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Band Gap Reduction in Ferroelectric BaTiO(3) Through Heterovalent Cu-Te Co-Doping for Visible-Light Photocatalysis

It is believed that ferroelectrics may serve as efficient photocatalysts as well as photovoltaic materials but for their large bandgaps which does not allow them to absorb a large part of the solar spectrum. We have explored theoretically within ab-initio density functional theory-based calculations...

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Publicado en:Front Chem
Main Authors: Rohj, Rohit Kumar, Hossain, Akmal, Mahadevan, Priya, Sarma, D. D.
Formato: Artigo
Idioma:Inglês
Publicado: Frontiers Media S.A. 2021
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Acceso en liña:https://ncbi.nlm.nih.gov/pmc/articles/PMC8181162/
https://ncbi.nlm.nih.gov/pubmed/34109158
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3389/fchem.2021.682979
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