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Updated: Jul 31, 2025

Synthesis of a Thiol Building Block for the Crystallization of a Semiconducting Gyroidal Metal-sulfur Framework
Published on: April 9, 2018
Quaternary alkaline-earth metal thiophosphate SrAgPS4: syntheses, structures, and optical properties
Wenhao Xing1, Jian Tang1, Fei Liang2
1Institute of Chemical Materials, China Academy of Engineering Physics, Mianyang 621900, People's Republic of China. wlyin@caep.cn.
Abstract:
Metal thiophosphates have outstanding properties for the generation of mid-infrared coherent light and are an emerging nonlinear optical material system. In this study, a new non-centrosymmetric (NCS) quaternary alkaline-earth metal thiophosphate, SrAgPS4, was obtained via a high-temperature solid-state method. The new compound crystallizes in the NCS Ama2 (No. 40) space group and features two-dimensional [AgPS4]2- layers consisting of alternately connected [PS4] and [AgS4] tetrahedra. SrAgPS4 exhibits a strong phase-matched second harmonic generation response (1.10 × AgGaS2 at 2100 nm) and a large band gap (2.97 eV). In addition, theoretical calculations reveal the intrinsic relationship between the electronic structure and optical properties. This work enriches and greatly promotes the research on infrared nonlinear optical materials based on thiophosphates.
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