First-principles study on linear and nonlinear optical properties of ZnGeP2

doi:10.1088/1674-1056/24/3/034205

中国物理B ›› 2015, Vol. 24 ›› Issue (3): 34205-034205.doi: 10.1088/1674-1056/24/3/034205

• ELECTROMAGNETISM, OPTICS, ACOUSTICS, HEAT TRANSFER, CLASSICAL MECHANICS, AND FLUID DYNAMICS • 上一篇下一篇

First-principles study on linear and nonlinear optical properties of ZnGeP₂

肖瑞春^{a b}, 吴海信^a, 倪友保^a, 王振友^a, 黄昌保^{a b}, 程旭东^{a b}

a Anhui Institute of Optics and Fine Mechanics, Chinese Academy of Sciences, Hefei 230031, China;
b University of Chinese Academy of Sciences, Beijing 100049, China

收稿日期:2014-07-23 修回日期:2014-10-30 出版日期:2015-03-05 发布日期:2015-03-05
基金资助:
Project supported by the National Natural Science Foundation of China (Grant No. 51202250) and the Knowledge Innovation Program of the Chinese Academy of Sciences (Grant No. 13J131211).

First-principles study on linear and nonlinear optical properties of ZnGeP₂

Xiao Rui-Chun (肖瑞春)^{a b}, Wu Hai-Xin (吴海信)^a, Ni You-Bao (倪友保)^a, Wang Zhen-You (王振友)^a, Huang Chang-Bao (黄昌保)^{a b}, Cheng Xu-Dong (程旭东)^{a b}

a Anhui Institute of Optics and Fine Mechanics, Chinese Academy of Sciences, Hefei 230031, China;
b University of Chinese Academy of Sciences, Beijing 100049, China

Received:2014-07-23 Revised:2014-10-30 Online:2015-03-05 Published:2015-03-05
Contact: Wu Hai-Xin E-mail:hxwu@ircrystal.com
Supported by:
Project supported by the National Natural Science Foundation of China (Grant No. 51202250) and the Knowledge Innovation Program of the Chinese Academy of Sciences (Grant No. 13J131211).

摘要/Abstract

摘要：

The study of the linear and nonlinear optical properties of ZnGeP₂ based on density functional theory has been carried out. In order to get a more physical picture in the infrared region, terms which are considered as the phonon effect were added to the calculated refractive dispersion curves. The phonon-corrected calculation curves show excellent agreement with experimental refractive indexes, which gives a better comprehension of the linear optical proprieties in the transparent region. The static nonlinear optical susceptibility was investigated using approaches based on the “sum over states” and the 2n+1 theorem methods. Both of the results of these two methods reasonably coincided with the experimental results.

关键词: ZnGeP₂, phonon effect, 2n+1 theorem, “sum over state&rdquo, method

Abstract:

Key words: ZnGeP₂, phonon effect, 2n+1 theorem, “sum over state&rdquo, method

中图分类号: (Optical properties of bulk materials and thin films)

78.20.-e

42.65.-k (Nonlinear optics)

肖瑞春, 吴海信, 倪友保, 王振友, 黄昌保, 程旭东. First-principles study on linear and nonlinear optical properties of ZnGeP₂[J]. 中国物理B, 2015, 24(3): 34205-034205.

Xiao Rui-Chun (肖瑞春), Wu Hai-Xin (吴海信), Ni You-Bao (倪友保), Wang Zhen-You (王振友), Huang Chang-Bao (黄昌保), Cheng Xu-Dong (程旭东). First-principles study on linear and nonlinear optical properties of ZnGeP₂[J]. Chin. Phys. B, 2015, 24(3): 34205-034205.

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First-principles study on linear and nonlinear optical properties of ZnGeP₂

First-principles study on linear and nonlinear optical properties of ZnGeP₂

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