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Journal of the Chemical Society, Dalton Transactions

Volumn , Issue 3, 2002, Pages 399-404

A pyracylene model for the interaction of transition metals with fullerenes: A density functional study

(3) Nunzi, Francesca a Sgamellotti, Antonio a Re, Nazzareno a

a UNIVERSITY OF PERUGIA (Italy)

Author keywords

[No Author keywords available]

Indexed keywords

AROMATIC HYDROCARBONS; ATOMS; CALCULATIONS; CARRIER CONCENTRATION; CHEMICAL BONDS; COMPUTER SIMULATION; ELECTRON ENERGY LEVELS; ELECTRONIC STRUCTURE; FULLERENES; MATHEMATICAL MODELS; MOLECULAR STRUCTURE; PROBABILITY DENSITY FUNCTION;

BOND DISSOCIATION ENERGY; CHATT-DEWAR-DUNCANSON MODEL; POLYNUCLEAR AROMATIC HYDROCARBON; PYRACYLENE;

MOLECULAR DYNAMICS;

EID: 0036007792 PISSN: 1470479X EISSN: None Source Type: Journal
DOI: 10.1039/b101145f Document Type: Article

Times cited : (10)

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