Density functional theory study of the interaction of hydrogen with Li 6C 60

Journal of Physical Chemistry Letters

Volumn 3, Issue 9, 2012, Pages 1084-1088

  Wang, Qian ^a,b   Jena, Puru ^b  

^a PEKING UNIVERSITY   (China)

^b VIRGINIA COMMONWEALTH UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

C ATOMS; DESORPTION OF HYDROGEN; ENDOHEDRALS; GENERALIZED GRADIENT APPROXIMATIONS; GRAVIMETRIC DENSITY; HYDROGEN ADSORPTION; HYDROGEN ATOMS; HYDROGEN STORAGE PROPERTIES; LI ATOMS; LOCAL DENSITY;

ATOMS; DESORPTION; HYDROGEN; HYDROGEN STORAGE;

DENSITY FUNCTIONAL THEORY;

EID: 84860531976     PISSN: None     EISSN: 19487185     Source Type: Journal    
DOI: 10.1021/jz3002037     Document Type: Article

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