Functionalized single-walled carbon nanotubes interacting with glycine amino acid: DFT study

We have investigated the adsorption of glycine on carbon nanotubes (CNTs) functionalized by various functional groups using density functional theory calculations. Compared with the pristine CNTs, the functionalized CNTs system has significantly higher binding energy value and shorter distance betwe...

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Veröffentlicht in:	Physica. B, Condensed matter Condensed matter, 2011-12, Vol.406 (23), p.4453-4459
Hauptverfasser:	Ganji, M.D., Bakhshandeh, A.
Format:	Artikel
Sprache:	eng
Schlagworte:	Ab initio calculations Adsorption Amino acids Condensed matter Condensed matter: electronic structure, electrical, magnetic, and optical properties Condensed matter: structure, mechanical and thermal properties Electronic structure and electrical properties of surfaces, interfaces, thin films and low-dimensional structures Electronic structure of nanoscale materials : clusters, nanoparticles, nanotubes, and nanocrystals Exact sciences and technology Fuctionalization Glycine Mathematical analysis Nanocomposites Nanoscale materials: clusters, nanoparticles, nanotubes, and nanocrystals Nanostructure Physics Structure of solids and liquids crystallography Surface chemistry SWCNTs
Online-Zugang:	Volltext
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