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Cs2TlAlCl6和Cs2TlAlBr6的结构稳定性和能量转换潜力:来自DFT基础光学基准测试和光伏评估的见解

Structural stability and energy conversion potential of Cs2TlAlCl6 and Cs2TlAlBr6: insights from DFT-based optical benchmarking and photovoltaic assessment

The study investigates the structural stability and photovoltaic potential of double perovskite materials Cs2TlAlCl6 and Cs2TlAlBr6 using Density Functional Theory (DFT) calculations. / 本研究利用密度泛函理论(DFT)计算,研究了双钙钛矿材料Cs2TlAlCl6和Cs2TlAlBr6的结构稳定性和光伏潜力。

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2026-10-29 18:05:24
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Material: Cs2TlAlCl6, Cs2TlAlBr6Method: DFT-based optical benchmarkingApplication: Photovoltaic assessment

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automated knowledge publish农场主2026-10-29 18:05:24

Record title: Structural stability and energy conversion potential of Cs2TlAlCl6 and Cs2TlAlBr6: insights from DFT-based optical benchmarking and photovoltaic assessment.