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RESEARCH PAPER · Applied Physics Letters · 2007

First-principles study of the structure, electronic, and optical properties of orthorhombic BiInO3

Chenliang Li, Hai Wang, Biao Wang, Rui Wang

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First-principles study of the structure, electronic, and optical properties of orthorhombic BiInO3OriginalFirst-principles study of electronic structure, mechanical and optical properties of V 4 AlC 349Significant second-harmonic generation in two lead-free polar oxides BiInO3 and BiAlO3: A first-principles investigation14High-pressure phase transitions in BiMO3 ( M=Al , Ga, and In):In situx-ray diffraction and Raman scattering experiments39Compositionally driven ferroelectric phase transition in xBiInO3–(1−x)BaTiO3: a lead-free perovskite-based piezoelectric material9Structural identification, electronic and optical properties of ZnSnO3: First principle calculations39Improved visible-light photocatalysis of nano-Bi2Sn2O7 with dispersed s-bands109First-principles study of the structural, elastic, electronic and optical properties of the monoclinic BiScO316Effects of aluminum vacancies on electronic structure and optical properties of Ta4AlC3: A first principles study7Structural, Electronic and Optical Properties of BiAl x Ga 1− x O 3 ( x = 0, 0.25, 0.5 and 0.75)10Polar and nonpolar phases of BiMO3: A review155Elastic moduli of orthorhombic perovskites6First-Principles Study of the Structural, Electronic and Optical Properties of Hexagonal LiIO 313Phase stability, electronic structure and optical properties of BiInO 3 under strain6First-principles study of the electronic and optical properties of a new metallic MoAlB109Understanding the structure–property relationships of the ferroelectric to relaxor transition of the (1 − x)BaTiO3–(x)BiInO3 lead-free piezoelectric system10Electronic, optical and thermal properties of Cr 3 AlB 4 by first-principles calculations19BiVO3 : A Bi-based material with promising uv-visible light absorption properties14Structural, optical, and thermal properties of MAX-phase Cr2AlB216Theoretical investigation of electronic, bonding and optical properties of nanolaminated boride WAlB7Thermal stability and electrical properties of BiFe1−xMxO3 (M = Al3+, Ga3+) ceramics12First-principles study of structural, electronic, ferroelectric, and vibrational properties of BiInO3 under high pressure10X-ray photoemission studies of BiInO3: Surface termination and effective Debye temperature13Comparative density functional studies of BiMO 3 polymorphs (M = Al, Ga, In) based on LDA, GGA, and meta -GGA functionals4Comprehensive review of micro/nanostructured ZnSnO 3 : characteristics, synthesis, and diverse applications44Study of structural, mechanical, thermodynamic, and optical properties of rare-earth based perovskite oxides AcXO3 (X = Al, Ga, In)14

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  1. First-principles study of electronic structure, mechanical and optical properties of V 4 AlC 3

    Journal of Physics D Applied Physics · 2009-02-25

    Chenliang Li, Biao Wang, Yuanshi Li, Rui Wang

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  2. Significant second-harmonic generation in two lead-free polar oxides BiInO3 and BiAlO3: A first-principles investigation

    Applied Physics Letters · 2009-05-11

    Sheng Ju, Tianyi Cai

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  3. High-pressure phase transitions in BiMO3 ( M=Al , Ga, and In):In situx-ray diffraction and Raman scattering experiments

    Physical Review B · 2009-12-04

    Hitoshi Yusa, Alexei А. Belik, Eiji Takayama‐Muromachi, Naohisa Hirao, Yasuo Ohishi

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  4. Compositionally driven ferroelectric phase transition in xBiInO3–(1−x)BaTiO3: a lead-free perovskite-based piezoelectric material

    Applied Physics Letters · 2010-05-31

    Kaustuv Datta, Emmanuelle Suard, Pamela A. Thomas

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  5. Structural identification, electronic and optical properties of ZnSnO3: First principle calculations

    Computational Materials Science · 2010-06-29

    Huiyang Gou, Faming Gao, Jingwu Zhang

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  6. Improved visible-light photocatalysis of nano-Bi2Sn2O7 with dispersed s-bands

    Journal of Materials Chemistry · 2011-01-01

    Jianjun Wu, Fuqiang Huang, Xujie Lü, Ping Chen, Dongyun Wan, Fangfang Xu

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  7. First-principles study of the structural, elastic, electronic and optical properties of the monoclinic BiScO3

    Physica B Condensed Matter · 2011-03-16

    Chenliang Li, Zhenqing Wang, Chaoying Wang

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  8. Effects of aluminum vacancies on electronic structure and optical properties of Ta4AlC3: A first principles study

    Physica B Condensed Matter · 2011-07-25

    Chenliang Li, Zhenqing Wang, Chaoying Wang

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  9. Structural, Electronic and Optical Properties of BiAl x Ga 1− x O 3 ( x = 0, 0.25, 0.5 and 0.75)

    Chinese Physics Letters · 2011-08-01

    Sai Gong, Yue-Hua Wang, Xinyin Zhao, Min Zhang, Na Zhao, Yi-Feng Duan

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  10. Polar and nonpolar phases of BiMO3: A review

    Journal of Solid State Chemistry · 2012-01-29

    Alexei А. Belik

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  11. Elastic moduli of orthorhombic perovskites

    Solid State Communications · 2013-01-11

    Ajay Singh Verma

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  12. First-Principles Study of the Structural, Electronic and Optical Properties of Hexagonal LiIO 3

    Chinese Physics Letters · 2013-06-01

    Gang Yao, Yu Chen, Xinyou An, Zhongqian Jiang, Linhong Cao, WU Wei-dong, Yan Zhao

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  13. Phase stability, electronic structure and optical properties of BiInO 3 under strain

    Journal of Physics D Applied Physics · 2014-01-03

    Chenliang Li, Zhenqing Wang, Decai Ma, Chaoying Wang, Baolai Wang

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  14. First-principles study of the electronic and optical properties of a new metallic MoAlB

    Scientific Reports · 2016-12-22

    Xiao‐Hong Li, Hong‐Ling Cui, Rui-Zhou Zhang

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  15. Understanding the structure–property relationships of the ferroelectric to relaxor transition of the (1 − x)BaTiO3–(x)BiInO3 lead-free piezoelectric system

    Journal of Materials Science · 2017-01-25

    Alicia Maria Manjón-Sanz, Caitlin Berger, Michelle Dolgos

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  16. Electronic, optical and thermal properties of Cr 3 AlB 4 by first-principles calculations

    Vacuum · 2017-09-06

    Xiao‐Hong Li, Hong‐Ling Cui, Rui-Zhou Zhang

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  17. BiVO3 : A Bi-based material with promising uv-visible light absorption properties

    Physical review. B./Physical review. B · 2017-10-30

    C. S. Praveen, Lorenzo Maschio, Michel Rérat, Vicente Timón, Matjaž Valant

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  18. Structural, optical, and thermal properties of MAX-phase Cr2AlB2

    Frontiers of Physics · 2017-12-26

    Xiao‐Hong Li, Hong‐Ling Cui, Rui-Zhou Zhang

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  19. Theoretical investigation of electronic, bonding and optical properties of nanolaminated boride WAlB

    Materials Chemistry and Physics · 2018-03-17

    Xiao‐Hong Li, Hong‐Ling Cui, Yongliang Yong, Rui-Zhou Zhang

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  20. Thermal stability and electrical properties of BiFe1−xMxO3 (M = Al3+, Ga3+) ceramics

    Journal of Materials Science Materials in Electronics · 2019-01-02

    Tian-Fu Cao, Jian‐Qing Dai, Jianhui Zhu, Xiaoya Li, Xiaowei Wang

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  21. First-principles study of structural, electronic, ferroelectric, and vibrational properties of BiInO3 under high pressure

    Journal of Physics and Chemistry of Solids · 2019-06-15

    Jakub Kaczkowski

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  22. X-ray photoemission studies of BiInO3: Surface termination and effective Debye temperature

    Journal of Applied Physics · 2021-07-13

    Archit Dhingra, Daniel Sando, Po-Shen Lu, Zoe G. Marzouk, V. Nagarajan, P. A. Dowben

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  23. Comparative density functional studies of BiMO 3 polymorphs (M = Al, Ga, In) based on LDA, GGA, and meta -GGA functionals

    New Journal of Chemistry · 2022-01-01

    Iwona Płowaś, Jakub Kaczkowski

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  24. Comprehensive review of micro/nanostructured ZnSnO 3 : characteristics, synthesis, and diverse applications

    RSC Advances · 2023-01-01

    Moksodur Rahman, Muhammad Shahriar Bashar, Lutfor Rahman, Faisal Islam Chowdhury

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  25. Study of structural, mechanical, thermodynamic, and optical properties of rare-earth based perovskite oxides AcXO3 (X = Al, Ga, In)

    Optical and Quantum Electronics · 2024-05-17

    Umair Mumtaz, Syed Awais Rouf, Hafiz Tariq Masood, A. A. Abd El-Moula, Muhammad Iqbal Hussain, Nasir Abbas, Ali S. Alshomrany, Noureddine Sfina

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