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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...
| Autores principales: | , , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
John Wiley and Sons Inc.
2017
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| Materias: | |
| 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 |