LDA+DMFT study for LiV2O4 at T=0

Arita Ryotaro

RIKEN, Condensed Matter Theory Laboratory, Wako, Saitama, Japan

By means of the LDA+DMFT method, we investigate the electronic structure of LiV2O4, for which various heavy-fermion-like behaviors have been observed experimentally. To obtain the spectral function at T->0, we employ the projective quantum Monte Carlo method as the solver of the effective impurity problem in DMFT. We show that a sharp peak appears just above the Fermi level at T=0, which is consistent with the recent photoemission experiment by Shimoyamada et al.

[Phys. Rev. Lett. 96 026403 (2006)]

Back