Electronic structure and quantum critical behavior of NbFe$_{2}$

POSTER

Abstract

The C14 hexagonal Laves phase compound NbFe2 sits on the edge of a magnetic instability. By varying the composition, Nb$_{1-y}$Fe$_{2+y}$ encompasses two ferromagnetic states, a spin density wave state, and a quantum critical point (y = -0.04). Density functional calculations, using the generalized gradient approximation, found the electronic structure. An analysis of electronic structure calculations will be presented, illuminating the magnetic behavior and susceptibility at low temperature.

Authors

  • Brian Neal

    University of California, Davis

  • Warren Pickett

    University of California, Davis