Electrical Characteristics of Cobalt Phthalocyanine Complexes Adsorbed on Graphene

We investigate, at a density functional level, the electric characteristics of 18 complexes of cobalt phthalocyanine (CoPc) and cobalt tetraaminephthalocyanine (CoTAPc) adsorbed on graphene functionalized with CO2 – or CO moieties. Three models of graphene molecules are used, pristine, defect, and v...

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Veröffentlicht in:	Journal of physical chemistry. C 2011-08, Vol.115 (32), p.16052-16062
Hauptverfasser:	Cárdenas-Jirón, Gloria I, Leon-Plata, Paola, Cortes-Arriagada, Diego, Seminario, Jorge M
Format:	Artikel
Sprache:	eng
Schlagworte:	C: Surfaces, Interfaces, Catalysis
Online-Zugang:	Volltext
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