ = La, Nd, Eu, Yb) incorporation in synthetic tourmaline analogues: Towards tourmaline REE pattern explanation

    Chemical Geology · 2021-09-22

    Олег Сергеевич Верещагин, Sergey N. Britvin, Bernd Wunder, Olga V. Frank‐Kamenetskaya, Franziska Wilke, Natalia S. Vlasenko, Vladimir Vladimirovich Shilovskikh, Vladimir N. Bocharov, Denis V. Danilov

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  8. Strain‐Induced Structure Evolution of Multimetallic Nanoplates

    Advanced Functional Materials · 2022-07-30

    Azhar Mahmood, Dequan He, Shamraiz Hussain Talib, Ying He, Zhongqian Song, Liu Zhenbang, Dongxue Han, Li Niu

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  9. The synthesis of novel lanthanum hydroxyborate at extreme conditions

    Frontiers in Chemistry · 2023-09-28

    Olga A. Ibragimova, Lia Vaquero, Zain Hussein, Vadym Drozd, Stella Chariton, Vitali B. Prakapenka, Irina Chuvashova

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  10. Enhancing direct hydroxylation of benzene to phenol on Fe 1 /PMA single-atom catalyst: a comparative study of H 2 O 2 vs. O 2 -assisted reactions

    Materials Advances · 2024-01-01

    Beenish Bashir, Shamraiz Hussain Talib, Muhammad Ajmal Khan, Sharmarke Mohamed, Ahsanulhaq Qurashi, Hai Yan Xiao, Jun Li

    Read original paper ↗ ·
  11. Improving the Efficiency of Water Splitting and Oxygen Reduction Via Single‐Atom Anchoring on Graphyne Support

    Energy & environment materials · 2024-04-07

    Shamraiz Hussain Talib, Beenish Bashir, Muhammad Ajmal Khan, Babar Ali, Sharmarke Mohamed, Ahsanulhaq Qurashi, Jun Li

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  12. From B 3 O 3 (OH) 3 to B 3 O 3 F 3 : Uncovering Series of New Functional Units Based on [BO 2 F] Beneficial for Deep‐Ultraviolet Birefringence

    European Journal of Inorganic Chemistry · 2024-10-04

    Kewang Zhang, Dongdong Chu, Juanjuan Lu, Zhihua Yang, Shilie Pan

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  13. Targeted hydroxyl fluorination for first-principles design of deep-ultraviolet nonlinear optical crystals: multi-property optimization & chromatic dispersion modulation in Li 2 CsB 7 O 10 F 4

    Inorganic Chemistry Frontiers · 2026-01-01

    chenxu li, Haoran Wang, Min Zhang, Shilie Pan, Zhihua Yang

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