A New Deep-Ultraviolet Transparent Orthophosphate LiCs2PO4 with Large Second Harmonic Generation Response

被引:345
作者
Li, Lin [1 ,2 ]
Wang, Ying [1 ]
Lei, Bing-Hua [1 ,2 ]
Han, Shujuan [1 ]
Yang, Zhihua [1 ]
Poeppelmeier, Kenneth R. [3 ]
Pan, Shilie [1 ]
机构
[1] Chinese Acad Sci, Xinjiang Tech Inst Phys & Chem, Xinjiang Key Lab Elect Informat Mat & Devices, Key Lab Funct Mat & Devices Special Environm, 40-1 South Beijing Rd, Urumqi 830011, Peoples R China
[2] Univ Chinese Acad Sci, Beijing 100049, Peoples R China
[3] Northwestern Univ, Dept Chem, 2145 Sheridan Rd, Evanston, IL 60208 USA
基金
对外科技合作项目(国际科技项目); 美国国家科学基金会;
关键词
NONLINEAR-OPTICAL MATERIAL; BOND-VALENCE PARAMETERS; CRYSTAL-GROWTH; POLAR MATERIAL; ANIONIC GROUP; UNITS; PHOSPHATES; ALIGNMENT; SEMICONDUCTORS; POLYPHOSPHATE;
D O I
10.1021/jacs.6b06053
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
LiCs2PO4, a new deep-ultraviolet (UV) transparent material, was synthesized by the flux method. The material contains unusual edge-sharing LiO4-PO4 tetrahedra. It exhibits a very short absorption edge of A = 174 nm and generates the largest powder second harmonic generation (SHG) response for deep-UV phosphates that do not contain additional anionic groups, i.e., 2.6 times that of KH2PO4 (KDP). First-principles electronic structure analyses confirm the experimental results and suggest that the strong SHG response may originate from the aligned nonbonding O-2p orbitals. The discovery and characterization of LiCs2PO4 provide a new insight into the structure property relationships of phosphate-based nonlinear optical materials with large SHG responses and short absorption edges.
引用
收藏
页码:9101 / 9104
页数:4
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