Dirac points with giant spin-orbit splitting in the electronic structure of two-dimensional transition-metal carbides

H. Fashandi, V. Ivády, P. Eklund, A. Lloyd Spetz, M. I. Katsnelson, and I. A. Abrikosov
Phys. Rev. B 92, 155142 – Published 26 October 2015
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Abstract

Two-dimensional (2D) materials, especially their most prominent member, graphene, have greatly influenced many scientific areas. Moreover, they have become a base for investigating the relativistic properties of condensed matter within the emerging field of “Dirac physics.” This has ignited an intense search for new materials where charge carriers behave as massless or massive Dirac fermions. Here, by the use of density functional theory and symmetry analysis, we theoretically show the existence of Dirac electrons in a series of 2D transition-metal carbides, known as MXenes. They possess eight conical crossings in the first Brillouin zone with giant spin-orbit splitting. Our findings indicate that the 2D band structure of MXenes is protected against external perturbations and preserved even in multilayer phases. These results, together with the broad possibilities to engineer the properties of these phases, make them a potential candidate for studying novel Dirac-physics-based applications.

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  • Received 17 June 2015
  • Revised 24 September 2015

DOI:https://doi.org/10.1103/PhysRevB.92.155142

©2015 American Physical Society

Authors & Affiliations

H. Fashandi1,*, V. Ivády1,2, P. Eklund1, A. Lloyd Spetz1, M. I. Katsnelson3,4, and I. A. Abrikosov1,5

  • 1Department of Physics, Chemistry, and Biology, Linköping University, SE-581 83 Linköping, Sweden
  • 2Wigner Research Centre for Physics, Hungarian Academy of Sciences, PO Box 49, H-1525, Budapest, Hungary
  • 3Radboud University, Institute for Molecules and Materials, Heyendaalseweg 135, 6525AJ Nijmegen, The Netherlands
  • 4Department of Theoretical Physics and Applied Mathematics, Ural Federal University, Mira strasse 19, Ekaterinburg, 620002, Russia
  • 5Materials Modeling and Development Laboratory, National University of Science and Technology MISIS, 119049 Moscow, Russia

  • *E-mail: hosfa@ifm.liu.se

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Issue

Vol. 92, Iss. 15 — 15 October 2015

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