Excited State Calculations of Cu-Doped Anatase TiO<sub>2</sub> (101) and (001) Nanofilms

Excited State Calculations of Cu-Doped Anatase TiO<sub>2</sub> (101) and (001) Nanofilms

Excited state calculations are performed to predict the electronic structure and optical absorption characteristics of Cu-doped anatase Ti<inline-formula><math xmlns="http://www.w3.org/1998/Math/MathML" display="inline"><semantics><msub><mo>O</mo&...

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Bibliographic Details
Main Authors: Yin-Pai Lin, Elina Neilande, Hanna Bandarenka, Siarhei Zavatski, Inta Isakoviča, Sergei Piskunov, Dmitry Bocharov, Eugene A. Kotomin
Format: Article
Language:English
Published: MDPI AG 2024-03-01
Series:Crystals
Subjects:
TiO<sub>2</sub> nanofilm
photocatalyst
Cu dopant
time-dependent density functional theory
absorption spectra
Online Access:https://www.mdpi.com/2073-4352/14/3/247

Internet

https://www.mdpi.com/2073-4352/14/3/247

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