Magnetic Signature in Graphene Using Adsorbed Metal–Organic Networks

The interaction of a 2D metal–organic network (MON) stacked on graphene has been studied with the help of first-principles density functional theory (DFT) and DFT + U calculations. By varying the length of a polyphenyl-dicarbonitrile linker, we have evaluated the influence of the metal–metal distanc...

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Veröffentlicht in:	Journal of physical chemistry. C 2024-01, Vol.128 (2), p.919-926
Hauptverfasser:	Rochefort, Alain, Anindya, Khalid N., Bouju, Xavier, Denawi, Adam H.
Format:	Artikel
Sprache:	eng
Schlagworte:	C: Physical Properties of Materials and Interfaces Physics
Online-Zugang:	Volltext
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