Comprehensive study on the dissociative chemisorption of NH 3 on the sidewalls of stone-wales defective armchair (5,5) single-walled carbon nanotubes

Journal of Physical Chemistry C

Volumn 116, Issue 10, 2012, Pages 6012-6021

  Turabekova, M A ^a,b   Dinadayalane, Tandabany C ^a   Leszczynska, Danuta ^a,b   Leszczynski, Jerzy ^a  

^a JACKSON STATE UNIVERSITY   (United States)

^b Jackson State University   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ADSORPTION SITE; B3LYP/6-31G; C-C BONDS; CARBON ATOMS; COMPREHENSIVE STUDIES; DEFECT SITES; DEFECT-FREE; DISSOCIATIVE CHEMISORPTION; ENERGY PRODUCTS; HOMO-LUMO ENERGY GAP; LOW ENERGIES; REACTION ENERGY; STONE-WALES DEFECTS; SYSTEMATIC STUDY;

ADSORPTION; AMMONIA; DISSOCIATION; NANOTUBES; SURFACE DEFECTS;

CHEMISORPTION;

EID: 84858311051     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp2098685     Document Type: Article

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