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篇目详细内容

【篇名】 First-principle study on the optical response of phosphorene
【刊名】 Frontiers of Physics
【刊名缩写】 Front. Phys.
【ISSN】 2095-0462
【EISSN】 2095-0470
【DOI】 10.1007/s11467-015-0468-y
【出版社】
【出版年】 2015
【卷期】 10 卷4期
【页码】 9-107301 页,共 107293 页
【作者】 Jia-He Lin; Hong Zhang; Xin-Lu Cheng;
【关键词】 phosphorene nanostructures

【摘要】

The optical response of phosphorene nanostructures was studied using time-dependent density functional theory (TDDFT). Compared with the absorption spectrum of graphene, that of the phosphorene nanostructure exhibits high absorbance in the ultraviolet region, which indicates a high light absorptivity. In a low-energy resonance zone, a spectral band extends to the entire near-infrared regions. When the impulse excitation polarizes in the armchair-edge direction, the low-energy plasmon in a few-layer phosphorene nanostructure shows an apparent long-range charge-transfer excitation but is significantly less pronounced along the zigzag-edge direction. The edge configuration significantly affects the absorption spectrum of monolayer phosphorene nanostructures. The armchair-edge and the zigzag-edge serve different functions in the absorption spectrum. Moreover, the absorption spectrum of the few-layer phosphorene nanostructure changes with the number of layers when the impulse excitation polarizes in the armchair-edge direction. In addition, the change in the low-energy resonance zone is significantly different from that in the high-energy resonance zone.

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