English

Origin of large thermopower in LiRh$_2$O$_4$

Strongly Correlated Electrons 2008-10-01 v2 Materials Science

Abstract

Motivated by the newly synthesized mixed-valent spinel LiRh2_2O4_4 for which a large thermopower is observed in the metallic cubic phase above 230K [Okamoto {\it et al.} (arXiv:0806.2504)], we calculate the Seebeck coefficient by the combination of local density approximation and dynamical mean field theory (LDA+DMFT). The experimental values are well reproduced not only by LDA+DMFT but also by the less involved Boltzmann equation approach. A careful analysis of the latter shows unexpectedly that the origin of the large thermopower shares a common root with a very different oxide: Nax_xCoO2_2. We also discuss how it is possible to further increase the powerfactor of LiRh2_2O4_4 through doping, which makes the material even more promoising for technological applications.

Keywords

Cite

@article{arxiv.0806.2506,
  title  = {Origin of large thermopower in LiRh$_2$O$_4$},
  author = {R. Arita and K. Kuroki and K. Held and A. V. Lukoyanov and S. Skornyakov and V. I. Anisimov},
  journal= {arXiv preprint arXiv:0806.2506},
  year   = {2008}
}

Comments

5 pages, 5 figures