石墨烯
材料科学
插层(化学)
凝聚态物理
密度泛函理论
电子能带结构
光电发射光谱学
X射线光电子能谱
纳米技术
核磁共振
化学
无机化学
计算化学
物理
作者
D. Pacilè,Cláudia Cardoso,Giulia Avvisati,I. Vobornik,Carlo Mariani,Dario A. Leon,Pietro Bonfá,Daniele Varsano,Andrea Ferretti,Maria Grazia Betti
摘要
We report on the electronic properties of an artificial system obtained by the intercalation of equiatomic FeCo layers under graphene grown on Ir(111). Upon intercalation, the FeCo film grows epitaxially on Ir(111), resulting in a lattice-mismatched system. By performing density functional theory calculations, we show that the intercalated FeCo layer leads to a pronounced corrugation of the graphene film. At the same time, the FeCo intercalated layers induce a clear transition from a nearly undisturbed to a strongly hybridized graphene π-band, as measured by angle-resolved photoemission spectroscopy. A comparison of experimental results with the computed band structure and the projected density of states unveils a spin-selective hybridization between the π band of graphene and FeCo-3d states. Our results demonstrate that the reduced dimensionality, as well as the hybridization within the FeCo layers, induces a narrowing and a clear splitting of Fe 3d-up and Fe 3d-down-spin bands of the confined FeCo layers with respect to bulk Fe and Co.
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