二维β-AsP单层的可调谐电子和光电特性:第一原理研究

IF 2.9 3区 化学 Q3 CHEMISTRY, PHYSICAL
Zhonghui Xu, Kaiyu Wei, Zhengyu Wang, Junlin Jiang, San-huang Ke, Guogang Liu
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引用次数: 0

摘要

二维(2D)半导体因其引人入胜的电子特性引起了电子工程界的极大兴趣。在本研究中,我们通过第一性原理计算并结合应变工程,系统地研究了 β-AsP 单层的电子和光电特性。结果表明,β-AsP 单层具有合适的间接带隙和应变可调的电子结构。在此基础上,所设计的基于β-AsP单层的双电极光电探测器在近紫外区表现出很强的光电响应,在施加1 V的偏置电压下,最大光电流可达74。这些发现表明,β-AsP 单层是开发近紫外光检测器和光电器件的理想候选材料。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
Tunable electronic and optoelectronic characteristics of two-dimensional β-AsP monolayer: A first-principles study
Two-dimensional (2D) semiconductors have attracted a great deal of interest from the electrical engineering community due to their intriguing electronic properties. In this study, we have systematically investigated the electronic and optoelectronic properties of β-AsP monolayers by first-principles calculations combined with strain engineering. The results show that the β-AsP monolayer has a suitable indirect bandgap and a strain-tunable electronic structure. On this basis, the designed two-electrode photodetector based on β-AsP monolayer exhibits a strong photoelectric response in the near-ultraviolet region, and the maximum photocurrent can reach 74 under the applied bias voltage of 1 V. In particular, the strain engineering not only improves the photoelectric performance of the β-AsP-based photodetector, but also adjusts its photodetection range. These findings suggest that β-AsP monolayers are ideal candidates for the development of near-ultraviolet photodetectors and optoelectronic devices.
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来源期刊
Physical Chemistry Chemical Physics
Physical Chemistry Chemical Physics 化学-物理:原子、分子和化学物理
CiteScore
5.50
自引率
9.10%
发文量
2675
审稿时长
2.0 months
期刊介绍: Physical Chemistry Chemical Physics (PCCP) is an international journal co-owned by 19 physical chemistry and physics societies from around the world. This journal publishes original, cutting-edge research in physical chemistry, chemical physics and biophysical chemistry. To be suitable for publication in PCCP, articles must include significant innovation and/or insight into physical chemistry; this is the most important criterion that reviewers and Editors will judge against when evaluating submissions. The journal has a broad scope and welcomes contributions spanning experiment, theory, computation and data science. Topical coverage includes spectroscopy, dynamics, kinetics, statistical mechanics, thermodynamics, electrochemistry, catalysis, surface science, quantum mechanics, quantum computing and machine learning. Interdisciplinary research areas such as polymers and soft matter, materials, nanoscience, energy, surfaces/interfaces, and biophysical chemistry are welcomed if they demonstrate significant innovation and/or insight into physical chemistry. Joined experimental/theoretical studies are particularly appreciated when complementary and based on up-to-date approaches.
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