DFT Study on the Hydrogenation of CO2 to Methanol on Ho-Doped Cu(211) Surface

The catalytic conversion of carbon dioxide (CO2) into methanol, a valuable chemical product, has been investigated theoretically on a novel holmium (Ho)-doped Cu(211) surface by density functional theory (DFT) calculations. The possible key intermediates formed during the hydrogenation of CO2 and as...

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Veröffentlicht in:	Journal of physical chemistry. C 2020-10, Vol.124 (41), p.22426-22434
Hauptverfasser:	Tezsevin, Ilker, Senkan, Selim, Onal, Isik, Düzenli, Derya
Format:	Artikel
Sprache:	eng
Schlagworte:	C: Surfaces, Interfaces, Porous Materials, and Catalysis
Online-Zugang:	Volltext
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