Adsorption of C2H2 and C2H4 on Pt-decorated graphene nanostructure: Ab-initio study

Volume: 211, Pages: 115 - 120
Published: Jan 1, 2016
Abstract
null null Adsorption properties of C 2 H 2 null and C 2 H 4 null gas molecules on Pt-decorated graphene (PtG) have been examined using first-principles density functional theory (DFT) calculations. A particular interesting aspect of PtG is that the Pt atom influences the electronic structure of graphene through coulombic charge-transferring. Upon adsorption of C 2 H 2 null and C 2 H 4 null on PtG, the C–C axis remains essentially parallel to the...
Paper Details
Title
Adsorption of C2H2 and C2H4 on Pt-decorated graphene nanostructure: Ab-initio study
Published Date
Jan 1, 2016
Volume
211
Pages
115 - 120
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