Evaluating the performance of Cs2PtI6−xBrx for photovoltaic and photocatalytic applications using first-principles study and SCAPS-1D simulation

Evaluating the performance of Cs2PtI6−xBrx for photovoltaic and photocatalytic applications using first-principles study and SCAPS-1D simulation

All inorganic free-lead halide double perovskites are attractive materials in solar energy harvesting applications. In this study, density functional theory calculations have been used to predict the structures, band structures, and density of states of Cs2PtI6−xBrx with (x = 0, 2, 4, and 6). The op...

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Bibliographic Details
Main Authors: Hadeer H. AbdElAziz, Mohamed Taha, Waleed M.A. El Rouby, M.H. Khedr, Laila Saad
Format: Article
Language:English
Published: Elsevier 2022-10-01
Series:Heliyon
Subjects:
Perovskite
DFT
Solar cell
Cs2PtI6
Photocatalysis
SCAPS-1D
Online Access:http://www.sciencedirect.com/science/article/pii/S2405844022020965

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http://www.sciencedirect.com/science/article/pii/S2405844022020965

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