Related papers: Magnetic ground state of coupled edge-sharing CuO_…
Altermagnetism is a topic that has lately been gaining attention and the RuO$_2$ compound is among one of the most studied altermagnetic candidates. However, the survey of available literature on RuO$_2$ properties suggests that there is no…
We examine and identify magnetoresistance mechanisms in 2D system containing a sizable concentration of magnetic ions. We argue that some of these mechanisms can serve as a tool to measure spin polarization. Lack of spin degeneracy and…
In order to search for the magnetic ground state of surface nanostructures we extended first principles adiabatic spin dynamics to the case of fully relativistic electron scattering. Our method relies on a constrained density functional…
We report on measurements of the magnetic response of the anisotropic CuO_2 spin chains in lightly hole-doped La_x (Ca,Sr)_14-x Cu_24 O_41, x>=5. The experimental data suggest that in magnetic fields B >~ 4T (applied along the easy axis)…
The recently observed multiferroic behavior in the s=1/2 chain cuprate LiVCuO_4 (LiCuVO_4) with edge-shared CuO_4 plaquettes and helical spin ordering does not agree with the existing theories such as a spin-current scenario. We argue that…
While the dominant magnetic interaction in La$_2$CuO$_4$ is superexchange between nearest-neighbor Cu moments, the pinning of the spin direction depends on weak anisotropic effects associated with spin-orbit coupling. The symmetry of the…
The electronic structure and magnetic properties of CaCr$\mathrm{O}_3$ have been calculated by two methods, including hybrid-exchange density-function theory and density-functional theory + $U$. The computed densities of states from both of…
The exchange coupling of two magnetic layers via a diffuse oxide interlayer is studied with an atomistic spin model. We investigate the effect of magnetic concentration and oxide layer thickness on the effective exchange coupling strength…
The ordered magnetic states of MnWO4 at low temperatures were examined by evaluating the spin exchange interactions between the Mn2+ ions of MnWO4 on the basis of first principles density functional calculations and by performing classical…
We have investigated the structural and magnetic transitions in CsCoO$_2$ using calorimetric measurements, neutron powder diffraction (NPD), density functional theory (DFT) calculations and muon-spin relaxation ($\mu$SR) measurements.…
When two quantum systems are coupled via a mediator, their dynamics has traces of non-classical properties of the mediator. We show how this observation can be effectively utilised to study the quantum nature of materials without…
Co-doped ZnO is the prototypical dilute magnetic oxide showing many of the characteristics of ferromagnetism. The microscopic origin of the long range order however remains elusive, since the conventional mechanisms for the magnetic…
This paper is a brief review of our recent studies concerning on magnetism and electronic states of lattice systems with Hund coupling. First we examined the effectiveness of the Hund coupling in realizing ferromagnetism in the doubly…
Dynamic spin correlation function of the $S=1/2$ antiferromagnetic spin chain with alternating nearest neighbor and competing next nearest neighbor interactions is studied using the numerical diagonalization method. We find characteristics…
We investigate the ground-state properties of a one-dimensional $t_{\rm 2g}$-orbital Hubbard model including an atomic spin-orbit coupling by using numerical methods, such as Lanczos diagonalization and density-matrix renormalization group.…
LaCu3Fe4O12 undergoes a phase transition at 393 K involving the spin order (SO) of the Fe sites and the charge order (CO) resulting in Cu-Fe intersite charge transfer. On the basis of density functional calculations, we show that this…
A spin dynamics approach has been used to study the behavior of the magnetic spins and the electric pseudo-spins in a 1-D composite multiferroic chain with a linear magneto-electric coupling at the interface. The response is investigated…
A study of 4$\alpha$ linear-chain structure in high-lying collective excitation states of $^{16}$O with a covariant density functional theory is presented. The low-spin states are obtained by configuration mixing of particle-number and…
We use spin-density-functional theory to study the spacing between conductance peaks and the ground-state spin of 2D model quantum dots with up to 200 electrons. Distributions for different ranges of electron number are obtained in both…
We use density-functional band-structure calculations to explore the origin of the up-up-down-down (UUDD) magnetic order in Cu$_2$GeO$_4$ with the frustrated $J_1-J_2$ spin chains coupled into layers within the spinel-like crystal…