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Superhalogen Anions Supported by the Systems Comprising Alternately Aligned Boron and Nitrogen Central Atoms
Using DFT/(B3LYP/wB97XD/B2PLYPD) and OVGF electronic structure methods with flexible atomic orbital basis sets, we examined the series of polynuclear superhalogen anions matching the (BF(3)(BN)( n )F(4n+1))(–) formula (for n = 1-10,13,18-20) containing alternately aligned boron and nitrogen central...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Frontiers Media S.A.
2022
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9068874/ https://www.ncbi.nlm.nih.gov/pubmed/35529695 http://dx.doi.org/10.3389/fchem.2022.863408 |