Related papers: J-freezing and Hund's rules in spin-orbit-coupled …
The alkali-doped fullerides A$_3$C$_{60}$ are half-filled three-orbital Hubbard systems which exhibit an unconventional superconducting phase next to a Mott insulator. While the pairing is understood to arise from an effectively negative…
We investigate the half-filled Hubbard chain with additional nearest- and next-nearest-neighbor spin exchange, J1 and J2, using bosonization and the density-matrix renormalization group. For J2 = 0 we find a spin-density-wave phase for all…
The two-dimensional extended Hubbard model that includes a nearest- neighbor Heisenberg interaction is studied using a mean-field theory where quasiparticles are defined by an U(8) group of canonical transformations. The theory is a…
We investigate the quasiparticle dynamics in the two-orbital Hubbard model on the square lattice at quarter filling by means of the cellular dynamical mean field theory. We show that the Fermi-liquid state is stabilized up to the large…
Using the coupled cluster method (CCM) we study the full (zero-temperature) ground-state (GS) phase diagram of a spin-half ($s=1/2$) $J_{1}$-$J_{2}$ Heisenberg model on a cross-striped square lattice. Each site of the square lattice has 4…
The entanglement of the spin and orbital degrees of freedom through the spin-orbit coupling has been actively studied in condensed matter physics. In several iridium-oxide systems, the spin-orbital entangled state, identified by the…
We examine the nature of the transition to the antiferromagnetically ordered state in the half-filled three-dimensional Hubbard model using the dual-fermion multiscale approach. Consistent with analytics, in the weak-coupling regime we find…
We study a three-orbital Hubbard model with negative Hund coupling in infinite dimensions, combining dynamical mean-field theory with continuous time quantum Monte Carlo simulations. This model, which is relevant for the description of…
Spin-crossover compounds, which are characterized by magnetic ions showing low-spin and high-spin states at thermally accessible energies, are ubiquitous in nature. We here focus on the effect of an exchange interaction on the collective…
We investigate the highly frustrated spin and orbital superexchange interactions in cubic vanadates. The fluctuations of $t_{2g}$ orbitals trigger a {\it novel mechanism of ferromagnetic interactions} between spins S=1 of V$^{3+}$ ions…
We present studies of the atomic limit of the extended Hubbard model with pair hopping for arbitrary electron density and arbitrary chemical potential. The Hamiltonian consists of (i) the effective on-site interaction $U$ and (ii) the…
In this paper, a generalization of standard spin fluctuation theory is considered by replacing the simple Hubbard interaction by the screened Hartree-Fock interaction for f electrons. This model is then used in both an LS and a JJ coupling…
When localized spins on different d orbitals prefer different types of antiferromagnetic ordering, the Hund's rule coupling creates frustration. Using spin-wave theory we study the case of two such orbitals on a square lattice coupled…
We propose a way to identify strongly Hund-correlated materials by unveiling a key signature of Hund correlations at the two-particle level. The defining feature is the {\it sign} of the response of the {\it frozen spin ratio} (the…
We present magnetic properties of the three-band Hubbard model in the para- and antiferromagnetic phase on a hypercubic lattice calculated with the Dynamical Mean-Field Theory (DMFT). To allow for solutions with broken spin-symmetry we…
We investigate spin-triplet exciton condensation in the two-orbital Hubbard model close to half filling by means of dynamical mean-field theory. Employing an impurity solver that handles complex off-diagonal hybridization functions, we…
We studied a multi-orbital Hubbard model at half-filling for two and three orbitals per site on a two-site cluster via full exact diagonalization, in a wide range for the onsite repulsion $U$, from weak to strong coupling, and multiple…
We study ordered phases with broken translational symmetry in the half-filled three-orbital Hubbard model with antiferromagnetic Hund coupling by means of dynamical mean-field theory (DMFT) and continuous-time quantum Monte Carlo…
The electronic ground state of Ca3LiOsO6 was recently considered within an intermediate coupling regime that revealed J=3/2 spin-orbit entangled magnetic moments. Through inelastic neutron scattering and density functional theory we…
Using the real-space Hartree Fock approximation, the magnetic phase diagram of a five-orbital Hubbard model for the iron-based superconductors is studied varying the electronic density $n$ in the range from 5 to 7 electrons per transition…