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Carborane super-nano-tubes

AuthorsBhattacharya, D.; Klein, D. J.; Oliva, José M.
Issue Date2015
CitationChemical Physics Letters 634: 71- 76 (2015)
Abstract© 2015 Elsevier B.V. All rights reserved. Nano-structures are naturally sought to be designed from a few especially stable multifunctional units, which can be manipulated into diverse chosen forms. To this end an icosahedral para-carborane unit is here investigated as a basic building block, to form super-carborane nano-tubes. The energetics for differing conceivable forms of the super-nanotubes is investigated, to reveal evidently more stable choices and asymptotic behaviors for long tubes. Further a lower frequency band of exo-carboraneic vibrations is revealed, and interpreted.
Identifiersdoi: 10.1016/j.cplett.2015.05.058
issn: 0009-2614
Appears in Collections:(IQFR) Artículos
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