Two-dimensional Penta-BP5 Sheets: High-stability, Strain-tunable Electronic Structure and Excellent Mechanical Properties
Abstract Two-dimensional (2D) crystals exhibit unique and exceptional properties and show promise for various applications. In this work, we systematically studied the structures of a 2D boronphosphide (BP) monolayer with different stoichiometric ratios (BPx, x = 1, 2, 3, 4, 5, 6 and 7) and observed...
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2017
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oai:doaj.org-article:e00221ff84e442f5a61d1ee09815754b2021-12-02T12:32:19ZTwo-dimensional Penta-BP5 Sheets: High-stability, Strain-tunable Electronic Structure and Excellent Mechanical Properties10.1038/s41598-017-02011-92045-2322https://doaj.org/article/e00221ff84e442f5a61d1ee09815754b2017-05-01T00:00:00Zhttps://doi.org/10.1038/s41598-017-02011-9https://doaj.org/toc/2045-2322Abstract Two-dimensional (2D) crystals exhibit unique and exceptional properties and show promise for various applications. In this work, we systematically studied the structures of a 2D boronphosphide (BP) monolayer with different stoichiometric ratios (BPx, x = 1, 2, 3, 4, 5, 6 and 7) and observed that each compound had a stable 2D structure with metallic or semiconducting electronic properties. Surprisingly, for the BP5 compounds, we discovered a rare penta-graphene-like 2D structure with a tetragonal lattice. This monolayer was a semiconductor with a quasi-direct band gap of 2.68 eV. More importantly, investigation of the strain effect revealed that small uniaxial strain can trigger the band gap of the penta-BP5 monolayer to transition from a quasi-direct to direct band gap, whereas moderate biaxial strain can cause the penta-BP5 to transform from a semiconductor into a metal, indicating the great potential of this material for nanoelectronic device applications based on strain-engineering techniques. The wide and tuneable band gap of monolayer penta-BP5 makes it more advantageous for high-frequency-response optoelectronic materials than the currently popular 2D systems, such as transition metal dichalcogenides and black phosphorus. These unique structural and electronic properties of 2D BP sheets make them promising for many potential applications in future nanodevices.Shijie LiuBo LiuXuhan ShiJiayin LvShifeng NiuMingguang YaoQuanjun LiRan LiuTian CuiBingbing LiuNature PortfolioarticleMedicineRScienceQENScientific Reports, Vol 7, Iss 1, Pp 1-8 (2017) |
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Medicine R Science Q Shijie Liu Bo Liu Xuhan Shi Jiayin Lv Shifeng Niu Mingguang Yao Quanjun Li Ran Liu Tian Cui Bingbing Liu Two-dimensional Penta-BP5 Sheets: High-stability, Strain-tunable Electronic Structure and Excellent Mechanical Properties |
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Abstract Two-dimensional (2D) crystals exhibit unique and exceptional properties and show promise for various applications. In this work, we systematically studied the structures of a 2D boronphosphide (BP) monolayer with different stoichiometric ratios (BPx, x = 1, 2, 3, 4, 5, 6 and 7) and observed that each compound had a stable 2D structure with metallic or semiconducting electronic properties. Surprisingly, for the BP5 compounds, we discovered a rare penta-graphene-like 2D structure with a tetragonal lattice. This monolayer was a semiconductor with a quasi-direct band gap of 2.68 eV. More importantly, investigation of the strain effect revealed that small uniaxial strain can trigger the band gap of the penta-BP5 monolayer to transition from a quasi-direct to direct band gap, whereas moderate biaxial strain can cause the penta-BP5 to transform from a semiconductor into a metal, indicating the great potential of this material for nanoelectronic device applications based on strain-engineering techniques. The wide and tuneable band gap of monolayer penta-BP5 makes it more advantageous for high-frequency-response optoelectronic materials than the currently popular 2D systems, such as transition metal dichalcogenides and black phosphorus. These unique structural and electronic properties of 2D BP sheets make them promising for many potential applications in future nanodevices. |
format |
article |
author |
Shijie Liu Bo Liu Xuhan Shi Jiayin Lv Shifeng Niu Mingguang Yao Quanjun Li Ran Liu Tian Cui Bingbing Liu |
author_facet |
Shijie Liu Bo Liu Xuhan Shi Jiayin Lv Shifeng Niu Mingguang Yao Quanjun Li Ran Liu Tian Cui Bingbing Liu |
author_sort |
Shijie Liu |
title |
Two-dimensional Penta-BP5 Sheets: High-stability, Strain-tunable Electronic Structure and Excellent Mechanical Properties |
title_short |
Two-dimensional Penta-BP5 Sheets: High-stability, Strain-tunable Electronic Structure and Excellent Mechanical Properties |
title_full |
Two-dimensional Penta-BP5 Sheets: High-stability, Strain-tunable Electronic Structure and Excellent Mechanical Properties |
title_fullStr |
Two-dimensional Penta-BP5 Sheets: High-stability, Strain-tunable Electronic Structure and Excellent Mechanical Properties |
title_full_unstemmed |
Two-dimensional Penta-BP5 Sheets: High-stability, Strain-tunable Electronic Structure and Excellent Mechanical Properties |
title_sort |
two-dimensional penta-bp5 sheets: high-stability, strain-tunable electronic structure and excellent mechanical properties |
publisher |
Nature Portfolio |
publishDate |
2017 |
url |
https://doaj.org/article/e00221ff84e442f5a61d1ee09815754b |
work_keys_str_mv |
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1718394127214706688 |