Anionic Aliovalent Substitution from Structure Models of ZnS: Novel Defect Diamond-like Halopnictide Infrared Nonlinear Optical Materials with Wide Band Gaps and Large SHG Effects

被引:57
作者
Chen, Jindong [1 ,2 ]
Lin, Chensheng [1 ]
Zhao, Dan [4 ]
Luo, Min [1 ]
Peng, Guang [1 ]
Li, Bingxuan [1 ]
Yang, Shunda [1 ]
Sun, Yingshuang [1 ,2 ]
Ye, Ning [1 ,3 ]
机构
[1] Chinese Acad Sci, Fujian Inst Res Struct Matter, Key Lab Optoelect Mat Chem & Phys, Fuzhou 350002, Fujian, Peoples R China
[2] Univ Chinese Acad Sci, Beijing 100049, Peoples R China
[3] Lab Optoelect Informat China, Technol Innovat, Fuzhou 350002, Fujian, Peoples R China
[4] Henan Polytech Univ, Coll Chem & Chem Engn, Jiaozuo 454000, Henan, Peoples R China
基金
中国国家自然科学基金;
关键词
anionic aliovalent substitution; defect diamond-like structure; halopnictides; IR NLO materials; second-harmonic generation; MID-IR; SINGLE-CRYSTALS; GROWTH; 1ST-PRINCIPLES; AGGASE2; ZNGEP2; PREDICTION; PHASES; DAMAGE; SE;
D O I
10.1002/anie.202010319
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
To design pnictide nonlinear optical materials with wide band gap and large second-harmonic generation, the heavy halogen I was introduced into pnictides through anionic aliovalent substitution with diamond-like ZnS as templates. Thus, four excellent halopnictide-based infrared nonlinear optical crystals, M(3)(II)PnI(3)(M-II=Zn, Cd; Pn=P, As), were obtained. They all exhibited defect diamond-like structures with highly parallel-oriented [M(II)PnI(3)] mixed-anionic tetrahedral groups, leading to excellent physical properties including wide band gaps (2.38-2.85 eV), large second harmonic generation responses (2.7-5.1xAgGaS(2)), high laser-induced damage thresholds (5.5-10.7xAgGaS(2)), and good IR transparency. In particular, Cd(3)PI(3)and Cd(3)AsI(3)achieved phase-matching (Delta n=0.035 and 0.031) that their template beta-ZnS could not do. Anionic aliovalent substitution provides a feasible strategy to design novel promising halopnictide IR NLO materials.
引用
收藏
页码:23549 / 23553
页数:5
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