Interaction between zigzag single-wall carbon nanotubes and polymers: A density-functional study

Journal of Chemical Physics

Volumn 122, Issue 21, 2005, Pages

  Simeoni, Mirko ^a   De Luca, Cinzia ^a   Picozzi, Silvia ^a   Santucci, Sandro ^a   Delley, Bernard ^b  

^a UNIVERSITY OF L'AQUILA   (Italy)

^b PAUL SCHERRER INSTITUTE   (Switzerland)

Author keywords

[No Author keywords available]

Indexed keywords

ELASTIC CONSTANTS; EQUILIBRIUM STRUCTURAL PROPERTIES; EXCHANGE-CORRELATION FUNCTIONS; HYDROGEN ELECTRONEGATIVITY; METALLIC SURFACES; PHOTOVOLTAIC (PV); POLYMERIC MATRIX; SINGLE-WALL CARBON NANOTUBES (SWNT);

AROMATIC POLYMERS; ELECTRONIC STRUCTURE; HYDROGEN; LIGHT EMITTING DIODES; MOLECULES; MONOMERS; NITROGEN COMPOUNDS; SEMICONDUCTING POLYMERS; SEMICONDUCTOR DEVICES;

CARBON NANOTUBES;

EID: 21244465505     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1925272     Document Type: Article

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