Gas sensing properties of platinum derivatives of single-walled carbon nanotubes: A DFT analysis

Journal of Molecular Graphics and Modelling

Volumn 28, Issue 1, 2009, Pages 62-69

  Pannopard, P ^a,b   Khongpracha, P ^a,b   Probst, M ^c   Limtrakul, J ^a,b  

^a Faculty of Engineering   (Thailand)

^b KASETSART UNIVERSITY   (Thailand)

^c UNIVERSITY OF INNSBRUCK   (Austria)

Author keywords

Defected CNTs; DFT; NH3; NO2; Pt CNT assemblies; Sensor

Indexed keywords

DEFECTED CNTS; DFT; NH3; NO2; PT-CNT ASSEMBLIES;

ADSORPTION; CARBON NANOTUBES; CHARGE TRANSFER; ELECTRONIC STRUCTURE; ION EXCHANGE; PROBABILITY DENSITY FUNCTION; SENSORS; SINGLE-WALLED CARBON NANOTUBES (SWCN); SULFUR COMPOUNDS;

PLATINUM;

AMMONIA; CARBON NANOTUBE; NITROGEN DIOXIDE; PLATINUM DERIVATIVE; SINGLE WALLED NANOTUBE;

ADSORPTION; ARTICLE; COMPLEX FORMATION; DENSITY FUNCTIONAL THEORY; DEVICE; GAS; GEOMETRY; PRIORITY JOURNAL; SENSOR;

AMMONIA; MODELS, THEORETICAL; NANOTUBES, CARBON; NITROGEN DIOXIDE; PLATINUM;

EID: 69249229727     PISSN: 10933263     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jmgm.2009.04.005     Document Type: Article

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