Theoretical study of CO adsorption on the surface of BN, AlN, BP and AlP nanotubes

Surface Science

Volumn 606, Issue 11-12, 2012, Pages 981-985

  Beheshtian, Javad ^a   Baei, Mohammad T ^b   Peyghan, Ali Ahmadi ^c  

^a SHAHID RAJAEE TEACHER TRAINING UNIVERSITY   (Iran)

^b ISLAMIC AZAD UNIVERSITY   (Iran)

^c ISLAMIC AZAD UNIVERSITY   (Iran)

Author keywords

Aluminum nitride nanotubes; Aluminum phosphide nanotubes; B97D; Boron nitride nanotubes; Boron phosphide nanotubes; Density functional theory

Indexed keywords

ADSORPTION BEHAVIOR; ALN; B97D; BN NANOTUBE; BORON NITRIDE NANOTUBES; CO ADSORPTION; DENSITY FUNCTIONAL THEORIES (DFT); DENSITY FUNCTIONAL THEORY CALCULATIONS; ENERGY VALUE; FRONTIER MOLECULAR ORBITALS; FUNCTIONAL CHANGES; FUNCTIONALS; HIGH ENERGY; LUMO ENERGY LEVELS; THEORETICAL STUDY;

ADSORPTION; ALUMINUM NITRIDE; MOLECULAR ORBITALS; TUBES (COMPONENTS);

NANOTUBES;

EID: 84859165361     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.susc.2012.02.019     Document Type: Article

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