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Magnetically Induced Current Densities in Zinc Porphyrin Nanoshells
[Image: see text] The molecular structures of porphyrinoid cages were obtained by constructing small polyhedral graphs whose vertices have degree-4. The initial structures were then fully optimized at the density functional theory (DFT) level using the generalized gradient approximation. Some of pol...
| Autores principales: | , , , |
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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/PMC8978182/ https://www.ncbi.nlm.nih.gov/pubmed/35302768 http://dx.doi.org/10.1021/acs.jpca.1c10815 |