期刊
ACS NANO
卷 6, 期 6, 页码 4823-4834出版社
AMER CHEMICAL SOC
DOI: 10.1021/nn301505x
关键词
MoS2; nanoribbons; two-dimensional nanostructures; magnetism; electric field effect; spin crossover
类别
资金
- Science Foundation of Ireland [07/IN.1/1945]
Ab initio density functional theory calculations are performed to investigate the electronic structure of MoS2 armchair nanoribbons in the presence of an external static electric field. Such nanoribbons, which are nonmagnetic and semiconducting, exhibit a set of weakly interacting edge states whose energy position determines the band gap of the system. We show that, by applying an external transverse electric field, E-ext, the nanoribbon band gap can be significantly reduced, leading to a metal-insulator transition beyond a certain critical value. Moreover, the presence of a sufficiently high density of states at the Fermi level in the vicinity of the metal-insulator transition leads to the onset of Stoner ferromagnetism that can be modulated, and even extinguished, by E-ext. In the case of bilayer nanoribbons we further show that the band gap can be changed from indirect to direct by applying a transverse field, an effect that might be of significance for opto-electronics applications.
作者
我是这篇论文的作者
点击您的名字以认领此论文并将其添加到您的个人资料中。
推荐
暂无数据