Insights into the adsorption of simple benzene derivatives on carbon nanotubes

RSC Advances

Volumn 4, Issue 101, 2014, Pages 58036-58046

  Liu, Yonglan ^a   Zhang, Jin ^a   Chen, Xiaohua ^a   Zheng, Jie ^b   Wang, Guixue ^a   Liang, Guizhao ^a  

^a CHONGQING UNIVERSITY   (China)

^b The University of Akron   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ADSORPTION; BENZENE; CARBON; CARBON NANOTUBES; COMPUTATIONAL CHEMISTRY; DESIGN FOR TESTABILITY; MATHEMATICAL MODELS; MOLECULAR GRAPHICS; MOLECULES; YARN;

ADSORPTION AND DESORPTIONS; ADSORPTION CHARACTERISTIC; BINDING CONFORMATIONS; BRIDGE CONFIGURATION; CORRELATION COEFFICIENT; NON-COVALENT FUNCTIONALIZATION; PREFERENTIAL INTERACTION; QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIP MODELING;

DENSITY FUNCTIONAL THEORY;

EID: 84909952346     PISSN: None     EISSN: 20462069     Source Type: Journal    
DOI: 10.1039/c4ra10195b     Document Type: Article

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