Density functional study on the interaction of Graphene-supported Nickel cluster with CO2 molecule

We try to use small size Ni cluster supported on graphitic material as an alternative for CO 2 hydrogenation catalyst. As an initial step, we study the ability of the supported Ni 4 cluster to interact with CO 2 molecule by means of density functional theory-based calculations. We find that strong C...

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Veröffentlicht in:	Journal of physics. Conference series 2021-06, Vol.1949 (1)
Hauptverfasser:	Pradana, M R, Maulana, A L, Prasetyo, Y, Saputro, A G, Agusta, M K, Ginting, L Y, Dipojono, H K
Format:	Artikel
Sprache:	eng
Schlagworte:	Adsorption Carbon dioxide Chemisorption Clusters Density functional theory Graphene Nickel
Online-Zugang:	Volltext
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