相关论文: Robust atomic orbital in the cluster magnet LiMoO2
A Dirac electron system in solids mimics a relativistic quantum physics that is compatible with Maxwell's equations, by which we anticipate unified electromagnetic responses. We find a large orbital diamagnetism only along the interplane…
Dynamical topological solitons are studied in classical two-dimensional Heisenberg easy-axis ferromagnets. The properties of such solitons are treated both analytically in the continuum limit and numerically by spin dynamics simulations of…
The influence of spin-orbit interaction on chemical bonds in elemental solids and homonuclear dimers is analyzed by means of density-functional-theory calculations. Employing highly precise all-electron full-potential methodology, our…
Topological semimetals are intensively studied in recent years. Besides the well known Weyl and Dirac semimetals, some materials possess nodes with linear crossing of multiple bands. Low energy excitations around these nodes are called…
Ensembles of gold nanoparticles present a magnetic behavior which is at odds with the weakly diamagnetic response of bulk gold. In particular, an unusual ferromagnetic order has been unveiled by several experiments. Here we investigate if…
The semiconductor-semiconductor transition of La2RuO5 is studied by means of augmented spherical wave (ASW) electronic structure calculations as based on density functional theory and the local density approximation. This transition has…
We study the spin mixing dynamics of ultracold spin-1 atoms in a weak non-uniform magnetic field with field gradient $G$, which can flip the spin from +1 to -1 so that the magnetization $m=\rho_{+}-\rho_{-}$ is not any more a constant. The…
Topological insulators are a class of solids in which the nontrivial inverted bulk band structure gives rise to metallic surface states that are robust against impurity scattering. In three-dimensional (3D) topological insulators, however,…
We study the robustness of the paradigmatic kagome Resonating Valence Bond (RVB) spin liquid and its orthogonal version, the quantum dimer model. The non-orthogonality of singlets in the RVB model and the induced finite length scale not…
We study how spin and orbital effects influence the capability of promoting Dzyaloshinskii-Moriya (DM) interaction by studying the two magnetic polar materials, Cu(IO3)2 (S = 1/2 with orbital contribution) and Mn(IO3)2 (S = 5/2 with…
We characterize the low-energy physics of the two-orbital Hubbard model in the orbital-selective Mott phase, in which one band is metallic and the other insulating. Using dynamical mean-field theory with the numerical renormalization group…
We have investigated the structural and magnetic properties of a new cubic spinel LiZn$_{2}$V$_{3}$O$_{8}$ (LZVO) through x-ray diffraction, dc and ac susceptibility, magnetic relaxation, aging, memory effect, heat capacity and $^{7}$Li…
Two-component dipolar fermions in zigzag optical lattices allow for the engineering of spin-orbital models. We show that dipolar lattice fermions permit the exploration of a regime typically unavailable in solid-state compounds that is…
The alloy Ca$_{2-x}$Sr$_x$RuO$_4$ exhibits a complex phase diagram with peculiar magnetic metallic phases. In this paper some aspects of this alloy are discussed based on a mean field theory for an effective Kugel-Khomskii model of…
The valence electronic structure of magnetic centers is one of the factors that determines the characteristics of a magnet. It may refer to orbital degeneracy, as for $j_\text{eff}=1/2$ Kitaev magnets, or near-degeneracy, e.g. involving the…
Room-temperature ferromagnetism has been recently discovered in Co-doped TiO$_2$ rutile. Our $ab$ $initio$ density-functional theory investigations show that the substitutional Co ions incorporated into TiO$_2$ rutile tend to cluster and…
Molecule oxygen resembles 3d and 4f metals in exhibiting long-range spin ordering and electron strong correlated behaviors in compounds. The ferromagnetic spin ordering and half-metallicity, however, are quite elusive and have not been well…
We present our theoretical results on the electronic state in vanadium spinel oxide AlV$_2$O$_4$. The material is a mixed-valent system with the average valence V$^{2.5+}$, and V cations constitute a frustrated pyrochlore structure. It…
Usually, the octet rule has limited the 2D materials by elements within groups IIIA_VA, whose outmost electrons can be considered to form hybridization orbit by s wave and p wave. The hybridization orbits can accommodate all the outmost…
The properties of transition metal compounds are largely determined by nontrivial interplay of different degrees of freedom: charge, spin, lattice, but also orbital ones. Especially rich and interesting effects occur in systems with orbital…