1. Multifold degenerated phonon points in the cubic Nb3Bi compound.
- Author
-
MSL, Manasa, T., Aiswarya, Ptok, Andrzej, and Vaitheeswaran, G.
- Subjects
- *
PHONON dispersion relations , *BRILLOUIN zones , *ROTATIONAL symmetry , *INTERMETALLIC compounds , *CRYSTAL structure - Abstract
Topological materials are receiving significant attention for their distinctive properties and practical applications. Topological states featuring multi-fold band degeneracy are not restricted to electronic systems but also extend to phonon systems. In this investigation, we delved into the higher-order symmetry-constrained topological attributes of Nb 3 Bi, an intermetallic compound with a A15 crystal structure. Through the first-principles computations and symmetry evaluation, we tried to describe the topological phonon modes safeguarded by nonsymmorphic symmetries. Our scrutiny revealed that Nb 3 Bi possesses notable degeneracy in the phonon dispersion relation, particularly highlighted by a sixfold degenerate point situated at the R point of the Brillouin zone. In addition, we also identified cubic contact Dirac points and quadratic contact triple points at the R and Γ points, respectively. The computed phonon surface states considering two distinct terminations on the (001) and (1 1 ¯ 0) planes reveal a distinct twofold rotational symmetry arrangement. The present results offer valuable insights into the distinctive phonon attributes and surface characteristics of Nb 3 Bi, emphasizing its importance in the field of phonon topology. [ABSTRACT FROM AUTHOR]
- Published
- 2024
- Full Text
- View/download PDF