相关论文: Effects of the crystal structure on the ferromagne…
We study the influence of non magnetic impurities on the phase diagram of doped two-leg Hubbard Cu-O ladders. In the absence of impurities this system posseses d-wave superconducting states and orbital current states depending on the…
We have investigated electronic structures and magnetic properties of potential ZnO based diluted magnetic semiconductors: (Fe, Co) and (Fe, Cu) codoped ZnO. The origins of ferromagnetism are shown to be different between two. (Fe, Co)…
The possible presence of amorphous and heterogeneous phases in the inner crust of a neutron star is expected to reduce the electrical conductivity of the crust, with potentially important consequences on the magneto-thermal evolution of the…
We present a Quantum Monte Carlo study for Heisenberg spin-1/2 two leg ladder systems doped with non magnetic impurities. The simulations are applied to the doped spin ladder compound SrCu2O3 doped with Zn, where a large broadening of the…
From state-of-the-art density-functional calculations using hybrid functionals we show that, persistent $n$-type conductivity in ZnO is due to defect complexes formed between H with intrinsic and extrinsic defects. H exhibits cationic,…
We are considering the interplay between several non-magnetic impurities in the spin-1/2 Heisenberg antiferromagnet in chains, ladders and planes by introducing static vacancies in numerical quantum Monte Carlo simulations. The effective…
We study the impurity-induced phase transitions in a quasi-one-dimensional Heisenberg antiferromagnet doped with magnetic spin-1/2 impurities and non-magnetic ones. The impurity-induced transition temperature determined by the quantum Monte…
We use a quantum Monte Carlo method (stochastic series expansion) to study the effects of a magnetic or nonmagnetic impurity on the magnetic susceptibility of the two-dimensional Heisenberg antiferromagnet. At low temperatures, we find a…
Using the first-principles density-functional approach, magnetic properties of Mn-, Fe-, Co-, and Ni-doped rutile TiO2 were investigated for two different impurity concentrations (25% and 6.25%). Calculations were performed with the…
We analyze the effects of an applied magnetic field on the phase diagram of a weakly-correlated electron system with imperfect nesting. The Hamiltonian under study describes two bands: electron and hole ones. Both bands have spherical Fermi…
In this work we have employed density-functional theory with hybrid functionals to investigate the atomic and electronic structure of bare and hydrogenated Mn doped ZnO nanowires with small diameter. We determine changes in magnetic and…
A detailed analysis of the Kondo effect of a magnetic impurity in a zigzag graphene nanoribbon is addressed. An adatom is coupled to the graphene nanoribbon via a hybridization amplitude $\Gamma_{imp}$ in a hollow or top site configuration.…
We study the influence of disorder and randomly distributed impurities on the properties of correlated antiferromagnets. To this end the Hubbard model with (i) random potentials, (ii) random hopping elements, and (iii) randomly distributed…
We consider an integrable model describing an Anderson-like impurity coupled to an open $t$--$J$ chain. Both the hybridization (i.e. its coupling to bulk chain) and the local spectrum can be controlled without breaking the integrability of…
Using first-principles calculations, we investigated the impact of chromium (Cr) and vanadium (V) impurities on the magnetic anisotropy and spin polarization in Fe/MgO magnetic tunnel junctions. It is demonstrated using layer resolved…
In this paper, we study the defects effect on magnetic properties of a nano-square structure. This system is composed with alternate layers consisting of the spins {\sigma}=3/2 and S=1. More precisely, we examine the effect of different…
Being motivated by recent experimental studies, we investigate magnetic structures of the Mo pyrochlores $A_2$Mo$_2$O$_7$ ($A$= Y, Nd, and Gd) and their impact on the electronic properties. The latter are closely related with the behavior…
Density functional theory is used to explore the possibility of inducing impurity band ferromagnetism in monolayers of semiconducting MoS2 by introducing holes into the narrow Mo 4d band that forms the top of the valence band. A large out…
We study the Kondo screening of a magnetic impurity adsorbed in graphene in the presence of Rashba spin-orbit interaction. The system is described by an effective single-channel Anderson impurity model, which we analyze using the numerical…
A formalism is developed to treat magnetic impurities in a Mott-Hubbard antiferromagnetic insulator within a representation involving multiple orbitals per site. Impurity scattering of magnons is found to be strong when the number of…