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Crystal and electronic structure of the sub-stoichiometric photocatalyst Cu4Se6: DFT study

Ruslan Kevorkyants Orcid Logo, Saima Farooq, Chedly Tizaoui Orcid Logo

Journal of Physics and Chemistry of Solids, Volume: 162, Start page: 110529

Swansea University Author: Chedly Tizaoui Orcid Logo

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Published in: Journal of Physics and Chemistry of Solids
ISSN: 0022-3697
Published: Elsevier BV 2022
Online Access: Check full text

URI: https://cronfa.swan.ac.uk/Record/cronfa60820
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Keywords: Photocatalysis, DFT, Cu2-xSe, Electronic structure, Molecular modeling
College: Faculty of Science and Engineering
Funders: EPSRC (EP/M028267/1), the European Regional Development Fund through the Welsh Government (80708), and the Ser Solar project via Welsh Government.
Start Page: 110529