English

Thermoelectric effect in kagome lattice enhanced at van Hove singularities

Materials Science 2023-11-14 v3

Abstract

We have performed first-principles calculations using density functional theory on a kagome lattice model with a chiral spin state, as a representative example demonstrating significant longitudinal and transverse thermoelectric properties. The results revealed that the saddle-point-type van Hove singularity (VHS) enhances thermoelectric effects. The longitudinal thermoelectric conductivity αxx\alpha_{xx} was large at the chemical potentials tuned close to the band at the symmetry points, K (lower band edge), Γ\Gamma (upper band edge), and M (saddle point), where the VHSs of the density of states (DOS) were at the corresponding band energies. The transverse thermoelectric conductivity αxy\alpha_{xy} was large at the chemical potential of saddle-point-type VHS. A large anomalous Nernst coefficient of about 10 μ\muV/K at 50 K was expected.

Keywords

Cite

@article{arxiv.2309.11728,
  title  = {Thermoelectric effect in kagome lattice enhanced at van Hove singularities},
  author = {Kaiki Shibata and Naoya Yamaguchi and Hikaru Sawahata and Fumiyuki Ishii},
  journal= {arXiv preprint arXiv:2309.11728},
  year   = {2023}
}