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Hot-Carrier Transfer across a Nanoparticle–Molecule Junction: The Importance of Orbital Hybridization and Level Alignment
[Image: see text] While direct hot-carrier transfer can increase photocatalytic activity, it is difficult to discern experimentally and competes with several other mechanisms. To shed light on these aspects, here, we model from first-principles hot-carrier generation across the interface between pla...
Autores principales: | Fojt, Jakub, Rossi, Tuomas P., Kuisma, Mikael, Erhart, Paul |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
American Chemical Society
2022
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9650767/ https://www.ncbi.nlm.nih.gov/pubmed/36200744 http://dx.doi.org/10.1021/acs.nanolett.2c02327 |
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