Soft and chiral phonons in chiral phase of K3NiO2

Abstract

Raman scattering measurements confirmed the theoretical prediction that the structural phase transition from the achiral tetragonal to the chiral tetragonal phase, which occurs near 400 K, is induced by a doubly degenerate soft phonon at the Z point of the Brillouin zone. In the low-temperature chiral phase, the soft mode activates in Raman spectra, splits into two components with A1 and B1 symmetries and harden with cooling according to Cochran law. Circularly polarized Raman scattering did not reveal the angular momentum of these singly degenerate phonons at the Gamma point, which is consistent with theory. We also calculated the phonon branches in the whole Brillouin zone for both crystalline phases and compared the results with the phonons observable in the Raman spectra. The calculations revealed that some phonons with nonzero k have angular momentum in the chiral phase. A pronounced circular motion of atoms can be observed, for example, in a Dirac-type topological phonon at the M-point of the Brillouin zone with a frequency of 168 cm-1.