A multi-scale computational investigation of cationic dye interaction with rutile TiO2: An interconnected simulation approach
Author:
Funder
National Research Foundation of Korea
Ministry of Science, ICT and Future Planning
Publisher
Elsevier BV
Reference47 articles.
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3. A rutile phase-TiO2 film via a facile hydrothermal method for photocatalytic methylene blue dye decolourization;Shilpa;Mater. Today:. Proc.,2022
4. Investigation on influence of thickness variation effect of TiO2 film, spacer and counter electrode for improved dye-sensitized solar cells performance;Abdel-Galeil;Optik,2021
5. Computational insights into the adsorption mechanisms of anionic dyes on the rutile TiO2 (1 1 0) surface: combining SCC-DFT tight binding with quantum chemical and molecular dynamics simulations;Amrhar;J. Mol. Liq.,2023
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