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A Holistic View of the Interactions between Electron-Deficient Systems: Clustering of Beryllium and Magnesium Hydrides and Halides

In the search for common bonding patterns in pure and mixed clusters of beryllium and magnesium derivatives, the most stable dimers and trimers involving BeX(2) and MgX(2) (X = H, F, Cl) have been studied in the gas phase using B3LYP and M06-2X DFT methods and the G4 ab initio composite procedure. T...

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Detalles Bibliográficos
Autores principales: Mó, Otilia, Montero-Campillo, M. Merced, Yáñez, Manuel, Alkorta, Ibon, Elguero, José
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10673300/
https://www.ncbi.nlm.nih.gov/pubmed/38005228
http://dx.doi.org/10.3390/molecules28227507