相关论文: Non-magnetic ground state of PuO$_2$

The correlated-band theory implemented as a combination of the local-density approximation with the dynamical mean-field theory is applied to PuO2. An insulating electronic structure, consistent with the experimental valence-band…

By LDA+U method with spin-orbit coupling (LDA+U+SO) the magnetic state and electronic structure have been investigated for plutonium in \delta and \alpha phases and for Pu compounds: PuN, PuCoGa5, PuRh2, PuSi2, PuTe, and PuSb. For metallic…

We investigate the ground-state properties of the periodic Anderson model on the square lattice across various band fillings. Employing the infinite projected entangled-pair states (iPEPS) technique, we can determine the magnetic ground…

Motivated by recent photoemission and pump-probe experiments, we report determinant Quantum Monte Carlo simulations of hybridization fluctuations in the half-filled periodic Anderson model. A tentative phase diagram is constructed based…

We construct a class of exact ground states of three-dimensional periodic Anderson models (PAMs) -- including the conventional PAM -- on regular Bravais lattices at and above 3/4 filling, and discuss their physical properties. In general,…

The competition between antiferromagnetic and spin-singlet ground states within quantum spin models and the 1/2-filled band Hubbard model has received intense scrutiny. Here we demonstrate a frustration-induced transition from N\'{e}el…

Plutonium dioxide is of high technological importance in nuclear fuel cycle and is particularly crucial in long-term storage of Pu-based radioactive waste. Using first-principles density-functional theory, in this paper we systematically…

We report on results from high-energy spectroscopic measurements on CeFe2, a system of particular interest due to its anomalous ferromagnetism with an unusually low Curie temperature and small magnetization compared to the other rare…

Rutile RuO$_2$ has attracted great interest recently, as its magnetic ground state remains controversial. Experimental studies have reported either nonmagnetic or altermagnetic (AM) ground states in different crystalline samples of RuO$_2$,…

Using density functional theory and LDA+U method, we investigate magnetic and electronic structure of Y$_{2}$Ir$_{2}$O$_{7}$ and rare-earth based pyrochlore iridates. Our study reveals that the ground state is a non-collinear magnetic…

We investigate the ground-state properties of the one-dimensional two-band Hubbard model with different bandwidths. The density-matrix renormalization group method is applied to calculate the averaged electron occupancies $n$ as a function…

The degenerate Anderson model with a nonlinear electron dispersion and an energy dependent hybridization is proven to exhibit hidden integrability and is diagonalized by the Bethe ansatz. If the impurity $f$-level energy lies below the…

We consider the simplest variant of a Kondo insulator where a doublet of localized $f$-electrons hybridizes with spin-degenerate conduction electrons. We analyse the symmetries of $f$-orbitals involved in the hybridization and point out…

We present the first magneto-absorption studies of coupled electron double layers in the quantum Hall regime. Optical absorption spectra in the vicinity of total filling factor nu = 1 reveal intriguing behavior that have no analog in the…

Magnetic susceptibility and the magnetization process have been measured in \green polycrystal. In this compound, the magnetic manganese ion exists as Mn$^{5+}$ in a tetrahedral environment, and thus the magnetic interaction can be…

We consider a non-relativistic electron bound by an external potential and coupled to the quantized electromagnetic field in the standard model of non-relativistic QED. We compute the energy functional of product states of the form…

We consider a spinless, non-relativistic particle bound by an external potential and linearly coupled to a quantized radiation field. The energy $\mathcal{E}(u,f)$ of product states of the form $u\otimes \Psi_f$, where $u$ is a normalized…

We present a class of exact ground states of a three-dimensional periodic Anderson model at 3/4 filling. Hopping and hybridization of d and f electrons extend over the unit cell of a general Bravais lattice. Employing novel composite…

The local-density approximation combined with the dynamical mean-field theory (LDA+DMFT) is applied to the paramagnetic phase of light actinide dioxides: UO2, NpO2, and PuO2. The calculated band gaps and the valence-band electronic…

The properties of UO$_{2}$ result from rich $f$-electron physics, including electronic Coulomb interactions, spin-orbit and crystal field effects, as well as inter-ionic multipolar coupling. We present a comprehensive theoretical study of…