Quantum-chemical model evaluations of thermodynamics and kinetics of oxygen atom additions to narrow nanotubes

Journal of Nanoscience and Nanotechnology

Volumn 3, Issue 1-2, 2003, Pages 193-198

  Slanina, Zdeněk ^a,b   Stobinski, Leszek ^c,d   Tomasik, Piotr ^e   Lin, Hong Ming ^c   Adamowicz, Ludwik ^f  

^a INSTITUTE FOR MOLECULAR SCIENCE   (Japan)

^b INSTITUTE OF CHEMISTRY   (Taiwan)

^c TATUNG UNIVERSITY   (Taiwan)

^d INSTITUTE OF PHYSICAL CHEMISTRY   (Poland)

^e UNIVERSITY OF AGRICULTURE IN KRAKOW   (Poland)

^f University of Arizona   (United States)

Author keywords

Chemisorption; Functionalization; Gas Sensors; Molecular Electronics; Narrow Nanotubes; Oxygen Additions; Quantum Chemical Modeling; Thermodynamic and Kinetic Control

Indexed keywords

CARBON NANOTUBE; FULLERENE DERIVATIVE; OXYGEN;

ADSORPTION; ARTICLE; CALCULATION; CHEMICAL BOND; ENTHALPY; ISOMER; MODEL; QUANTUM CHEMISTRY; THERMODYNAMICS; CHEMICAL STRUCTURE; CHEMISTRY; CLASSIFICATION; COMPUTER SIMULATION; CONFORMATION; CRYSTALLOGRAPHY; ENERGY TRANSFER; ENTROPY; EVALUATION; METHODOLOGY; NANOTECHNOLOGY; OXIDATION REDUCTION REACTION; QUANTUM THEORY; STEREOISOMERISM;

COMPUTER SIMULATION; CRYSTALLOGRAPHY; ENERGY TRANSFER; ENTROPY; MODELS, MOLECULAR; MOLECULAR CONFORMATION; MOLECULAR STRUCTURE; NANOTECHNOLOGY; NANOTUBES, CARBON; OXIDATION-REDUCTION; OXYGEN; QUANTUM THEORY; STEREOISOMERISM; THERMODYNAMICS;

EID: 0041382780     PISSN: 15334880     EISSN: None     Source Type: Journal    
DOI: 10.1166/jnn.2003.190     Document Type: Article

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