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RESEARCH PAPER · Chemistry of Materials · 2020

Lattice Anharmonicity of Stereochemically Active Lone Pairs Controls Thermochromic Band Gap Reduction of PbVO3Cl

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Lattice Anharmonicity of Stereochemically Active Lone Pairs Controls Thermochromic Band Gap Reduction of PbVO3ClOriginalStructural Properties of NdTiO2+ x N1– x and Its Application as Photoanode15Periodic TableTalks: The Elements Never Go Out of Style2Lessons learned from FeSb2O4 on stereoactive lone pairs as a design principle for anion insertion17Reversible thermochromism to tune the bandgap of organic–inorganic hybrid materials24Lone but Not Alone: Precise Positioning of Lone Pairs for the Design of Photocatalytic Architectures38Chemistry, Structure, and Function of Lone Pairs in Extended Solids117Strategies and Considerations for Least-Squares Analysis of Total Scattering Data11Sn2P2S6: A lead-free reversible thermochromic ferroelectric with high near-infrared reflectance9Broadband emission originating from the stereochemical expression of 6s 2 lone pairs in two-dimensional lead bromide perovskites11Colorless to black switching with high contrast ratio via the electrochemical process of a hybrid organic–inorganic perovskite11Ultralow lattice thermal conductivity induced by anharmonic cation rattling and significant role of intrinsic point defects in TlBiS217Effect of Stereochemically Active Electron Lone Pairs on Magnetic Ordering in Trivanadates8Toggling Stereochemical Activity through Interstitial Positioning of Cations between 2D V2O5 Double Layers12Photocatalytic hydrogen evolution mechanisms mediated by stereoactive lone pairs of Sb2VO5 in quantum dot heterostructures9Internal strain-driven bond manipulation and band engineering in Bi 2− x Sb x YO 4 Cl photocatalysts with triple fluorite layers7Thermally Induced Lattice-Defective Oxygen Breathing in Perovskite-Structure Stannates with High-Contrast Reversible Thermochromism11Perovskitizer Tuning Pb 2+ 6s 2 Lone Pair Effects in Hybrid Perovskite Halide Enables Multiaxial Self‐Powered X‐Ray Detection20Stereochemical expression of Bi 6s 2 lone pairs mediates fluoride-ion (De)insertion in tunnel-structured Bi 2 PdO 4 and Bi 1.6 Pb 0.4 PtO 49Vanadium-based oxyhalide photocatalysts for visible-light-driven Z-scheme water splitting: advancing conduction band engineering0A nacre-inspired structural material with thermochromic properties and mechanical robustness by atomic-level design17Lone Pair Electron Manipulation: A Promising Avenue for Tuning Properties in Functional Materials3Covalency and Lone Pair-Driven Distortions in Sulfur-Doped Tin Niobate2Tuning birefringence in alkaline-earth metal oxyhalides through diverse mixed-cation coordination architectures1Irreversible thermochromic Pb 2 Sn 2 O 6 · x H 2 O: competition between weak ligand H 2 O and lone-pair electrons1Two-dimensional halide-based hybrid perovskite materials: properties, perspectives, and future scopes0Anion Exchange in LaBaInO 3 F 2 : Structural and Optical Effects of Low-Temperature Topochemical Modification3An Atom-Precise Approach to Damp First-Order Phase Transitions and Its Implications for Neuromorphic Signal Processing1Anomalous mass effect and coherent phonon transport in layered ternary chalcogenides X Sc Y 2 ( X = Li , Na; Y = Se , Te)0

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  1. Structural Properties of NdTiO2+ x N1– x and Its Application as Photoanode

    Inorganic Chemistry · 2020-12-29

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  2. Periodic TableTalks: The Elements Never Go Out of Style

    Inorganic Chemistry · 2021-04-26

    Javier Vela, Emily A. Weiss

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  3. Lessons learned from FeSb2O4 on stereoactive lone pairs as a design principle for anion insertion

    Cell Reports Physical Science · 2021-09-30

    Wasif Zaheer, George Agbeworvi, Saul Perez-Beltran, Justin L. Andrews, Yierpan Aierken, Conan R. Weiland, Cherno Jaye, Young‐Sang Yu, David A. Shapiro, Sirine C. Fakra, Daniel A. Fischer, Jinghua Guo, David Prendergast, Sarbajit Banerjee

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  4. Reversible thermochromism to tune the bandgap of organic–inorganic hybrid materials

    Materials Chemistry Frontiers · 2022-01-01

    Min Wan, Hao Chen, Yanning Wang, Ke Shi, Jing-Yuan Liu, Zi-Mu Li, Siyu Ye, Jun‐Yi Li, Li-Zhuang Chen

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  5. Lone but Not Alone: Precise Positioning of Lone Pairs for the Design of Photocatalytic Architectures

    Chemistry of Materials · 2022-01-31

    Joseph V. Handy, Wasif Zaheer, Arianna R.M. Rothfuss, Caitlin R. McGranahan, George Agbeworvi, Justin L. Andrews, Karoline E. García-Pedraza, John D. Ponis, Jaime R. Ayala, Yu Cheng Ding, David F. Watson, Sarbajit Banerjee

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  6. Chemistry, Structure, and Function of Lone Pairs in Extended Solids

    Accounts of Chemical Research · 2022-03-23

    Geneva Laurita, Ram Seshadri

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  7. Strategies and Considerations for Least-Squares Analysis of Total Scattering Data

    ACS Omega · 2022-04-18

    Carolyne Chepkemboi, Kyle Jorgensen, Janell Sato, Geneva Laurita

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  8. Sn2P2S6: A lead-free reversible thermochromic ferroelectric with high near-infrared reflectance

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    Meixia Wu, Xiao Zhou, Xihui Liang, Yifeng Han, Yonghong Li, Xingan Jiang, Xueyun Wang, Yisheng Chai, Xiang Zhou, Hui Yu Yang, Dan Lin, Ping Xu, Man‐Rong Li

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  9. Broadband emission originating from the stereochemical expression of 6s 2 lone pairs in two-dimensional lead bromide perovskites

    Dalton Transactions · 2023-01-01

    Xiaofan Jiang, Yu Tao, Jiazhen Gu, Leyang Jin, Chen Li, Wenkai Zhang, Yongping Fu

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  10. Colorless to black switching with high contrast ratio via the electrochemical process of a hybrid organic–inorganic perovskite

    Carbon Energy · 2023-03-24

    Ming Shuang Xu, Jianmin Gu, Zixun Fang, Yu Li, Xing Wang, Xiaoyu Zhao, Tifeng Jiao, Wei Wang

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  11. Ultralow lattice thermal conductivity induced by anharmonic cation rattling and significant role of intrinsic point defects in TlBiS2

    Physical review. B./Physical review. B · 2023-06-12

    Miaomiao Jian, Zhenzhen Feng, Yazhu Xu, Yuli Yan, Gaofeng Zhao, David Joseph Singh

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  12. Effect of Stereochemically Active Electron Lone Pairs on Magnetic Ordering in Trivanadates

    Inorganic Chemistry · 2023-08-02

    George Agbeworvi, Wasif Zaheer, John D. Ponis, Joseph V. Handy, Jaime R. Ayala, Justin L. Andrews, Parker Schofield, Cherno Jaye, Conan R. Weiland, Daniel A. Fischer, Sarbajit Banerjee

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  13. Toggling Stereochemical Activity through Interstitial Positioning of Cations between 2D V2O5 Double Layers

    Chemistry of Materials · 2023-08-31

    George Agbeworvi, Wasif Zaheer, Joseph V. Handy, Justin L. Andrews, Saul Perez-Beltran, Cherno Jaye, Conan R. Weiland, Daniel A. Fischer, Perla B. Balbuena, Sarbajit Banerjee

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  14. Photocatalytic hydrogen evolution mechanisms mediated by stereoactive lone pairs of Sb2VO5 in quantum dot heterostructures

    Chem Catalysis · 2023-12-20

    Wasif Zaheer, Caitlin R. McGranahan, Jaime R. Ayala, Karoline E. García-Pedraza, Luis J. Carrillo, Arianna R.M. Rothfuss, Udani K. Wijethunga, George Agbeworvi, Alice R. Giem, Justin L. Andrews, Joseph V. Handy, Saul Perez-Beltran, Rolando Calderón-Oliver, Lu Ma, Steven N. Ehrlich, Cherno Jaye, Conan R. Weiland, Daniel A. Fischer, David F. Watson, Sarbajit Banerjee

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  15. Internal strain-driven bond manipulation and band engineering in Bi 2− x Sb x YO 4 Cl photocatalysts with triple fluorite layers

    Chemical Science · 2024-01-01

    Artem Gabov, Daichi Kato, Hiroki Ubukata, Ryotaro Aso, Naoji Kakudou, Koji Fujita, Hajime Suzuki, Osamu Tomita, Akinori Saeki, Ryu Abe, Smagul Zh. Karazhanov, Hiroshi Kageyama

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  16. Thermally Induced Lattice-Defective Oxygen Breathing in Perovskite-Structure Stannates with High-Contrast Reversible Thermochromism

    ACS Applied Materials & Interfaces · 2024-02-26

    Xin Zhang, Yiwen Wang, Orest M. Ivasishin, Jiaqi Zhang, Long Yuan

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  17. Perovskitizer Tuning Pb 2+ 6s 2 Lone Pair Effects in Hybrid Perovskite Halide Enables Multiaxial Self‐Powered X‐Ray Detection

    Advanced Functional Materials · 2024-04-30

    Ruiqing Li, Bohui Xu, Jianbo Wu, Shihai You, Chengshu Zhang, Chengmin Ji, Zheshuai Lin, Junhua Luo

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  18. Stereochemical expression of Bi 6s 2 lone pairs mediates fluoride-ion (De)insertion in tunnel-structured Bi 2 PdO 4 and Bi 1.6 Pb 0.4 PtO 4

    Chemical Science · 2025-01-01

    George Agbeworvi, Anindya Pakhira, Shruti Hariyani, Wasif Zaheer, Alice R. Giem, Jaime R. Ayala, John D. Ponis, Saul Perez-Beltran, Cherno Jaye, Conan R. Weiland, Daniel A. Fischer, Hassan Said Bazzi, Mohammed Al‐Hashimi, Sarbajit Banerjee

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  19. Vanadium-based oxyhalide photocatalysts for visible-light-driven Z-scheme water splitting: advancing conduction band engineering

    Journal of Materials Chemistry A · 2025-01-01

    Hajime Suzuki, Ryuki Tomita, Yusuke Ishii, Osamu Tomita, Akinobu Nakada, Akinori Saeki, Ryu Abe

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  20. A nacre-inspired structural material with thermochromic properties and mechanical robustness by atomic-level design

    National Science Review · 2025-03-13

    Jun Pang, Z. Wang, Tao Song, Zhen-Bang Zhang, Yu‐Feng Meng, Sichao Zhang, Long Zhang, Weiyi Xing, Shu‐Hong Yu

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  21. Lone Pair Electron Manipulation: A Promising Avenue for Tuning Properties in Functional Materials

    European Journal of Inorganic Chemistry · 2025-04-07

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  22. Covalency and Lone Pair-Driven Distortions in Sulfur-Doped Tin Niobate

    Inorganic Chemistry · 2025-08-27

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  23. Tuning birefringence in alkaline-earth metal oxyhalides through diverse mixed-cation coordination architectures

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  24. Irreversible thermochromic Pb 2 Sn 2 O 6 · x H 2 O: competition between weak ligand H 2 O and lone-pair electrons

    Journal of Materials Chemistry C · 2026-01-01

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  25. Two-dimensional halide-based hybrid perovskite materials: properties, perspectives, and future scopes

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  27. An Atom-Precise Approach to Damp First-Order Phase Transitions and Its Implications for Neuromorphic Signal Processing

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  28. Anomalous mass effect and coherent phonon transport in layered ternary chalcogenides X Sc Y 2 ( X = Li , Na; Y = Se , Te)

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