Related papers: Theory of Manganite Superlattice
A comprehensive theoretical model for the bulk manganite system La$_{1-x}$(Ca,Sr)$_x$MnO$_3$ is presented. The model includes local and cooperative Jahn-Teller distortions and the on-site Coulomb and exchange interaction. The model is is…
Heterostructures of mixed-valence manganites are still under intense scrutiny, due to the occurrence of exotic quantum phenomena linked to electronic correlation and interfacial composition. For instance, if two anti-ferromagnetic…
Using first-principles techniques, we study the structural, magnetic and electronic properties of (111)-oriented (LaMnO$_3$)$_{2n}$$\vert$(SrMnO$_3$)$_{n}$ superlattices of varying thickness ($n=2,4,6$). We find that the properties of the…
The electronic properties of many transition metal oxide systems require new ideas concerning the behaviour of electrons in solids for their explanation. A recent example, subsequent to that of cuprate superconductors, is of rare earth…
We investigate the stability of the charge exchange (CE) phase within a microscopic model which describes a single plane as in La$_{0.5}$Sr$_{1.5}$MnO$_4$. The model includes Coulomb interactions (on-site and intersite), the Jahn-Teller…
The phase diagram of half-doped manganite systems of formula A_{0.5}A'_{0.5}MnO_3 is investigated within a single-orbital model incorporating magnetic double-exchange and superexchange, together with intersite Coulomb and electron-lattice…
(Pr,Ca)MnO3 is the archetypal charge-ordered manganite, but in Pr0.48Ca0.52MnO3 we find (using convergent-beam electron diffraction and dark-field images) that the superlattice period is locally incommensurate with respect to the parent…
Jahn-Teller (JT) effect both in the absence and presence of the strong Coulomb correlation is studied theoretically focusing on the reduction $\Delta K$ of the kinetic energy gain which is directly related to the spin wave stiffness.…
A correlated inhomogeneous mean-field approach is proposed in order to study a tight-binding model of the manganite heterostructures (LaMnO3)2n/(SrMnO3)n with average hole doping x = 1/3. Phase diagrams, spectral and optical properties of…
The role of elastic interactions between Jahn-Teller ions in formation of various orbital- and charge-ordered structures in manganites and related compounds is analyzed. It is shown that such interactions alone are often sufficient to…
Studying the nature and consequences of electron-phonon interaction in manganites is an area of intense ongoing research. Here, in an attempt to model charge and orbital ordering in manganites displaying C-type antiferromaganetism, we study…
A model for $La_{1-x}Sr_xMnO_3$ which incorporates the physics of dynamic Jahn-Teller and double-exchange effects is presented and solved via a dynamical mean field approximation. In an intermediate coupling regime the interplay of these…
We study the magnetic structure of the (LaMnO$_3$)$_{2n}$/(SrMnO$_3$)$_n$ superlattices from density-functional calculations. In agreement with the experiments, we find that the magnetism changes with the layer thickness `n'. The reason for…
We have recently argued that manganites do not possess stripes of charge order, implying that the electron-lattice coupling is weak [Phys Rev Lett \textbf{94} (2005) 097202]. Here we independently argue the same conclusion based on…
The magnetic structure of LaMnO$_3$ is investigated on three-dimensional clusters of MnO$_6$ octahedra by using a combination of relaxation and Monte Carlo techniques. It is found that the cooperative Jahn-Teller phonons lead to the…
The interlayer exchange coupling mediated by the valence band electrons in $\textrm{(MnTe)}_{\textrm{m}} \textrm{(ZnTe)}_{\textrm{n}}$ superlattices has been examined theoretically. The calculations have been performed within the framework…
A tight-binding model for eg electrons coupled to Jahn-Teller lattice distortions is studied via unbiased Monte- Carlo simulations. By focusing on the periodicity of the Jahn Teller distortions, and the one-particle spectral function, our…
Motivated by recent experiments, we use the $+U$ extension of the generalized gradient approximation to density functional theory to study superlattices composed of alternating layers of LaNiO$_3$ and LaMnO$_3$. For comparison we also study…
At interfaces between oxide materials, lattice and electronic reconstructions always play important roles in exotic phenomena. In this study, the density functional theory and maximally localized Wannier functions are employed to…
Using {\it ab initio} density functional theory we explore the behavior of thin layers of metallic $d^4$ SrFeO$_3$ confined between the $d^0$ dielectric SrTiO$_3$ in a superlattice geometry. We find the presence of insulating SrTiO$_3$…