From Two‐ to Three‐Dimensional Structures of a Supertetrahedral Boran Using Density Functional Calculations

With help of the DFT calculations and imposing of periodic boundary conditions the geometrical and electronic structures were investigated of two‐ and three‐dimensional boron systems designed on the basis of graphane and diamond lattices in which carbons were replaced with boron tetrahedrons. The co...

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Detalles Bibliográficos
Autores principales: Getmanskii, Iliya V., Minyaev, Ruslan M., Steglenko, Dmitrii V., Koval, Vitaliy V., Zaitsev, Stanislav A., Minkin, Vladimir I.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: John Wiley and Sons Inc. 2017
Materias:
Communications
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5574009/
https://www.ncbi.nlm.nih.gov/pubmed/28402596
http://dx.doi.org/10.1002/anie.201701225

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5574009/
https://www.ncbi.nlm.nih.gov/pubmed/28402596
http://dx.doi.org/10.1002/anie.201701225

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