A DFT study of H2 adsorption on functionalized carbon nanotubes

Physica E: Low-Dimensional Systems and Nanostructures

Volumn 54, Issue , 2013, Pages 115-117

  Soleymanabadi, Hamed ^a   Kakemam, Jamal ^b  

^a ISLAMIC AZAD UNIVERSITY   (Iran)

^b ISLAMIC AZAD UNIVERSITY   (Iran)

Author keywords

Adsorption; Bandgap; DFT; Hydrogen storage

Indexed keywords

BINDING AFFINITIES; CHEMICAL FUNCTIONALIZATION; DFT; FUNCTIONALIZED CARBON NANOTUBES; HOMO-LUMO ENERGY GAP; HYDROGEN ADSORPTION CAPACITY; MOLECULAR HYDROGEN; POTENTIAL BARRIERS;

BINDING ENERGY; CARBON NANOTUBES; ENERGY GAP; FUNCTIONAL GROUPS; HYDROGEN STORAGE;

ADSORPTION;

EID: 84880056112     PISSN: 13869477     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.physe.2013.06.015     Document Type: Article

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