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Influence of Capping Ligands, Solvent, and Thermal Effects on CdSe Quantum Dot Optical Properties by DFT Calculations
[Image: see text] Cadmium selenide nanomaterials are very important materials in photonics, catalysis, and biomedical applications due to their optical properties that can be tuned through size, shape, and surface passivation. In this report, static and ab initio molecular dynamics density functiona...
Autores principales: | Fenoll, Didac A., Sodupe, Mariona, Solans-Monfort, Xavier |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
American Chemical Society
2023
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10061629/ https://www.ncbi.nlm.nih.gov/pubmed/37008094 http://dx.doi.org/10.1021/acsomega.3c00324 |
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