S. Capponi et Ff. Assaad, Spin and charge dynamics of the ferromagnetic and antiferromagnetic two-dimensional half-filled Kondo lattice model - art. no. 155114, PHYS REV B, 6315(15), 2001, pp. 5114
We present a detailed numerical study of ground state and finite temperatur
e spin and charge dynamics of the two-dimensional Kondo lattice model with
hopping t and exchange J. Our numerical results stem from auxiliary field q
uantum Monte Carlo simulations formulated in such a way that the sign probl
em is absent at half-band filling thus allowing us to reach lattice sizes u
p to 12 x 12. At T = 0 and antiferromagnetic couplings J>0 the competition
between the Ruderman-Kittel-Kasuya-Yosida interaction and the Kondo effect
triggers a quantum phase transition between antiferromagnetically ordered a
nd magnetically disordered insulators: J(c)/t = 1.45+/-0.05. At J<0 the sys
tem remains an antiferromagnetically ordered insulator and irrespective of
the sign of J, the quasiparticle gap scales as \J\. The dynamical spin stru
cture factor S(<(q)over right arrow>, omega) evolves smoothly from its stro
ng-coupling form with spin gap at (q) over right arrow = (pi, pi) to a spin
-wave form. For J>0, the single-particle spectral function A((k) over right
arrow, omega) shows a dispersion relation following that of hybridized ban
ds as obtained in the noninteracting periodic Anderson model. In the ordere
d phase this feature is supplemented by shadows, thus allowing an interpret
ation in terms of the coexistence of Kondo screening and magnetic ordering.
In contrast, at J<0 the single-particle dispersion relation follows that o
f noninteracting electrons in a staggered external magnetic field. At finit
e temperatures spin T-S and charge T-C scales are defined by locating the m
aximum in the charge and spin uniform susceptibilities. For weak to interme
diate couplings, T-S marks the onset of antiferromagnetic fluctuations-as o
bserved by a growth of the staggered spin susceptibility-and follows a J(2)
law. At strong couplings T-S scales as J. On the other hand T-C scales as
J both in the weak- and strong-coupling regime. At and slightly below T-C w
e observe (i) the onset of screening of the magnetic impurities, (ii) a ris
e in the resistivity as a function of decreasing temperature, (iii) a dip i
n the integrated density of states at the Fermi energy, and finally (iv) th
e occurrence of hybridized bands in A(<(k)over right arrow>, omega). It is
shown that in the weak-coupling limit, the charge gap of order J is formed
only at T-S and is hence of magnetic origin. The specific heat shows a two-
peak structure. The low-temperature peak follows T-S and is hence of magnet
ic origin. Our results are compared to various mean-field theories.