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Perovskite solar cells (PSCs) are promising for next-generation photovoltaics, but their commercial viability is hindered by the toxicity of lead (Pb). This study investigates the performance of lead-free PSCs by comparatively evaluating four different perovskite absorber layers: FASnI3, CsSnI3, KGeCl3 and CsGeI3. Usin...
This work addresses a critical gap in data-driven modeling of low-dimensional quantum materials by curating a dataset of 254 functionalized and doped graphene and silicon carbide quantum dots with DFT-computed HOMO and LUMO energies, establishing a foundation for high-throughput screening and inverse design of quantum...
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