Abstract

Degenerate points/lines in the band structures of crystals have become a staple of the growing number of topological materials. The bulk-boundary correspondence provides a relation between bulk topology and surface states. While line degeneracies of bulk excitations have been extensively characterised, line degeneracies of surface states are not well understood. We show that SnIP, a quasi-one-dimensional van der Waals material with a double helix crystal structure, exhibits topological nodal rings/lines in both the bulk phonon modes and their corresponding surface states. Using a combination of first-principles calculations, symmetry-based indicator theories and Zak phase analysis, we find that two neighbouring bulk nodal rings form doubly degenerate lines in their drumhead-like surface states, which are protected by the combination of time-reversal symmetry {{{mathcal{T}}}} and glide mirror symmetry {bar{M}}_{y}. Our results indicate that surface degeneracies can be generically protected by symmetries such as {{{mathcal{T}}}}{bar{M}}_{y}, and phonons provide an ideal platform to explore such degeneracies.

Highlights

  • Degeneracies in the bulk energy bands of crystals were intensively studied in the early days of band theory[1]

  • When the band crossings are one-dimensional in momentum space, they can form nodal lines, nodal rings or nodal chains, depending on their shape[23,24,25,26,27,28,29,30,31], and these line crossings are protected by symmetries such as mirror or PT32,33

  • Our results suggest that similar surface degenerate lines/points will be found in other materials when there are extra symmetries to protect these surface degeneracies, and we believe that phonons can be a primary platform to study these degeneracies because of the presence of time-reversal symmetry and the flexibility to study the degeneracies in the entire phonon spectrum

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Summary

Introduction

Degeneracies in the bulk energy bands of crystals were intensively studied in the early days of band theory[1]. When the band crossings are one-dimensional in momentum space, they can form nodal lines, nodal rings or nodal chains, depending on their shape[23,24,25,26,27,28,29,30,31], and these line crossings are protected by symmetries such as mirror or PT (where P is the spatial inversion symmetry and T is the time-reversal symmetry)[32,33] Recent advances, using both group-theoretical analysis and high-throughput calculations, have enabled a comprehensive understanding of bulk band degeneracies in both electrons[34,35,36] and phonons[22]. These topological degeneracies exhibit unique physical properties such as a ‘quantum anomaly’[37,38], enabling various applications from spintronics[39] to topological quantum computation[40]

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