Ferromagnetism and non-local correlations in the Hubbard model

We study the possibility and stability of band-ferromagnetism in the single-band Hubbard model for the simple cubic (SC) lattice. A non-local self-energy is derived within a modified perturbation theory. Results for the spectral density and quasiparticle density of states are shown with special attention to the effects of k-dependence. The importance of non-local correlations for the fulfillment of the Mermin-Wagner theorem is our main result. A phase digram showing regions of ferromagnetic order is calculated for the three dimensional lattice. Besides, we show results for the optical conductivity and prove that already the renormalized one-loop contribution to the conductivity cancels the Drude peak exactly in case of a local self-energy which is not anymore true for a non-local self-energy.Comment: 11 pages, 10 figures, accepted for publication in PR

Spin-filter effect of the europium chalcogenides: An exactly solved many-body model

A model Hamiltonian is introduced which considers the main features of the experimental spin filter situation as s-f interaction, planar geometry and the strong external electric field. The proposed many-body model can be solved analytically and exactly using Green functions. The spin polarization of the field-emitted electrons is expressed in terms of spin-flip probabilities, which on their part are put down to the exactly known dynamic quantities of the system. The calculated electron spin polarization shows remarkable dependencies on the electron velocity perpendicular to the emitting plane and the strength of s-f coupling. Experimentally observed polarization values of about 90% are well understood within the framework of the proposed model.Comment: accepted (Physical Review B); 10 pages, 11 figures; http://orion.physik.hu-berlin.de

Magnetic phase diagram of the Kondo lattice model with quantum localized spins

The magnetic phase diagram of the ferromagnetic Kondo lattice model is determined at T=0 in 1D, 2D, and 3D for various magnitudes of the quantum mechanical localized spins ranging from S=1/2 to classical spins. We consider the ferromagnetic phase, the paramagnetic phase, and the ferromagnetic/antiferromagnetic phase separated regime. There is no significant influence of the spin quantum number on the phase boundaries except for the case S=1/2, where the model exhibits an instability of the ferromagnetic phase with respect to spin disorder. Our results give support, at least as far as the low temperature magnetic properties are concerned, to the classical treatment of the S=3/2-spins in the intensively investigated manganites, for which the ferromagnetic Kondo-lattice model is generally employed to account for magnetism.Comment: 8 pages, 6 figure

Curie temperatures of the concentrated and diluted Kondo-lattice model as a possible candidate to describe magnetic semiconductors and metals

We present a theory to model carrier mediated ferromagnetism in concentrated or diluted local moment systems. The electronic subsystem of the Kondo lattice model is described by a combined equation of motion / coherent potential approximation method. Doing this we can calculate the free energy of the system and its minimum according to the magnetization of the local moments. Thus also the Curie temperature can be determined and its dependence on important model parameters. We get qualitative agreement with the Curie temperatures' experimental values of Ga$_{1-x}$Mn$_x$As for a proper hole density.Comment: 11 pages, 10 figures, refereed version of Physica Status Solidi b (http://dx.doi.org/10.1002/pssb.201147059

Metallic surface of a Mott insulator - Mott insulating surface of a metal

The dynamical mean-field theory (DMFT) is employed to study the Mott transition in the semi-infinite Hubbard model at half-filling and zero temperature. We consider the low-index surfaces of the three-dimensional simple-cubic lattice and systematically vary the model parameters at the very surface. Within the DMFT the problem is self-consistently mapped onto a set of coupled effective impurity models corresponding to the inequivalent layers parallel to the surface. Assuming that the influence of the Hubbard bands on the low-energy quasi-particle resonance can be neglected at the critical point, a simplified ``linearized DMFT'' becomes possible which is formally equivalent to the Weiss molecular-field theory for the semi-infinite Ising model. This implies that qualitatively the rich phenomenology of the Landau description of second-order phase transitions at surfaces has a direct analogue for the surface Mott transition. Motivated by this formal analogy, we work out the predictions of the linearized DMFT in detail. It is found that under certain circumstances the surface of a Mott insulator can be metallic while a Mott-insulating surface of a normal metal is not possible. The corresponding phase diagrams, the (mean-field) critical exponents and the critical profiles of the quasi-particle weight are derived. The results are confirmed by a fully numerical evaluation of the DMFT equations using the exact-diagonalization (ED) method.Comment: LaTeX, 35 pages, 19 eps figures included, submitted to Phys. Rev.

Temperature-dependent bandstructure of bulk EuO

We present calculations for the temperature-dependent electronic structure of bulk ferromagnetic EuO based on a parametrization of the d-f model Hamiltonian using results of first-principles TB-LMTO band structure calculations. The presented method avoids the problem of double-counting of relevant interactions and takes into account the symmetry of the atomic orbitals. It enables us to determine the temperature-dependent band structure of EuO over the entire temperature range.Comment: 14 pages, 4 eps figures, Solid State Commun. (in press