Physics – Condensed Matter – Strongly Correlated Electrons
Scientific paper
2010-12-29
Physics
Condensed Matter
Strongly Correlated Electrons
additional data and figs
Scientific paper
10.1103/PhysRevB.85.115128
Based on dynamical mean-field theory with a continuous-time quantum Monte-Carlo impurity solver, static as well as dynamic spin and charge susceptibilites for the phase diagram of the sodium cobaltate system Na$_x$CoO$_2$ are discussed. The approach includes important vertex contributions to the q-dependent two-particle response functions by means of a local approximation to the irreducible vertex function in the particle-hole channel. A single-band Hubbard model suffices to reveal several charge- and spin-instability tendencies in accordance with experiment, including the stabilization of an effective kagome sublattice close to x=0.67, without invoking the doping-dependent Na-potential landscape. The in-plane antiferromagnetic-to-ferromagnetic crossover is additionally verified by means of the computed Korringa ratio. Moreover an intricate high-energy mode in the transverse spin susceptiblity is revealed, pointing towards a strong energy dependence of the effective intersite exchange.
Boehnke Lewin
Lechermann Frank
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