First-principles investigation of structural, electronic, optical, and elastic properties of TlPtF3 fluoroperovskite for optoelectronic applications
This study presents a comprehensive investigation of the structural, mechanical, electronic, and optical properties of the TlPtF3 compound, a thallium-based halide perovskite. Using density functional theory (DFT) within the CASTEP code, and considering both GGA and GGA+U approximations, we confirm...
Furkejuvvon:
| Váldodahkkit: | , , , , , |
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| Materiálatiipa: | Artigo |
| Giella: | Inglês |
| Almmustuhtton: |
Elsevier
2026-06-01
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| Ráidu: | Chemical Thermodynamics and Thermal Analysis |
| Fáttát: | |
| Liŋkkat: | http://www.sciencedirect.com/science/article/pii/S2667312626000544 |
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