Hydrogen storage capabilities of the most stable isomers of Na nBm (m + n = 6) clusters

Chinese Physics B

Volumn 20, Issue 4, 2011, Pages

  Ruan, Wen ^a   Xie, An Dong ^a   Yu, Xiao Guang ^a   Wu, Dong Lan ^a  

^a JINGGANGSHAN UNIVERSITY   (China)

Author keywords

density functional theory; geometric property; hydrogen storage capabilities; Na B clusters

Indexed keywords

BASIS SETS; BORON ATOM; BRIDGING BONDS; GEOMETRIC PROPERTY; HYDROGEN ATOMS; HYDROGEN STORAGE CAPABILITIES; HYDROGEN STORAGE CAPACITIES; HYDROGEN STORAGE PROPERTIES; INTERACTION ENERGIES; NA ATOMS; NA-B CLUSTERS; OSCILLATORY EFFECTS; STABLE ISOMERS; STABLE STRUCTURES; STORAGE CAPABILITY;

ATOMS; BINDING ENERGY; BORON; BORON COMPOUNDS; DENSITY FUNCTIONAL THEORY; HYDROGEN; ISOMERS; SODIUM;

HYDROGEN STORAGE;

EID: 79955686681     PISSN: 16741056     EISSN: None     Source Type: Journal    
DOI: 10.1088/1674-1056/20/4/043104     Document Type: Article

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