Related papers: Electron correlation and spin density wave order i…
We study the symmetry-broken phases in two- and three-orbital Hubbard models with lifted orbital degeneracy using dynamical mean field theory. On the technical level, we explain how symmetry relations can be exploited to measure the…
We study a ferromagnetic instability in a doped single-band Hubbard model by means of dynamical mean-field theory with the continuous-time quantum Monte Carlo simulations. Examining the effect of the strong correlations in the system on the…
The distribution of valence electrons in metals usually follows the symmetry of an ionic lattice. Modulations of this distribution often occur when those electrons are not stable with respect to a new electronic order, such as spin or…
We study instabilities of single-species fermionic atoms in the p-orbital bands in two-dimensional optical lattices at noninteger filling against interactions. Charge density wave and orbital density wave orders with stripe or checkerboard…
In view of the recent experimental facts in the iron-pnictides, we make a proposal that the itinerant electrons and local moments are simultaneously present in such multiband materials. We study a minimal model composed of coupled itinerant…
The phase stability of the various crystalline structures of the super-heavy element Copernicium was determined based on the first-principles calculations with different levels of the relativistic effects. We utilized the Darwin term,…
Strong electron correlations lie at the origin of transformative phenomena such as colossal magneto-resistance and high-temperature superconductivity. Already near room temperature, doped copper oxide materials display remarkable features…
We study collective spin excitations of a magnetically ordered state in a multi-component system composed of both itinerant electrons and local moments. Here the induced spin-density-wave (SDW) ordering of itinerant electrons and the…
Using the multiband $d-p$ model and unrestricted Hartree-Fock approximation we investigate the electronic structure and spin-orbital order in three-dimensional MnO$_3$ lattice such as realized in LaMnO$_3$. The orbital order is induced and…
We attribute the structural phase transition (SPT) in the parent compounds of the iron pnictides to orbital ordering. Due to the anisotropy of the $d_{xz}$ and $d_{yz}$ orbitals in the $xy$ plane, a ferro-orbital ordering makes the…
We consider the impact of the competition among superconductivity, spin density wave, and nematic order in iron pnictides, and show that the ordering competition substantially reshapes the global phase diagram. We perform a detailed…
We investigate the electronic structure of nickelate superconductor NdNiO2 upon hole doping, by means of density-functional theory and dynamical mean-field theory. We demonstrate the strong intrinsic hybridization between strongly…
The electronic orders in Hubbard models on a Kagome lattice at van Hove filling are of intense current interest and debate. We study this issue using the singular-mode functional renormalization group theory. We discover a rich variety of…
The two-orbital Hubbard model for the pnictides is studied numerically using the real-space Hartree-Fock approximation on finite clusters. Upon electron doping, states with a nonuniform distribution of charge are stabilized. The observed…
To perform a local orbital analysis of electronic and magnetic interactions, we construct the Wannier functions (WFs) of the Fe $3d$ orbitals in the parent compound of the recently discovered iron pnictide superconductors, LaFeAsO, and a…
The origin of unusual anisotropic electronic properties in the spin-density wave state of iron pnictides has conventionally been attributed to the breaking of four-fold rotational symmetry associated with the collinear magnetic order. By…
The tension between fermion pairing and magnetism affects numerous strongly correlated electron systems, from high-temperature cuprates to twisted bilayer graphene. Exotic forms of fermion pairing and superfluidity are predicted when…
Correlation effects are observed strong in Iron chalcogenides superconductors by experimental and theoretical investigations. We present a comparative study of the influence of Coulomb interaction and Hund's coupling in the electronic…
We study the half filled extended Hubbard model on a two-dimensional square lattice using cluster dynamical mean field theory on clusters of size 8-20. We show that the model exhibits metallic, Mott insulating, and charge ordered phases,…
Cluster perturbation theory is used to calculate band structure, spectral functions, Fermi surface, and spin and charge susceptibilities for the two-orbital model of iron pnictides with the on-site multiorbital Hubbard interactions.…