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Hybrid nodal chain in an orthorhombic graphene network

Kun Bu1,2,*, Yuting Qian1,2,*, Jian-Tao Wang1,2,3,†, and Hongming Weng1,2,3,4

  • 1Beijing National Laboratory for Condensed Matter Physics, Institute of Physics, Chinese Academy of Sciences, Beijing 100190, China
  • 2School of Physical Sciences, University of Chinese Academy of Sciences, Beijing 100049, China
  • 3Songshan Lake Materials Laboratory, Dongguan, Guangdong 523808, China
  • 4CAS Center for Excellence in Topological Quantum Computation, University of Chinese Academy of Sciences, Beijing 100190, China

  • *These authors contributed equally to this work.
  • †wjt@aphy.iphy.ac.cn

Phys. Rev. B 103, L081108 – Published 17 February, 2021

DOI: https://doi.org/10.1103/PhysRevB.103.L081108

Abstract

A topological nodal line (NL) semimetal is a kind of special three-dimensional semimetal state with only nodal lines around the Fermi level. It has been revealed that there are basically two types of NLs when spin-orbit coupling is not considered for electronic system: One is dubbed s-NLs, protected by a combinational symmetry S of spatial inversion (P) and time reversal (T), i.e., S=PT; the other one is m-NLs, protected by mirror (M) or glide symmetry, constraining the NL inside certain symmetrical planes. However, a hybrid nodal chain (HNC), composed of linked s-NLs and m-NLs from the same two crossing bands, has not been well studied so far. Here, we identify by ab initio calculations a new all-sp2 hybridized carbon allotrope as a good candidate, which has a unit cell of 24 carbon atoms with Pnna (D2h6) symmetry and is termed oP−C24 carbon. The HNC hosted by oP−C24 can be simply described by a two-band k·p model, distinguished from the three-band model proposed for another HNC candidate in the TiRhAs family. This kind of HNC is proposed in a real material here and paves the way for further theoretical and experimental investigations.

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