Mechanism of orbital reconstruction at the interfaces of transition metal oxides

Orbital reconstruction at interfaces between YBa2Cu3O6 and SrO-terminated SrTiO3 is studied using local spin density approximation (LSDA) with intra-atomic Coulomb repulsion (LSDA+U). The change of population of interfacial Cu 3d orbitals results in stabilization of a new oxidation state $3d^8$ which involves an additional modification of orbital occupancies in the nearest SrO and TiO2 layers. We find that an increase of electron charge in Cu 3d_{x^2-y^2} states counterbalances a depopulation of 3d_{3z^2-r^2} orbitals which induces, on account of the onsite Coulomb repulsion U, a splitting of 3d_{3z^2-r^2} states at CuO2-SrO interfaces.Comment: 7 pages, 7 figures, to appear in Physical Review

Jet-induced gauge field instabilities in the quark-gluon plasma: A kinetic theory approach

We discuss the properties of the collective modes of a system composed by a thermalized quark-gluon plasma traversed by a relativistic jet of partons. The transport equations obeyed by the components of the plasma and of the jet are studied in the Vlasov approximation. Assuming that the partons in the jet can be described with a tsunami-like distribution function we derive the expressions of the dispersion law of the collective modes. Then the behavior of the unstable gauge modes of the system is analyzed for various values of the velocity of the jet, of the momentum of the collective modes and of the angle between these two quantities. We find that the most unstable modes are those with momentum orthogonal to the velocity of the jet and that these instabilities appear when the velocity of the jet is higher than a threshold value, which depends on the plasma and jet frequencies. The results obtained within the Vlasov approximation are compared with the corresponding results obtained using a chromohydrodynamical approach.The effect we discuss here suggests a possible collective mechanism for the description of the jet quenching phenomena in heavy ion collisions.Comment: 13 pages, 6 figure

Interface hole-doping in cuprate-titanate superlattices

The electronic structure of interfaces between YBa$_2$Cu$_3$O$_6$ and SrTiO$_3$ is studied using local spin density approximation (LSDA) with intra-atomic Coulomb repulsion (LSDA+U). We find a metallic state in cuprate/titanate heterostructures with the hole carriers concentrated substantially in the CuO$_2$-layers and in the first interface TiO$_2$ and SrO planes. This effective interface doping appears due to the polarity of interfaces, caused by the first incomplete copper oxide unit cell. Interface-induced high pre-doping of CuO$_2$-layers is a key mechanism controlling the superconducting properties in engineered field-effect devices realized on the basis of cuprate/titanate superlattices.Comment: 5 pages, 5 figure

Oxygen vacancies at titanate interfaces: two-dimensional magnetism and orbital reconstruction

We show that oxygen vacancies at titanate interfaces induce a complex multiorbital reconstruction which involves a lowering of the local symmetry and an inversion of t2g and eg orbitals resulting in the occupation of the eg orbitals of Ti atoms neighboring the O vacancy. The orbital reconstruction depends strongly on the clustering of O vacancies and can be accompanied by a magnetic splitting between the local eg orbitals with lobes directed towards the vacancy and interface dxy orbitals. The reconstruction generates a two-dimensional interface magnetic state not observed in bulk SrTiO3. Using generalized gradient approximation (LSDA) with intra-atomic Coulomb repulsion (GGA+U), we find that this magnetic state is common for titanate surfaces and interfaces.Comment: 13 pages, 18 figures, to appear in Physical Review

Magnetism and superconductivity at LAO/STO-interfaces: the role of Ti 3d interface electrons

Ferromagnetism and superconductivity are in most cases adverse. However, recent experiments reveal that they coexist at interfaces of LaAlO3 and SrTiO3. We analyze the magnetic state within density functional theory and provide evidence that magnetism is not an intrinsic property of the two-dimensional electron liquid at the interface. We demonstrate that the robust ferromagnetic state is induced by the oxygen vacancies in SrTiO3- or in the LaAlO3-layer. This allows for the notion that areas with increased density of oxygen vacancies produce ferromagnetic puddles and account for the previous observation of a superparamagnetic behavior in the superconducting state.Comment: 5 pages, 4 figures, to appear in Physical Review B (Rapid Communications

Electronic charge and orbital reconstruction at cuprate-titanate interfaces

In complex transition metal oxide heterostructures of physically dissimilar perovskite compounds, interface phenomena can lead to novel physical properties not observed in either of their constituents. This remarkable feature opens new prospects for technological applications in oxide electronic devices based on nm-thin oxide films. Here we report on a significant electronic charge and orbital reconstruction at interfaces between YBa2Cu3O6 and SrTiO3 studied using local spin density approximation (LSDA) with intra-atomic Coulomb repulsion (LSDA+U). We show that the interface polarity results in the metallicity of cuprate-titanate superlattices with the hole carriers concentrated predominantly in the CuO2 and BaO layers and in the first interface TiO2 and SrO planes. We also find that the interface structural relaxation causes a strong change of orbital occupation of Cu 3d orbitals in the CuO2 layers. The concomitant change of Cu valency from +2 to +3 is related to the partial occupation of the Cu $3d_{3z^2-r^2}$ orbitals at the interface with SrO planes terminating SrTiO3. Interface-induced predoping and orbital reconstruction in CuO2 layers are key mechanisms which control the superconducting properties of field-effect devices developed on the basis of cuprate-titanate heterostructures.Comment: 11 pages, 8 figures, to appear in the "Proceedings of Third Joint HLRB and KONWIHR Result and Reviewing Workshop", Springer 200

Self-consistent model of electron drift mode turbulence

The nonlinear dynamics of magnetic electron drift mode turbulence are outlined and the generation of large-scale magnetic structures in a non-uniform magnetized plasma by turbulent Reynolds stress is demonstrated. The loop-back of large-scale flows on the microturbulence is elucidated and the modulation of the electron drift mode turbulence spectrum in a medium with slowly varying parameters is presented. The wave kinetic equation in the presence of large-scale flows is derived and it can be seen that the small-scale turbulence and the large-scale structures form a self-regulating system. Finally, it is shown by the use of quasilinear theory that the shearing of microturbulence by the flows can be described by a diffusion equation in k-space and the corresponding diffusion coefficients are calculate

Holstein polaron in the presence of disorder

Non-local, inhomogeneous and retarded response observed in experiments is reproduced by introducing the Inhomogeneous Momentum Average (IMA) method to study single polaron problems with disorder in the on-site potential and/or spatial variations of the electron-phonon couplings and/or phonon frequencies. We show that the electron-phonon coupling gives rise to an additional inhomogeneous, strongly retarded potential, which makes instant approximations questionable. The accuracy of IMA is demonstrated by comparison with results from the approximation free Diagrammatic Monte Carlo (DMC) method. Its simplicity allows for easy study of many problems that were previously unaccessible. As an example, we show how inhomogeneities in the electron-phonon coupling lead to nonlocal, retarded response in scanning tunneling microscopy (STM) images.Comment: 4 pages, 3 figure