Browsing by Author "Kunstmann, Jens"

Now showing 1 - 4 of 4

Citation - WoS: 17
Citation - Scopus: 18
Boron Doped Graphene Nanostructures
(Wiley-v C H verlag Gmbh, 2008) Ozdogan, Cem; Kunstmann, Jens; Fehske, Holger; Quandt, Alexander
We present results from an ab initio study of metallized semiconducting graphene nanostructures. Our model system consists of an alternating chain of quasi-planar B-7 clusters embedded into a semiconducting arm-chair nanoribbon. We observe the appearance of overlapping bands around the Fermi-level, with crystal momenta pointing into the direction of these boron chains. This observation could be a vantage point for the development of graphene nanodevices and integrated nanocircuits, based on existing technologies. (C) 2008 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim
Citation - WoS: 22
Citation - Scopus: 21
Functionalizing Graphene by Embedded Boron Clusters
(Iop Publishing Ltd, 2008) Ozdogan, Cem; Kunstmann, Jens; Fehske, Holger; Quandt, Alexander
We present a model system that might serve as a blueprint for the controlled layout of graphene based nanodevices. The systems consists of chains of B-7 clusters implanted in a graphene matrix, where the boron clusters are not directly connected. We show that the graphene matrix easily accepts these alternating B-7-C-6 chains and that the implanted boron components may dramatically modify the electronic properties of graphene based nanomaterials. This suggests a functionalization of graphene nanomaterials, where the semiconducting properties might be supplemented by parts of the graphene matrix itself, but the basic wiring will be provided by alternating chains of implanted boron clusters that connect these areas.
Citation - WoS: 8
Citation - Scopus: 8
Localization of Metallicity and Magnetic Properties of Graphene and of Graphene Nanoribbons Doped With Boron Clusters
(Taylor & Francis Ltd, 2014) Kunstmann, Jens; Quandt, Alexander; Ozdogan, Cem
As a possible way of modifying the intrinsic properties of graphene, we study the doping of graphene by embedded boron clusters with density functional theory. Cluster doping is technologically relevant as the cluster implantation technique can be readily applied to graphene. We find that B-7 clusters embedded into graphene and graphene nanoribbons are structurally stable and locally metallize the system. This is done both by the reduction of the Fermi energy and by the introduction of boron states near the Fermi level. A linear chain of boron clusters forms a metallic "wire" inside the graphene matrix. In a zigzag edge graphene nanoribbon, the cluster-related states tend to hybridize with the edge and bulk states. The magnetism in boron-doped graphene systems is generally very weak. The presence of boron clusters weakens the edge magnetism in zigzag edge graphene nanoribbon, rather than making the system appropriate for spintronics. Thus, the doping of graphene with the cluster implantation technique might be a viable technique to locally metallize graphene without destroying its attractive bulk properties.
Citation - WoS: 210
Citation - Scopus: 219
Stability of Edge States and Edge Magnetism in Graphene Nanoribbons
(Amer Physical Soc, 2011) Ozdogan, Cem; Quandt, Alexander; Fehske, Holger; Kunstmann, Jens
We critically discuss the stability of edge states and edge magnetism in zigzag edge graphene nanoribbons (ZGNRs). We point out that magnetic edge states might not exist in real systems and show that there are at least three very natural mechanisms-edge reconstruction, edge passivation, and edge closure-which dramatically reduce the effect of edge states in ZGNRs or even totally eliminate them. Even if systems with magnetic edge states could be made, the intrinsic magnetism would not be stable at room temperature. Charge doping and the presence of edge defects further destabilize the intrinsic magnetism of such systems.