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Triple nodal points characterized by their nodal-line structure in all magnetic space groups

Patrick M. Lenggenhager, Xiaoxiong Liu, Titus Neupert, and Tomáš Bzdušek
Phys. Rev. B 106, 085128 – Published 18 August 2022

Abstract

We analyze triply degenerate nodal points [or triple points (TPs) for short] in energy bands of crystalline solids. Specifically, we focus on spinless band structures, i.e., when spin-orbit coupling is negligible, and consider TPs formed along high-symmetry lines in the momentum space by a crossing of three bands transforming according to a one-dimensional (1D) and a two-dimensional (2D) irreducible corepresentation (ICR) of the little cogroup. The result is a complete classification of such TPs in all magnetic space groups, including the nonsymmorphic ones, according to several characteristics of the nodal-line structure at and near the TP. We show that the classification of the presently studied TPs is exhausted by 13 magnetic point groups (MPGs) that can arise as the little cogroup of a high-symmetry line and which support both 1D and 2D spinless ICRs. For 10 of the identified MPGs, the TP characteristics are uniquely determined without further information; in contrast, for the 3 MPGs containing sixfold rotational symmetry, two types of TPs are possible, depending on the choice of the crossing ICRs. The classification result for each of the 13 MPGs is illustrated with first-principles calculations of a concrete material candidate.

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  • Received 22 February 2022
  • Accepted 27 July 2022

DOI:https://doi.org/10.1103/PhysRevB.106.085128

©2022 American Physical Society

Physics Subject Headings (PhySH)

Condensed Matter, Materials & Applied Physics

Authors & Affiliations

Patrick M. Lenggenhager1,2,3,*, Xiaoxiong Liu3,†, Titus Neupert3, and Tomáš Bzdušek1,3

  • 1Condensed Matter Theory Group, Paul Scherrer Institute, 5232 Villigen PSI, Switzerland
  • 2Institute for Theoretical Physics, ETH Zurich, 8093 Zurich, Switzerland
  • 3Department of Physics, University of Zurich, Winterthurerstrasse 190, 8057 Zurich, Switzerland

  • *Corresponding author: lenpatri@ethz.ch
  • Corresponding author: xxliu@physik.uzh.ch

See Also

Erratum: From triple-point materials to multiband nodal links [Phys. Rev. B 103, L121101 (2021)]

Patrick M. Lenggenhager, Xiaoxiong Liu, Stepan S. Tsirkin, Titus Neupert, and Tomáš Bzdušek
Phys. Rev. B 106, 079903 (2022)

Universal higher-order bulk-boundary correspondence of triple nodal points

Patrick M. Lenggenhager, Xiaoxiong Liu, Titus Neupert, and Tomáš Bzdušek
Phys. Rev. B 106, 085129 (2022)

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Vol. 106, Iss. 8 — 15 August 2022

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