• 文献标题:   Electronic Properties of alpha-RuCl3 in Proximity to Graphene
  • 文献类型:   Article
  • 作  者:   BISWAS S, LI Y, WINTER SM, KNOLLE J, VALENTI R
  • 作者关键词:  
  • 出版物名称:   PHYSICAL REVIEW LETTERS
  • ISSN:   0031-9007 EI 1079-7114
  • 通讯作者地址:   Goethe Univ Frankfurt
  • 被引频次:   8
  • DOI:   10.1103/PhysRevLett.123.237201
  • 出版年:   2019

▎ 摘  要

In the pursuit of developing routes to enhance magnetic Kitaev interactions in alpha-RuCl3, as well as probing doping effects, we investigate the electronic properties of alpha-RuCl3 in proximity to graphene. We study alpha-RuCl3/graphene heterostructures via ab initio density functional theory calculations, Wannier projection, and nonperturbative exact diagonalization methods. We show that alpha-RuCl3 becomes strained when placed on graphene and charge transfer occurs between the two layers, making alpha-RuCl3 (graphene) lightly electron doped (hole doped). This gives rise to an insulator-to-metal transition in alpha-RuCl3 with the Fermi energy located close to the bottom of the upper Hubbard band of the t(2g) manifold. These results suggest the possibility of realizing metallic and even exotic superconducting states. Moreover, we show that in the strained alpha-RuCl3 monolayer the Kitaev interactions are enhanced by more than 50% compared to the unstrained bulk structure. Finally, we discuss scenarios related to transport experiments in alpha-RuCl3/graphene heterostructures.