English

The electronic structure of {\em R}NiC$_2$ intermetallic compounds

Strongly Correlated Electrons 2015-05-13 v2

Abstract

First-principles calculations of the electronic structure of members of the RRNiC2_2 series are presented, and their Fermi surfaces investigated for nesting propensities which might be linked to the charge-density waves exhibited by certain members of the series (RR = Sm, Gd and Nd). Calculations of the generalized susceptibility, χ0(q,ω)\chi_{0}({\bf q},\omega), show strong peaks at the same q{\bf q}-vector in both the real and imaginary parts for these compounds. Moreover, this peak occurs at a wavevector which is very close to that experimentally observed in SmNiC2_2. In contrast, for LaNiC2_2 (which is a superconductor below 2.7K) as well as for ferromagnetic SmNiC2_2, there is no such sharp peak. This could explain the absence of a charge-density wave transition in the former, and the destruction of the charge-density wave that has been observed to accompany the onset of ferromagnetic order in the latter.

Keywords

Cite

@article{arxiv.0903.1814,
  title  = {The electronic structure of {\em R}NiC$_2$ intermetallic compounds},
  author = {J. Laverock and T. D. Haynes and C. Utfeld and S. B. Dugdale},
  journal= {arXiv preprint arXiv:0903.1814},
  year   = {2015}
}

Comments

5 pages, 7 figures. Accepted for publication in Phys. Rev. B

R2 v1 2026-06-21T12:20:24.476Z