Theoretical studies of the relative stabilities and electronic properties on B endohedral and exohedral fullerenes

Synthetic Metals

Volumn 152, Issue 1-3, 2005, Pages 325-328

  Pan, X M ^a   Fu, Z ^a   Hong, B ^a   Zhao, L ^a   Qiu, Y Q ^a   Su, Z M ^a   Wang, R S ^a  

^a NORTHEAST NORMAL UNIVERSITY   (China)

Author keywords

B endohedral and exohedral fullerene; DFT B3LYP method; Electronic properties; Fullerene complexes

Indexed keywords

ATOMS; DOPING (ADDITIVES); ELECTRONIC PROPERTIES; REDOX REACTIONS; STABILITY;

DFTB3/B3LYP METHOD; ENDOHEDRAL AND EXOHEDRAL FULLERENE; FULLERENE COMPLEXES;

FULLERENES;

EID: 24644473215     PISSN: 03796779     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.synthmet.2005.07.227     Document Type: Conference Paper

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