平面外无序石墨烯中的电子传输

IF 9.1 2区 材料科学 Q1 MATERIALS SCIENCE, MULTIDISCIPLINARY npj 2D Materials and Applications Pub Date : 2024-01-05 DOI:10.1038/s41699-023-00437-6
Yifei Guan, Oleg V. Yazyev
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引用次数: 0

摘要

现实世界中的石墨烯样品在生长和转移过程中往往会出现各种类型的面外无序现象--波纹、皱褶和折叠。这些复杂的平面外缺陷是石墨烯自粘性和弯曲刚度相互作用的结果,不可避免地会导致电荷载流子散射,从而影响石墨烯的电子传输特性。我们采用紧密结合和密度泛函计算方法,在充分考虑晶格弛豫效应的同时,研究了电荷载流子在面外缺陷模型中的弹道传输问题。在同相位石墨烯皱纹中观察到的传输振荡归因于层内和层间传输通道之间的干扰,而非同相位皱纹则显示出消失的反向散射,并保留了平面石墨烯的传输特性。反向散射的抑制揭示了晶格对称在电子传输中的关键作用。我们的研究结果为控制石墨烯在这种无序状态下的传输特性提供了指导。
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Electronic transport in graphene with out-of-plane disorder
Real-world samples of graphene often exhibit various types of out-of-plane disorder–ripples, wrinkles and folds–introduced at the stage of growth and transfer processes. These complex out-of-plane defects resulting from the interplay between self-adhesion of graphene and its bending rigidity inevitably lead to the scattering of charge carriers thus affecting the electronic transport properties of graphene. We address the ballistic charge-carrier transmission across the models of out-of-plane defects using tight-binding and density functional calculations while fully taking into account lattice relaxation effects. The observed transmission oscillations in commensurate graphene wrinkles are attributed to the interference between intra- and interlayer transport channels, while the incommensurate wrinkles show vanishing backscattering and retain the transport properties of flat graphene. The suppression of backscattering reveals the crucial role of lattice commensuration in the electronic transmission. Our results provide guidelines to controlling the transport properties of graphene in presence of this ubiquitous type of disorder.
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来源期刊
npj 2D Materials and Applications
npj 2D Materials and Applications Engineering-Mechanics of Materials
CiteScore
14.50
自引率
2.10%
发文量
80
审稿时长
15 weeks
期刊介绍: npj 2D Materials and Applications publishes papers on the fundamental behavior, synthesis, properties and applications of existing and emerging 2D materials. By selecting papers with the potential for impact, the journal aims to facilitate the transfer of the research of 2D materials into wide-ranging applications.
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