相关论文: Oxygen-stripes in La0.5Ca0.5MnO3 from ab initio ca…
The electronic structure of La 7/8 Sr 1/8 MnO 3 was studied by using the rotation-invariant LSDA (Local Spin Density Approximation)+U formalism. We found the specific kind of charge and orbital order for ferromagnetic insulating solution in…
A novel stable crystallographic structure is discovered in a variety of ABO3, ABF3 and A2O3 compounds (including materials of geological relevance, prototypes of multiferroics, exhibiting strong spin-orbit effects, etc...), via the use of…
We have investigated the peculiar structure of charge and spin ordering in the half-doped layered perovskite oxide La$_{1.5}$Sr$_{0.5}$CoO$_4$ by elastic neutron scattering. Two samples with different preparation histories were studied. We…
The spin states and electronic structure of layered perovskite La1.5Ca0.5CoO4 are investigated using fullpotential linearized augmented plane-wave method. All the computational results indicate that the Co2+ ion is in a high-spin state and…
The crystallographic and magnetic properties of La{0.5+delta}A{0.5-delta}Mn{0.5+epsilon}Ru{0.5-epsilon}O{3} (A= Ca, Sr, Ba) were investigated by means of neutron powder diffraction. All studied samples show the orthorhombic perovskite…
We report the observation of superstructures associated with the oxygen 2p-states in two prototypical manganites using x-ray diffraction at the oxygen K-edge. We determine the nature of the orderings and discuss our picture with respect to…
We propose the origin of the charge-ordered stripe structure with the orbital ordering observed experimentally in La_(1-x)Ca_(x)MnO_(3) (x=1/2, 2/3), in which the long-range Coulomb interaction plays an essential role. We study a Hubbard…
The complex phase diagram of manganites with simultaneously active spin, charge, orbital, and lattice degrees of freedom continues providing surprises. In a recent groundbreaking experiment, membranes of the perovskite manganite…
We have analyzed the experimental evidence of charge and orbital ordering in La0.5Sr1.5MnO4 using first principles band structure calculations. Our results suggest the presence of two types of Mn sites in the system. One of the Mn sites…
The crystallographic and magnetic phase diagram of the n=2 layered manganite La2-2xSr1+2xMn2O7 in the region x=>0.5 has been studied using temperature dependent neutron powder diffraction. The magnetic phase diagram reveals a progression of…
The discovery of novel structural and physical properties in the $A$-site ordered manganite $R$BaMn$_2$O$_6$ ($R$ = Y and rare earth elements) has demanded new comprehension about perovskite manganese oxides. In the present study, the…
Using \emph{ab initio} band structure and DFT+dynamical mean-field theory methods we examine the effects of electron-electron interactions on the electronic structure, magnetic state, and structural phase stability of the recently…
A model of localized classical electrons coupled to lattice degrees of freedom and, via the Coulomb interaction, to each other, has been studied to gain insight into the charge and orbital ordering observed in lightly doped manganese…
The crystallographic (charge-ordered) and magnetic superstructures of La0.333Ca0.667MnO3 were studied by high-resolution synchrotron x-ray and neutron powder diffraction. In the antiferromagnetic structure, which was refined using a…
In all archetypical reported (001)-oriented perovskite heterostructures, it has been deduced that the preferential occupation of two-dimensional electron gases is in-plane $d_\textrm{xy}$ state. In sharp contrast to this, the investigated…
We report on a comprehensive study of the electronic and magnetic structure of the striped nickelate La5/3Sr1/3NiO4. The investigation is carried out using band structure calculations based on density functional theory. A magnetic structure…
We present diffraction data on a single-layered manganite La(0.42)Sr(1.58)MnO4 with hole doping (x>0.5). Overdoped La(0.42)Sr(1.58)MnO4 exhibits a complex ordering of charges, orbitals and spins. Single crystal neutron diffraction…
We investigate in this paper magnetic properties of the perovskite compound (La0.56Ce0.14)Sr0.30MnO3. The method we use here is Monte Carlo simulation, in which we take into account different kinds of interactions between nearest and…
The phase diagrams of LaMnO$_3$ perovskites have been intensely studied due to the colossal magnetoresistance (CMR) exhibited by compositions around the $\frac{3}{8}^{th}$ doping level. However, phase segregation between ferromagnetic (FM)…
Transition metal oxide perovskites are an ideal platform for exploring the interplay between spin, orbital, charge and lattice degrees of freedom. Among them, \ce{LaVO3} has been extensively studied in heterostructures and superlattices,…