Ab Initio Modeling of CuGa<sub>1−x</sub>In<sub>x</sub>S<sub>2</sub>, CuGaS<sub>2(1−x)</sub>Se<sub>2x</sub> and Ag<sub>1−x</sub>Cu<sub>x</sub>GaS<sub>2</sub> Chalcopyrite Solid Solutions for Photovoltaic Applications

Ab Initio Modeling of CuGa<sub>1−x</sub>In<sub>x</sub>S<sub>2</sub>, CuGaS<sub>2(1−x)</sub>Se<sub>2x</sub> and Ag<sub>1−x</sub>Cu<sub>x</sub>GaS<sub>2</sub> Chalcopyrite Solid Solutions for Photovoltaic Applications

Chalcopyrites are ternary semiconductor compounds with successful applications in photovoltaics. Certain chalcopyrites are well researched, yet others remain understudied despite showing promise. In this study, we use ab initio methods to study CuGaS<sub>2</sub>, AgGaS<sub>2</su...

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Bibliographic Details
Main Authors: Jurij Grechenkov, Aleksejs Gopejenko, Dmitry Bocharov, Inta Isakoviča, Anatoli I. Popov, Mikhail G. Brik, Sergei Piskunov
Format: Article
Language:English
Published: MDPI AG 2023-06-01
Series:Energies
Subjects:
chalcopyrites
solid solutions
density functional theory
ab initio calculation
photovoltaics
Online Access:https://www.mdpi.com/1996-1073/16/12/4823

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