Journal article
Journal of Molecular Liquids, vol. 377, 2023
Associate Professor of Chemistry | Hanyang University ERICA, South Korea
Center for Creative Convergence Education; Innovative Durable Building and Infrastructure Research Center
APA
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Amrhar, O., Lee, H.-S., Lgaz, H., Berisha, A., Ebenso, E. E., & Cho, Y. (2023). 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. Journal of Molecular Liquids, 377. https://doi.org/10.1016/j.molliq.2023.121554
Chicago/Turabian
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Amrhar, Otheman, Han-Seung Lee, Hassane Lgaz, Avni Berisha, Eno E. Ebenso, and Youngjae Cho. “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.” Journal of Molecular Liquids 377 (2023).
MLA
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Amrhar, Otheman, et al. “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.” Journal of Molecular Liquids, vol. 377, 2023, doi:10.1016/j.molliq.2023.121554.
BibTeX Click to copy
@article{amrhar2023a,
title = {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},
year = {2023},
journal = {Journal of Molecular Liquids},
volume = {377},
doi = {10.1016/j.molliq.2023.121554},
author = {Amrhar, Otheman and Lee, Han-Seung and Lgaz, Hassane and Berisha, Avni and Ebenso, Eno E. and Cho, Youngjae}
}