相关论文: Revealing the Underlying Mechanisms of Stacking Or…
We analyze magnetic properties of monolayers and bilayers of chromium trihalides, CrI$_3$, in two different stacking configurations: AA and rhombohedral ones. Our main focus is on the corresponding Curie temperatures, hysteresis curves,…
The thickness dependence of spin-orbit torque and magnetoresistance in ferromagnet/heavy-metal bilayers is studied using the first-principles non-equilibrium Green's function formalism combined with the Anderson disorder model. A systematic…
Magnetic ordering phenomena have a profound influence on the macroscopic properties of correlated-electron materials, but their realistic prediction remains a formidable challenge. An archetypical example is the ternary nickel oxide system…
An accurate understanding of the ground state electronic properties of La$_3$Ni$_2$O$_7$, a high-temperature superconductor under pressure, is key for unveiling the origin of its superconductivity. In this paper, we conduct a theoretical…
We analyze a $t_{2g}$ double-exchange system where the orbital directionality of the itinerant degrees of freedom is a key dynamical feature that self-adjusts in response to doping and leads to a phase diagram dominated by two classes of…
Recent observations of quantum anomalous Hall effects in moir\'e systems have revealed the emergence of interaction-driven ferromagnetism with significant orbital contributions. To capture this physics, we extend the modern theory of…
We have explored the electronic properties of stacked graphene flakes with the help of the quantum chemistry methods. We found that the behavior of a bilayer system is governed by the strength of the repulsive interactions that arise…
This work theoretically analyzes electronic ordering in AA-stacked bilayer graphene and the role of the Coulomb interaction in these many-body phenomena. Using the random phase approximation to account for screening, we find intra-layer…
Discovery of high-$T_c$ superconductivity (SC) in the bilayer nickelate series La$_3$Ni$_2$O$_7$ have attracted substantial interest, providing a new platform for exploring unconventional SC. Certain experimental evidence has pointed to a…
The ability to control magnetic interactions at the nanoscale is crucial for the development of next-generation spintronic devices and functional magnetic materials. In this work, we investigate theoretically, by means of many-body…
We analyze the charge- and spin response functions of rare-earth nickelates RNiO3 and their heterostructures using random-phase approximation in a two-band Hubbard model. The inter-orbital charge fluctuation is found to be the driving…
Van der Waals (VdW) materials have opened new directions in the study of low dimensional magnetism. A largely unexplored arena is the intrinsic tuning of VdW magnets toward new ground-states. The chromium trihalides provided the first such…
Motivated by the recent discovery of helical magnetic structure in RbEuFe$_{4}$As$_{4}$, we investigate interlayer ordering of magnetic moments in materials composed of spatially-separated superconducting and ferromagnetically-aligned…
The primordial ingredient of cuprate superconductivity is the CuO2 unit cell. Here, theoretical attention usually concentrates on the intra-atom Coulombic interactions dominating the 3d^9 and 3d^10 configurations of each copper ion.…
Comprehensive studies of magnetic properties of GdCr3(BO3)4 single crystal have been carried out. The integrals of intrachain and interchain exchange interactions in the chromium subsystem have been determined and the strength of Cr-Gd…
The non-interacting energy spectrum of graphene and its bilayer counterpart consists of multiple degeneracies owing to the inherent spin, valley and layer symmetries. Interactions among charge carriers are expected to spontaneously break…
Magnetic skyrmions are topologically protected spin swirling vertices, which are promising in device applications due to their particle-like nature and excellent controlability. Magnetic skyrmions have been extensively studied in a variety…
We study a model of two concentric onedimensional rings with incommensurate areas $A_1$ and $A_2$, in a constant magnetic field. The two rings are coupled by a nonhomogeneous inter-ring tunneling amplitude, which makes the one-particle…
Using {\it ab initio} approaches for extended Hubbard interactions coupled to phonons, we reveal that the intersite Coulomb interaction plays important roles in determining various distinctive phases of the paradigmatic charge ordered…
We study critical and magnetic properties of a bilayer Ising system consisting of two triangular planes A and B, with the antiferromagnetic (AF) coupling $J_{\rm A}$ and the ferromagnetic (FM) one $J_{\rm B}$ for the respective layers,…