Publications (80)242.61 Total impact
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ABSTRACT: We examine the quality of the local selfenergy approximation, applied here to models of multiple quantum impurities coupled to an electronic bath. The local selfenergy is obtained by solving a singleimpurity Anderson model in an effective medium that is determined selfconsistently, similar to the dynamical meanfield theory (DMFT) for correlated lattice systems. By comparing to exact results obtained using the numerical renormalization group, we determine situations where " impurityDMFT " is able to capture the physics of highly inhomogeneous systems, and those cases where it fails. For two magnetic impurities separated in realspace, the onset of the dilute limit is captured, but RKKYdominated interimpurity singlet formation cannot be described. For parallel quantum dot devices, impurityDMFT succeeds in capturing underscreened Kondo physics by selfconsistent generation of a critical pseudogapped effective medium. However, the quantum phase transition between highand lowspin states on tuning interdot coupling cannot be described.  [Show abstract] [Hide abstract]
ABSTRACT: Quantum criticality in systems of local moments interacting with itinerant electrons has become an important and diverse field of research. Here we review recent results which concern (a) quantum phase transitions in singleimpurity Kondo and Anderson models and (b) quantum phase transitions in heavyfermion lattice models which involve critical quasiparticles. For (a) the focus will be on impurity models with a pseudogapped host density of states and their applications, e.g., in graphene and other Dirac materials, while (b) is devoted to strongcoupling behavior near antiferromagnetic quantum phase transitions, with potential applications in a variety of heavyfermion metals.  [Show abstract] [Hide abstract]
ABSTRACT: We revisit the physics of a Kondo impurity coupled to a fermionic host with a diverging powerlaw density of states near the Fermi level, $\rho(\omega) \sim \omega^r$, with exponent 1<r<0. Using the analytical understanding of several fixed points, based partially on powerful mappings between models with bath exponents r and (r), combined with accurate numerical renormalization group calculations, we determine thermodynamic quantities within the stable phases, and also near the various quantum phase transitions. Antiferromagnetic Kondo coupling leads to strong screening with a negative zerotemperature impurity entropy, while ferromagnetic Kondo coupling can induce a stable fractional spin moment. We formulate the quantum field theories for all critical fixed points of the problem, which are fermionic in nature and allow for a perturbative renormalizationgroup treatment.  [Show abstract] [Hide abstract]
ABSTRACT: The Numerical Renormalization Group is used to solve quantum impurity problems, which describe magnetic impurities in metals, nanodevices, and correlated materials within DMFT. Here we present a conceptually and technically simple generalization of the Wilson Chain, avoiding the exponential scaling of complexity with the number of channels/bands. The method is applied to calculate the tmatrix of the threechannel Kondo model at T=0, which shows universal crossovers in the vicinity of nonFermi liquid critical points. A nonintegrable threeimpurity problem with three bands is also studied, revealing a rich phase diagram and novel screening/overscreening mechanisms.  [Show abstract] [Hide abstract]
ABSTRACT: In recent years the numerical renormalization group (NRG) method has been extended to the calculation of dynamic response functions and transport properties of magnetic impurity models. The approach can now be applied more widely to lattice models of strongly correlated electron systems by the use of dynamical mean field theory (DMFT), in which the lattice problem is transformed into one for an effective impurity with an additional selfconsistency constraint. We review these developments and assess the potential for further applications of this approach. We also discuss an alternative approach to renormalization, renormalized perturbation theory, in which the leading asymptotically exact results for the low temperature regime for a number of magnetic impurity models can be obtained within finite order perturbation theory.  [Show abstract] [Hide abstract]
ABSTRACT: The existence of a length scale ξK∼1/TK (with TK the Kondo temperature) has long been predicted in quantum impurity systems. At low temperatures T TK, the standard interpretation is that a spin12 impurity is screened by a surrounding "Kondo cloud" of spatial extent ξK. We argue that renormalization group (RG) flow between any two fixed points (FPs) results in a characteristic length scale, observed in real space as a crossover between physical behavior typical of each FP. In the simplest example of the Anderson impurity model, three FPs arise, and we show that "free orbital," "local moment," and "strong coupling" regions of space can be identified at zero temperature. These regions are separated by two crossover length scales ξLM and ξK, with the latter diverging as the Kondo effect is destroyed on increasing temperature through TK. One implication is that moment formation occurs inside the "Kondo cloud", while the screening process itself occurs on flowing to the strong coupling FP at distances ∼ξK. Generic aspects of the realspace physics are exemplified by the twochannel Kondo model, where ξK now separates local moment and overscreening clouds.  [Show abstract] [Hide abstract]
ABSTRACT: The bosonic singleimpurity Anderson model (BSIAM) is studied to understand the local dynamics of an atomic quantum dot (AQD) coupled to a BoseEinstein condensation (BEC) state, which can be implemented to probe the entanglement and the decoherence of a macroscopic condensate. Our recent approach of the numerical renormalizationgroup calculation for the BSIAM revealed a zerotemperature phase diagram, where a Mott phase with local depletion of normal particles is separated from a BEC phase with enhanced density of the condensate. As an extension of the previous work, we present the calculations of the local dynamical quantities of the BSIAM which reinforce our understanding of the physics in the Mott and the BEC phases. 
Article: Gatecontrolled Kondo screening in graphene: Quantum criticality and electronhole asymmetry
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ABSTRACT: Magnetic impurities in neutral graphene provide a realization of the pseudogap Kondo model, which displays a quantum phase transition between phases with screened and unscreened impurity moment. Here, we present a detailed study of the pseudogap Kondo model with finite chemical potential μ. While carrier doping restores conventional Kondo screening at lowest energies, properties of the quantum critical fixed point turn out to influence the behavior over a large parameter range. Most importantly, the Kondo temperature TK shows an extreme asymmetry between electron and hole doping. At criticality, depending on the sign of μ, TK follows either the scaling prediction TK∝μ with a universal prefactor, or TK∝μx with x≈2.6. This asymmetry between electron and hole doping extends well outside the quantum critical regime and also implies a qualitative difference in the shape of the tunneling spectra for both signs of μ.  [Show abstract] [Hide abstract]
ABSTRACT: The bosonic singleimpurity Anderson model (BSIAM) is studied to understand the local dynamics of an atomic quantum dot (AQD) coupled to a BoseEinstein condensation (BEC) state, which can be implemented to probe the entanglement and the decoherence of a macroscopic condensate. Our recent approach of the numerical renormalization group (NRG) calculation for the BSIAM revealed a zerotemperature phase diagram, where a Mott phase with local depletion of normal particles is separated from a BEC phase with enhanced density of the condensate. As an extension of the previous work, we present the calculations of the local dynamical quantities of the BSIAM which reinforce our understanding of the physics in the Mott and the BEC phases.  [Show abstract] [Hide abstract]
ABSTRACT: . When a system of correlated electrons is embedded in a dissipative environment, new emergent phenomena might occur due to the interplay of correlation and dissipation. Here we focus on quantum impurity systems with coupling to a bosonic bath. For the theoretical investigation we introduce the bosonic numerical renormalization group method which has been initially set up for the spinboson model. The role of both correlations and dissipation is described in the context of twoelectron transfer systems. We also discuss prospects for the investigation of lattice models of correlated electrons with coupling to a dissipative bath.  [Show abstract] [Hide abstract]
ABSTRACT: We investigate the charge transfer characteristics of one and two excess charges in a DNA basepair dimer using a model Hamiltonian approach. The electron part comprises diagonal and offdiagonal Coulomb matrix elements such a correlated hopping and the bondbond interaction, which were recently calculated by Starikov [E. B. Starikov, Phil. Mag. Lett. {\bf 83}, 699 (2003)] for different DNA dimers. The electronic degrees of freedom are coupled to an ohmic or a superohmic bath serving as dissipative environment. We employ the numerical renormalization group method in the nuclear tunneling regime and compare the results to Marcus theory for the thermal activation regime. For realistic parameters, the rate that at least one charge is transferred from the donor to the acceptor in the subspace of two excess electrons significantly exceeds the rate in the single charge sector. Moreover, the dynamics is strongly influenced by the Coulomb matrix elements. We find sequential and pair transfer as well as a regime where both charges remain selftrapped. The transfer rate reaches its maximum when the difference of the onsite and intersite Coulomb matrix element is equal to the reorganization energy which is the case in a GCGC dimer. Charge transfer is completely suppressed for two excess electrons in ATAT in an ohmic bath and replaced by damped coherent electronpair oscillations in a superohmic bath. A finite bondbond interaction $W$ alters the transfer rate: it increases as function of $W$ when the effective Coulomb repulsion exceeds the reorganization energy (inverted regime) and decreases for smaller Coulomb repulsion.  [Show abstract] [Hide abstract]
ABSTRACT: We discuss a particular source of error in the Numerical Renormalization Group (NRG) method for quantum impurity problems, which is related to a renormalization of impurity parameters due to the bath propagator. At any step of the NRG calculation, this renormalization is only partially taken into account, leading to systematic variation of the impurity parameters along the flow. This effect can cause qualitatively incorrect results when studying quantum critical phenomena, as it leads to an implicit variation of the phase transition's control parameter as function of the temperature and thus to an unphysical temperature dependence of the orderparameter mass. We demonstrate the massflow effect for bosonic impurity models with a power law bath spectrum, J(w) ~ w^s, namely the dissipative harmonic oscillator and the spinboson model. We propose an extension of the NRG to correct the massflow error. Using this, we find unambiguous signatures of a Gaussian critical fixed point in the spinboson model for s<1/2, consistent with meanfield behavior as expected from quantumtoclassical mapping. Comment: 13 pages, 11 figs 
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ABSTRACT: A continuous time cluster algorithm for twolevel systems coupled to a dissipative bosonic bath is presented and applied to the subOhmic spinboson model. When the power s of the spectral function Jomega proportional, variant omegas is smaller than 1/2, the critical exponents are found to be classical, meanfield like. Potential sources for the discrepancy with recent renormalization group predictions are traced back to the effect of a dangerously irrelevant variable.  [Show abstract] [Hide abstract]
ABSTRACT: We investigate nonequilibrium twoelectron transfer in a model redox system represented by a twosite extended Hubbard model and embedded in a dissipative environment. The influence of the electronelectron interactions and the coupling to a dissipative bosonic bath on the electron transfer is studied in different temperature regimes. At high temperatures, Marcus transfer rates are evaluated, and at low temperatures, we calculate equilibrium and nonequilibrium population probabilities of the donor and acceptor with the nonperturbative numerical renormalization group approach. We obtain the nonequilibrium dynamics of the system prepared in an initial state of two electrons at the donor site and identify conditions under which the electron transfer involves one concerted twoelectron step or two sequential singleelectron steps. The rates of the sequential transfer depend nonmonotonically on the difference between the intersite and onsite Coulomb interaction, which become renormalized in the presence of the bosonic bath. If this difference is much larger than the hopping matrix element, the temperature as well as the reorganization energy, simultaneous transfer of both electrons between donor and acceptor can be observed.  [Show abstract] [Hide abstract]
ABSTRACT: We use the numerical renormalization group method (NRG) to investigate a singleimpurity Anderson model with a coupling of the impurity to a superconducting host. Analysis of the energy flow shows, in contrast to previous belief, that NRG iterations can be performed up to a large number of sites, corresponding to energy differences far below the superconducting gap. This allows us to calculate the impurity spectral function very accurately for frequencies near the gap edge, and to resolve, in a certain parameter regime, sharp peaks in the spectral function close to the gap edge. 
Article: Dissipative TwoElectron Transfer
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ABSTRACT: We investigate nonequilibrium twoelectron transfer in a model redox system represented by a twosite extended Hubbard model and embedded in a dissipative environment. The influence of the electronelectron interactions and the coupling to a dissipative bosonic bath on the electron transfer is studied in different temperature regimes. At high temperatures Marcus transfer rates are evaluated and at low temperatures, we calculate equilibrium and nonequilibrium population probabilities of the donor and acceptor with the nonperturbative Numerical Renormalization Group approach. We obtain the nonequilibrium dynamics of the system prepared in an initial state of two electrons at the donor site and identify conditions under which the electron transfer involves one concerted twoelectron step or two sequential singleelectron steps. The rates of the sequential transfer depend nonmonotonically on the difference between the intersite and onsite Coulomb interaction which become renormalized in the presence of the bosonic bath. If this difference is much larger than the hopping matrix element, the temperature as well as the reorganization energy, simultaneous transfer of both electrons between donor and acceptor can be observed.  [Show abstract] [Hide abstract]
ABSTRACT: Electron transfer processes play a central role in many chemical and biological systems. Already the transfer of a single electron from the donor to the acceptor can be viewed as a complicated manybody problem, due to the coupling of the electron to the infinitely many environmental degrees of freedom, realized by density fluctuations of the solvent or molecular vibrations of the protein matrix. We focus on the quantum mechanical modelling of twoelectron transfer processes whose dynamics is governed by the Coulomb interaction between the electrons as well as the environmental degrees of freedoms represented by a bosonic bath. We identify the regime of parameters in which concerted transfer of the two electrons occurs and discuss the influence of the Coulomb repulsion and the coupling strength to the environment on the electron transfer rate. Calculations are performed using the nonperturbative numerical renormalization group approach for both equilibrium and nonequilibrium properties.  [Show abstract] [Hide abstract]
ABSTRACT: We address the quantum transition of a spin1/2 antiferromagnetic Kondo lattice model with an easyaxis anisotropy using the extended dynamical mean field theory. We derive results in real frequency by using the bosonic numerical renormalization group (BNRG) method and compare them with quantum Monte Carlo results in Matsubara frequency. The BNRG results show a logarithmic divergence in the critical local spin susceptibility, signaling a destruction of Kondo screening. The T=0 transition is consistent with being second order. The BNRG results also display some subtle features; we identify their origin and suggest means for further microscopic studies.  [Show abstract] [Hide abstract]
ABSTRACT: We systematically study the influence of ferromagnetic leads on the Kondo resonance in a quantum dot tuned to the local moment regime. We employ Wilson's numerical renormalization group method, extended to handle leads with a spin asymmetric density of states, to identify the effects of (i) a finite spin polarization in the leads (at the Fermisurface), (ii) a Stoner splitting in the bands (governed by the band edges) and (iii) an arbitrary shape of the leads density of states. For a generic lead density of states the quantum dot favors being occupied by a particular spinspecies due to exchange interaction with ferromagnetic leads leading to a suppression and splitting of the Kondo resonance. The application of a magnetic field can compensate this asymmetry restoring the Kondo effect. We study both the gatevoltage dependence (for a fixed band structure in the leads) and the spin polarization dependence (for fixed gate voltage) of this compensation field for various types of bands. Interestingly, we find that the full recovery of the Kondo resonance of a quantum dot in presence of leads with an energy dependent density of states is not only possible by an appropriately tuned external magnetic field but also via an appropriately tuned gate voltage. For flat bands simple formulas for the splitting of the local level as a function of the spin polarization and gate voltage are given.
Publication Stats
3k  Citations  
242.61  Total Impact Points  
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Institutions

20092015

University of Cologne
 Institute for Theoretical Physics
Köln, North RhineWestphalia, Germany


19992012

Universität Augsburg
 Institute of Physics
Augsberg, Bavaria, Germany 
Max Planck Institute of Physics
München, Bavaria, Germany


2006

Renmin University of China
 Department of Physics
Peping, Beijing, China


1997

Imperial College London
 Department of Mathematics
Londinium, England, United Kingdom


19941995

Universität Regensburg
 Intitute of Theoretical Physics
Ratisbon, Bavaria, Germany
