Related papers: Orbital Ordering in Fe$_{1-x}$Mn$_x$V$_2$O$_4$: A …
We study the correlation effects on the electronic structure and spin density wave order in Fe-pnictides. Using the multiorbital Hubbard model and Gutzwiller projection, we show that nonperturbative correlation effects are essential to…
We use resonant X-ray scattering at the nickel L$_{2,3}$ edges to investigate the interplay between orbital degrees of freedom and charge density waves (CDW) in the superconductor BaNi$_2$(As$_{1-x}$P$_x$)$_2$. Both the incommensurate and…
Magnetic and electronic structures in LaFeAsO in the single-stripe-type antiferromagnetic (AFM) phase are studied using first-principles density-functional calculations including the spin-orbit interaction. We show that the longitudinal…
Besides magnetic and charge order, regular arrangements of orbital occupation constitute a fundamental order parameter of condensed matter physics. Even though orbital order is difficult to identify directly in experiments, its presence was…
The vanadium doping effects on superconductivity and magnetism of iron pnictides are investigated in Ba(Fe$_{0.92-x}$Co$_{0.08}$V$_x$)$_2$As$_2$ by transport, susceptibility and neutron scattering measurements. The doping of magnetic…
Metal-insulator transition was microscopically investigated by orbital-resolved nuclear magnetic resonance (OR-NMR) spectroscopy in a single crystal of vanadium dioxide VO$_2$. Observations of the anisotropic $^{51}$V Knight shift and the…
We report detailed 51V NMR spectra in a single crystal of MnV2O4. The vanadium spectrum reveals two peaks in the orbitally ordered state, which arise from different internal hyperfine fields at two different V sublattices. These internal…
We analyzed the possible magnetic and orbital orderings of double perovskites, using a simple extension of the double exchange model well suited for these compounds. Orbital ordering is favored by the on site repulsion at the Fe ions. We…
The orbital effect on the anomalous magnetism and evolution of low La-doping single crystals, La$_x$Y$_{1-x}$VO$_{3}$ (x = 0, 0.1, and 0.2), has been investigated by applying the X-ray diffraction, specific heat, magnetization and Raman…
The evolution of the antiferromagnetic order parameter in CeFeAsO_{1-x}F_{x} as a function of the fluorine content x was investigated primarily via zero-field muon-spin spectroscopy. The long-range magnetic order observed in the undoped…
The standard way to find the orbital occupation of Jahn-Teller (JT) ions is to use structural data, with the assumption of a one-to-one correspondence between the orbital occupation and the associated JT distortion, e.g. in O6 octahedron.…
Single-site dynamical mean field theory is used to determine the magnetic and orbital-ordering phase diagram for a model of electrons moving on a lattice with three orbital states per site and with the fully rotationally invariant…
Density functional theory (DFT) calculations are carried out on ReOFeAs, Re = Ce, Pr, the parent compounds of the high-T$_c$ superconductors ReO$_{1-x}$F$_{x}$FeAs, in order to determine the magnetic order of the ground state. It is found…
The key role of the orbital degree of freedom to understand the magnetic properties of layered ruthenates is here discussed. In the G-type antiferromagnetic phase of Ca$_2$RuO$_4$, recent X-ray experiments reported the presence of 0.5 hole…
Using ab initio calculations based on the correlated band theory, we have investigated the quasi-one-dimensional chain system $\beta$-V$_2$O(PO$_4$), showing both charge and spin orderings. Even in the uncorrelated region, the pure…
We study the doping dependence of the spin-density-wave (SDW) state in four models of the 1111 pnictides. The random-phase approximation is used to determine the ordering temperature and the ordering vector as functions of doping, and to…
We present theoretical study of ordering phenomena in binary $C_{1-x}B_{x}$, $C_{1-x}N_{x}$ and ternary $B_{x}C_{1-x-y}N_{y}$ alloys forming two-dimensional, graphene-like systems. For calculating energy of big systems (20 000 atoms in the…
We study quantum phase transitions induced by the on-site spin-orbit interaction lambda(L.S) in a toy model of vanadium chains. In the lambda->0 limit, the decoupled spin and orbital sectors are described by a Haldane and an Ising chain,…
We investigate the phase diagrams of the spin-orbital $d^9$ Kugel-Khomskii model for increasing system dimensionality: from the square lattice monolayer, via the bilayer to the cubic lattice. In each case we find strong competition between…
Based on the degeneracy of the d_{zx} and d_{yz} orbitals in Sr_2RuO_4 it is argued that the Cooper pairs condense in orbital singlets. Together with the spin-triplet wave functions the real-space wave function then is symmetric.…