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Impact of fluorination on the energy level alignment of an F(n)ZnPc/MAPbI(3) interface
We have studied interactions at an interface between a Methylammonium Lead Iodide (MAPbI(3)) surface and zinc-phthalocyanine molecules with F substituting peripheral H (F(n)ZnPc; n = 4, 8, 12, and 16) by employing hybrid density functional theory (DFT) based simulations. These calculations show that...
| Autores principales: | , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
RSC
2022
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9680936/ https://www.ncbi.nlm.nih.gov/pubmed/36504749 http://dx.doi.org/10.1039/d2na00582d |