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journal article·2025-07-15Open access

Study of the structural and elastic properties of nonlinear optical material BaGa4S7

School of Materials Engineering, Yancheng Institute of Technology, Yancheng 224051, China, H. J. Hou, J. X. Bian, School of Materials Engineering, Yancheng Institute of Technology, Yancheng 224051, China, K.J. Liu, Shanghai PuChuang Intelligent Technology Co., Ltd, Shanghai 200120, China, W. X. Chen, School of Materials Engineering, Yancheng Institute of Technology, Yancheng 224051, China, X. W. Lu, School of Materials Engineering, Yancheng Institute of Technology, Yancheng 224051, China, S. R. Zhang, Department of Optoelectronics, Huaihua University, Huaihua 418000, China

Chalcogenide Letters· Volume 22· Issue 7
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Abstract

Utilizing first-principles method, the structural and anisotropic characteristics of BaGa4S7 has been meticulously investigated. The determined lattice parameters and elastic moduli exhibit a high degree of correlation with previously documented data. Based on its mechanical properties, BaGa4S7 demonstrates ductility and anisotropy. The anisotropic properties can be examined through a range of metrics.
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OpenAlex topics: Crystal Structures and Properties · High-pressure geophysics and materials · Solid-state spectroscopy and crystallography

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