Density functional theory calculations of ozone adsorption on sidewall single-wall carbon nanotubes with Stone-Wales defects

Chemical Physics Letters

Volumn 445, Issue 4-6, 2007, Pages 281-287

  Akdim, Brahim ^a   Kar, Tapas ^b   Duan, Xiaofeng ^a   Pachter, Ruth ^a  

^a AIR FORCE RESEARCH LABORATORY   (United States)

^b UTAH STATE UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ADSORPTION; DEFECTS; DENSITY FUNCTIONAL THEORY; ELECTRONIC STRUCTURE; SINGLE-WALLED CARBON NANOTUBES (SWCN);

PYRAMIDALIZATION ANGLES; STRUCTURAL CHANGES;

OZONE;

EID: 34548383925     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2007.08.001     Document Type: Article

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