Subscribe to the gold package and get unlimited access to Shamra Academy
Register a new userKondo screening in Co adatoms with full Coulomb interaction
120
0
0.0
(
0
)
Ask ChatGPT about the research
No Arabic abstract
Using a numerically exact first-principles many-body approach, we revisit the prototypical Kondo case of a cobalt impurity on copper. Even though this is considered a well understood example of the Kondo effect, we reveal an unexpectedly strong dependence of the screening properties on the parametrization of the local Coulomb tensor. As a consequence, the Kondo temperature can vary by orders of magnitude depending on the complexity of the parametrization of the electron-electron interaction. Further, we challenge the established picture of a spin-$1$ moment involving two cobalt $d$-orbitals only, as orbital-mixing interaction terms boost the contribution of the remainder of the $d$-shell.
rate research
Read More
The Kondo zero bias anomaly of Co adatoms probed by scanning tunneling microscopy is known to depend on the height of the tip above the surface, and this dependence is different on different low index Cu surfaces. On the (100) surface, the Kondo temperature first decreases then increases as the tip approaches the adatom, while on the (111) surface it is virtually unaffected. These trends are captured by combined density functional theory and numerical renormalization group (DFT+NRG) calculations. The adatoms are found to be described by an S = 1 Anderson model on both surfaces, and ab initio calculations help identify the symmetry of the active d orbitals. We correctly reproduce the Fano lineshape of the zero bias anomaly for Co/Cu(100) in the tunneling regime but not in the contact regime, where it is probably dependent on the details of the tip and contact geometry. The lineshape for Co/Cu(111) is presumably affected by the presence of surface states, which are not included in our method. We also discuss the role of symmetry, which is preserved in our model scattering geometry but most likely broken in experimental conditions.
The electronic structure of a prototype Kondo system, a cobalt impurity in a copper host is calculated with accurate taking into account of correlation effects on the Co atom. Using the recently developed continuous-time QMC technique, it is possible to describe the Kondo resonance with a complete four-index Coulomb interaction matrix. This opens a way for completely first-principle calculations of the Kondo temperature. We have demonstrated that a standard practice of using a truncated Hubbard Hamiltonian to consider the Kondo physics can be quantitatively inadequate.
Motivated by recent STM experiments, we explore the magnetic field induced Kondo effect that takes place at symmetry protected level crossings in finite Co adatom chains. We argue that the effective two-level system realized at a level crossing acts as an extended impurity coupled to the conduction electrons of the substrate by a distribution of Kondo couplings at the sites of the chain. Using auxiliary-field quantum Monte Carlo simulations, which quantitatively reproduce the field dependence of the zero-bias signal, we show that a proper Kondo resonance is present at the sites where the effective Kondo coupling dominates. Our modeling and numerical simulations provide a theoretical basis for the interpretation of the STM spectrum in terms of level crossings of the Co adatom chains.
We examine the exchange Hamiltonian for magnetic adatoms in graphene with localized inner shell states. On symmetry grounds, we predict the existence of a class of orbitals that lead to a distinct class of quantum critical points in graphene, where the Kondo temperature scales as $T_{K}propto|J-J_{c}|^{1/3}$ near the critical coupling $J_{c}$, and the local spin is effectively screened by a emph{super-ohmic} bath. For this class, the RKKY interaction decays spatially with a fast power law $sim1/R^{7}$. Away from half filling, we show that the exchange coupling in graphene can be controlled across the quantum critical region by gating. We propose that the vicinity of the Kondo quantum critical point can be directly accessed with scanning tunneling probes and gating.
The low-energy physics of a spin-1/2 Kondo impurity in a gapless host, where a density of band states $rho_0(epsilon)=|epsilon|^r/(|epsilon|^r+beta^r)$ vanishes at the Fermi level $epsilon=0$, is studied by the Bethe ansatz. The growth of the parameter $Gamma_r=beta{rm g}^{-1/r}$ (where ${rm g}$ is an exchange constant) is shown to drive the system ground state from the Kondo regime with the screened impurity spin to the Anderson regime, where the impurity spin is unscreened, however, in a weak magnetic field $H$, it exceeds its free value, $S_i(H)>{1/2}$, due to a strong coupling to a band. It is shown also that a sufficiently strong potential scattering at the impurity site destroys the Anderson regime.
Log in to be able to interact and post comments
comments
Fetching comments
Sign in to be able to follow your search criteria
