相关论文: DFT+U study of magnetic order in doped La$_2$CuO$_…

Doping $La_2CuO_{4}$ with alkaline-earth, $Ae= Sr,Ba$ generates holes in $La_{2-y-x}Ln_yAe_xCuO_{4}$ ($Ln =$ $Nd,Eu$). A small fraction of the holes, $\check{p} \le $ $0.02$, suppresses 3D-AFM. The rest resides as double holes at $O$ atoms…

The effect of a magnetic field on the charge stripe order in La(2-x)Ba(x)CuO(4) has been studied by means of high energy (100 keV) x-ray diffraction for charge carrier concentrations ranging from strongly underdoped to optimally doped. We…

We study long wavelength magnetic excitations in lightly doped La_{2-x}Sr_{x}CuO_{4} (x < 0.03) detwinned crystals. The lowest energy magnetic anisotropy induced gap can be understood in terms of the antisymmetric spin interaction inside…

Magnetic properties of Li$_x$CoO$_2$ for $x = 0.94, 0.75, 0.66$ and $0.51$ were investigated in frames of method combining Generalized Gradient Approximation with Dynamical Mean--Field Theory (GGA+DMFT). We found that a delicate interplay…

We determine the spin and charge orders in the ground state of the doped two-dimensional (2D) Hubbard model in its simplest form, namely with only nearest-neighbor hopping and on-site repulsion. At half-filling, the ground state is known to…

Using an exact diagonalization method within the dynamical mean-field theory we study stripe phases in the two-dimensional Hubbard model. We find a crossover at doping $\delta\simeq 0.05$ from diagonal stripes to vertical site-centered…

Multipolar magnetic phases in correlated insulators represent a great challenge for Density Functional Theory (DFT) due to the coexistence of intermingled interactions, typically spin-orbit coupling, crystal field and complex non-collinear…

Charge-order stripes of different types occur when copper oxides are doped with either heterovalent metal, like $La_{2-x}Sr_xCuO_4$, or oxygen, like $YBa_2Cu_3O_{6+y}$. The difference shows up in the doping dependence of their…

Measuring the ESR of Gd spin probes we have studied the magnetic properties of the copper oxide planes in the low temperature tetragonal (LTT) phase of Eu doped La_{2-x}Sr_xCuO_4. The data give evidence that at particular levels of Sr and…

We have performed a systematic study of the emergence of meta-stable states in density functional theory plus Hubbard U (DFT+U ) simulations of NiO, CoO, FeO. Particular attention is given to the spin-polarization of the…

We have carried out a systematic study on the effect of Cu doping on nuclear, magnetic, and dielectric properties in Mn$_{1-x}$Cu$_{x}$WO$_4$ for ${0}\leq{x}\leq{0.19}$ by a synergic use of different techniques, viz, heat capacity,…

Magnetic order has been investigated in stripe-ordered La(2-x)Sr(x)NiO(4) (x = 0.275, 0.37, 0.4) by d.c. magnetization and by polarized- and unpolarized-neutron diffraction. In the magnetically ordered phase, all three compositions exhibit…

We present results of magnetic neutron diffraction experiments on the co-doped super-oxygenated La(2-x)Sr(x)CuO(4+y) (LSCO+O) system with x=0.09. The spin-density wave has been studied and we find long-range incommensurate antiferromagnetic…

The ESR signal of Gd spin probes (0.5 at %) as well as the static normal state susceptibility of Eu (J(Eu^{3+})=0) doped La_{2-x-y}Sr_xEu_yCuO_4 reveal pronounced changes of the Cu magnetism at the structural transition from the…

Theoretically, the relative change of the Heisenberg-type nearest-neighbor coupling $J_1$ and next-nearest-neighbor coupling $J_2$ in the face-centered-cubic lattice can give rise to three main antiferromagnetic orderings of type-I,…

We investigate the electronic structure of (Sr$_{1-x}$La$_x$)$_2$RhO$_4$ using a combination of the density functional and dynamical mean-field theories. Unlike the earlier local density approximation plus Hubbard $U$ (LDA+U) studies, we…

The hole concentration dependence of the magnetic correlations is studied in very lightly-doped La$_{2-x}$Sr$_x$CuO$_4$ ($x<$0.02), which shows coexistence of a three-dimensional antiferromagnetic (AF) long-range ordered phase and a…

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…

The nature of the interplay between superconductivity and magnetism in the cuprates remains one of the fundamental unsolved problems in high temperature superconductivity. Whether and how these two phenomena are interdependent is perhaps…

We develop a dynamical mean-field theory approach for the spiral magnetic order, changing to a local coordinate frame with preferable spin alignment along the $z$-axis, which can be considered with the impurity solvers treating the spin…