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Thermodynamic Complexing of Monocyclopentadienylferrum (II) Intercalates with Double-Walled Carbon Nanotubes

By employing the methods of molecular mechanics, semi-empirical quantum-chemical РМ3 and Monte-Carlo, the positioning of monocyclopentadienylferrum (II) molecules in double-walled (5,5)@(10,10) carbon nanotubes (CNT) depending on their concentration and temperature has been studied. The molecules ha...

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Detalles Bibliográficos
Autores principales:	Мykhailenko, О. V., Prylutskyy, Yu I., Кomarov, І. V., Strungar, А. V.
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	Springer US 2016
Materias:	Nano Express
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4781790/ https://www.ncbi.nlm.nih.gov/pubmed/26951128 http://dx.doi.org/10.1186/s11671-016-1351-7

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