arXiv subjects

Frithjof B. Anders

Publications and source records attributed to Frithjof B. Anders.

At least 55 records · Page 3Linked to original sources

arXiv2015

Quantum transport through a molecular level: a scattering states numerical renormalisation group study

We use the scattering states numerical renormalization group (SNRG) approach to calculate the current $I(V)$ through a single molecular level coupled to a local molecular phonon. The suppression of $I$ for asymmetric junctions with increasing electron-phonon coupling, the hallmark of the Franck-Condon blockade, is discussed. We compare the SNRG currents with recently published data obtained by an iterative summation of path integrals approach (ISPI). Our results excellently agree with the ISPI currents for small and intermediate voltages. In the linear response regime $I(V)$ approaches the current calculated from the equilibrium spectral function. We also present the temperature and voltage evolution of the non-equilibrium spectral functions for a particle-hole asymmetric junction with symmetric coupling to the lead.

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arXiv2015

Influcence of the nuclear electric quadrupolar interaction on the coherence time of hole- and electron-spins confined in semiconductor quantum dots

The real-time spin dynamics and the spin noise spectra are calculated for p and n-charged quantum dots within an anisotropic central spin model extended by additional nuclear electric quadrupolar interactions (QC) and augmented by experimental data studied using identical excitation conditions. Using realistic estimates for the distribution of coupling constants including an anisotropy parameter, we show that the characteristic long time scale is of the same order for electron and hole spins strongly determined by the QC even though the analytical form of the spin decay differs significantly consistent with our measurements. The low frequency part of the electron spin noise spectrum is approximately $1/3$ smaller than those for hole spins as a consequence of the spectral sum rule and the different spectral shapes. This is confirmed by our experimental spectra measured on both types of quantum dot ensembles in the low power limit of the probe laser.

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arXiv2015

Real-time dynamics induced by quenches across the quantum critical points in gapless Fermi systems with a magnetic impurity

The energy-dependent scattering of fermions from a localized orbital at an energy-dependent rate $Γ(ε)\propto |ε|^r$ gives rise to quantum critical points (QCPs) in the pseudogap single-impurity Anderson model separating a local moment phase with an unscreened spin moment from a strong-coupling phase which slightly deviates from the screened phase of standard Kondo problem. Using the time-dependent numerical renormalization group (TD-NRG) approach we show that local dynamic properties always equilibrate towards a steady-state value even for quenches across the QCP but with systematic deviations from the thermal equilibrium depending on the distance to the critical coupling. Local non-equilibrium properties are presented for interaction quenches and hybridization quenches. We augment our numerical data by an analytical calculation that becomes exact at short times and find excellent agreement between the numerics and the analytical theory. For interaction quenches within the screened phase we find a universal function for the time-dependent local double occupancy. We trace back the discrepancy between our results and the data obtained by a time-dependent Gutzwiller variational approach to restrictions of the wave-function ansatz in the Gutzwiller theory: while the NRG ground states properly account for the formation of an extended spin moment which decouples from the system in the unscreened phase, the Gutzwiller ansatz only allows the formation of the spin moment on the local impurity orbital.

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arXiv2014

From thermal equilibrium to nonequilibrium quench dynamics: A conserving approximation for the interacting resonant level

We develop a low-order conserving approximation for the interacting resonant-level model (IRLM), and apply it to (i) thermal equilibrium, (ii) nonequilibrium steady state, and (iii) nonequilibrium quench dynamics. Thermal equilibrium is first used to carefully gauge the quality of the approximation by comparing the results with other well-studied methods, and finding good agreement for small values of the interaction. We analytically show that the power-law exponent of the renormalized level width usually derived using renormalization group approaches can also be correctly obtained in our approach in the weak interaction limit. A closed expression for the nonequilibrium steady-state current is derived and analytically and numerically evaluated. We find a negative differential conductance at large voltages, and the exponent of the power-law suppression of the steady-state current is calculated analytically at zero-temperature. The response of the system to quenches is investigated for a single-lead as well as for two-lead setup at finite voltage bias at particle-hole symmetry using a self-consistent two-times Keldysh Green function approach, and results are presented for the time-dependent current for different bias and contact interaction strength.

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arXiv2014

Conservation laws protect dynamic spin correlations from decay: Limited role of integrability in the central spin model

Mazur's inequality renders statements about persistent correlations possible. We generalize it in a convenient form applicable to any set of linearly independent constants of motion. This approach is used to show rigorously that a fraction of the initial spin correlations persists indefinitely in the isotropic central spin model unless the average coupling vanishes. The central spin model describes a major mechanism of decoherence in a large class of potential realizations of quantum bits. Thus the derived results contribute significantly to the understanding of the preservation of coherence. We will show that persisting quantum correlations are not linked to the integrability of the model, but caused by a finite operator overlap with a finite set of constants of motion.

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arXiv2014

Spatial and temporal propagation of Kondo correlations

We address the fundamental question how the spatial Kondo correlations are building up in time assuming an initially decoupled impurity spin $\vec{S}_{\rm imp}$. We investigate the time-dependent spin-correlation function $χ(\vec{r},t) = \langle \vec{S}_\mathrm{imp} \vec{s}(\vec{r}) \rangle (t)$ in the Kondo model with antiferromagnetic and ferromagnetic couplings where $ \vec{s}(\vec{r})$ denotes the spin density of the conduction electrons after switching on the Kondo coupling at time $t=0$. We present data obtained from a time-dependent numerical renormalisation group (TD-NRG) calculation. We gauge the accuracy of our two-band NRG by the spatial sum-rules of the equilibrium correlation functions and the reproduction of the analytically exactly known spin-correlation function of the decoupled Fermi sea. We find a remarkable building up of Kondo-correlation outside of the light cone defined by the Fermi velocity of the host metal. By employing a perturbative approach exact in second-order of the Kondo coupling, we connect these surprising correlations to the intrinsic spin-density entanglement of the Fermi sea. The thermal wave length supplies a cutoff scale at finite temperatures beyond which correlations are exponentially suppressed. We present data for the frequency dependent retarded spin-spin susceptibility and use the results to calculate the real-time response of a weak perturbation in linear response: within the spatial resolution no response outside of the light cone is found.

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arXiv2014

Spin noise in a quantum dot ensemble: from a quantum mechanical to a semi-classical description

Spin noise spectroscopy is a promising technique for revealing the microscopic nature of spin dephasing processes in quantum dots. We compare the spin-noise in an ensemble of singly charged quantum dots calculated by two complementary approaches. The Chebyshev polynomial expansion technique (CET) accounts for the full quantum mechanical fluctuation of the nuclear spin bath and a semi-classical approach (SCA) is based on the averaging the electron spin dynamics over all different static Overhauser field configurations. We observe a remarkable agreement between both methods in the high-frequency part of the spectra, while the low-frequency part is determined by the long time fluctuations of the Overhauser field. We find small differences in the spectra depending on the distribution of hyperfine couplings. The spin-noise spectra in strong enough magnetic fields where the nuclear dynamics is quenched calculated by two complimentary approaches are in perfect agreement.

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arXiv2014

Gate-tunable Kondo resistivity and dephasing rate in graphene studied by numerical renormalization group calculations

We investigate the resistivity and dephasing rate in the Kondo regime due to magnetic impurities in graphene with different chemial potentials ($μ$). The Kondo effect due to either carbon vacancies or magnetic adatoms in graphene is described by the single-orbital pseudo-gap asymmetric Anderson impurity model. We find that although the Anderson impurity model considered here is a mixed valence system, it can be drived into either the Kondo [$μ> μ_c$ (critical value) $>0$] or mixed valency ($μ\approx μ_c$) or empty orbital ($μ< μ_c$) regime by a gate voltage, giving rise to characteristic features in resistivity and dephasing rate in each regime. Specifically, in the case of $μ< μ_c$, the shapes of the resistivity (dephasing rate) curves for different $μ$ are nearly identical. However, as temperature decreases, they start to increase to their maxima at a lower $T/T_K$ but more rapidly [as $(T_K/T)^{3/2}$] than in normal metals [here $T$ ($T_K$) denotes the (Kondo) temperature]. As $T$ further decreases, after reaching the maximum, the dephasing rate drops more quickly than in normal metals, behaving as $(T/T_K)^3$ instead of $(T/T_K)^2$. Furthermore, the resistivity has a distinct peak above the saturation value near $T_K$. In the case of $μ> μ_c$, in contrast, the resistivity curve has an additional broad shoulder above 10$T_K$ and the dephasing rate exhibits an interesting shoulder-peak shape. In the narrow boundary region ($μ\approx μ_c$), both the resistivity and dephasing rate curves are similar to the corresponding ones in normal metals. This explains the conventional Kondo like resistivity from recent experiments on graphene with defects. The resistivity and dephasing rate are analysized in terms of the calculated $T$-dependent spectral function, correlation self-energy and renormalized impurity level.

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arXiv2013

Spin-noise in the anisotropic central spin model

Spin-noise measurements can serve as direct probe for the microscopic decoherence mechanism of an electronic spin in semiconductor quantum dots (QD).We have calculated the spin-noise spectrum in the anisotropic central spin model using a Chebyshev expansion technique which exactly accounts for the dynamics up to an arbitrary long but fixed time in a finite size system. In the isotropic case, describing QD charged with a single electron, the short-time dynamics is in good agreement with a quasi-static approximation for the thermodynamic limit. The spin-noise spectrum, however, shows strong deviations at low frequencies with a power-law behavior. In the Ising limit, applicable to QDs with heavy-hole spins, the spin-noise spectrum exhibits a threshold behavior above the Larmor frequency. In the generic anisotropic central spin model we have found a crossover from a Gaussian type of spin-noise spectrum to a more Ising-type spectrum with increasing anisotropy in a finite magnetic field. In order to make contact with experiments, we present ensemble averaged spin-noise spectra for QD ensembles charged with single electrons or holes. The Gaussian-type noise spectrum evolves to a more Lorentzian shape spectrum with increasing spread of characteristic time-scales and g-factors of the individual QDs.

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arXiv2012

Hybrid NRG-DMRG approach to real-time dynamics of quantum impurity systems

A hybrid approach to nonequilibrium dynamics of quantum impurity systems is presented. The numerical renormalization group serves as a means to generate a suitable low-energy Hamiltonian, allowing for an accurate evaluation of the real-time dynamics of the problem up to exponentially long times using primarily the time-adaptive density-matrix renormalization group. We extract the decay time of the interaction-enhanced oscillations in the interacting resonant-level model and show their quadratic divergence with the interaction strength U. Our numerical analysis is in excellent agreement with analytic predictions based on an expansion in 1/U.

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arXiv2012

Coherent control of correlated nanodevices: A hybrid time-dependent numerical renormalization-group approach to periodic switching

The time-dependent numerical renormalization-group approach (TD-NRG), originally devised for tracking the real-time dynamics of quantum-impurity systems following a single quantum quench, is extended to multiple switching events. This generalization of the TD-NRG encompasses the possibility of periodic switching, allowing for coherent control of strongly correlated systems by an external time-dependent field. To this end, we have embedded the TD-NRG in a hybrid framework that combines the outstanding capabilities of the numerical renormalization group to systematically construct the effective low-energy Hamiltonian of the system with the prowess of complementary approaches for calculating the real-time dynamics derived from this Hamiltonian. We demonstrate the power of our approach by hybridizing the TD-NRG with the Chebyshev expansion technique in order to investigate periodic switching in the interacting resonant-level model. Although the interacting model shares the same low-energy fixed point as its noninteracting counterpart, we surprisingly find the gradual emergence of damped oscillations as the interaction strength is increased. Focusing on a single quantum quench and using a strong-coupling analysis, we reveal the origin of these interaction-induced oscillations and provide an analytical estimate for their frequency. The latter agrees well with the numerical results.

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arXiv2011

Kinks in the electronic dispersion of the Hubbard model away from half filling

We study kinks in the electronic dispersion of a generic strongly correlated system by dynamic mean-field theory (DMFT). The focus is on doped systems away from particle-hole symmetry where valence fluctuations matter potentially. Three different algorithms are compared to asses their strengths and weaknesses, as well as to clearly distinguish physical features from algorithmic artifacts. Our findings extend a view previously established for half-filled systems where kinks reflect the coupling of the fermionic quasiparticles to emergent collective modes, which are identified here as spin fluctuations. Kinks are observed when strong spin fluctuations are present and, additionally, a separation of energy scales for spin and charge excitations exists. Both criteria are met by strongly correlated systems close to a Mott-insulator transition. The energies of the kinks and their doping dependence fit well to the kinks in the cuprates, which is surprising in view of the spatial correlations neglected by DMFT.

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arXiv2011

Two-channel pseudogap Kondo and Anderson models: Quantum phase transitions and non-Fermi liquids

We discuss the two-channel Kondo problem with a pseudogap density of states, $ρ(\w)\propto|\w|^r$, of the bath fermions. Combining both analytical and numerical renormalization group techniques, we characterize the impurity phases and quantum phase transitions of the relevant Kondo and Anderson models. The line of stable points, corresponding to the overscreened non-Fermi liquid behavior of the metallic $r=0$ case, is replaced by a stable particle-hole symmetric intermediate-coupling fixed point for $0 \rmax$, this non-Fermi liquid phase disappears, and instead a critical fixed point with an emergent spin--channel symmetry appears, controlling the quantum phase transition between two phases with stable spin and channel moments, respectively. We propose low-energy field theories to describe the quantum phase transitions, all being formulated in fermionic variables. We employ epsilon expansion techniques to calculate critical properties near the critical dimensions $r=0$ and $r=1$, the latter being potentially relevant for two-channel Kondo impurities in neutral graphene. We find the analytical results to be in excellent agreement with those obtained from applying Wilson's numerical renormalization group technique.

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arXiv2011

Nonequilibrium Zeeman-splitting in quantum transport through nanoscale junctions

We calculate the nonequilibrium differential conductance $G(V)$ through a quantum dot as function of bias voltage $V$ and applied magnetic field $H$. We use a Keldysh conserving approximation for weakly correlated and the scattering states numerical renormalization group for the intermediate and strongly correlated regime out of equilibrium. In the weakly correlated regime, the Zeeman splitting observable in $G(V)$ strongly depends on the asymmetry of the coupling to the two leads, as well as on particle-hole asymmetry of the quantum dot. In contrast, in the strongly correlated regime, where Kondo-correlations dominate, the position $Δ_K$ of the Zeeman-split zero-bias anomaly is independent of such asymmetries and always found to be of the order of the Zeeman energy $Δ_0$. We find a crossover from the purely spin-fluctuation driven Kondo regime at small magnetic fields with $Δ_K<Δ_0$ to a regime at large fields where the contribution of charge fluctuations induces larger splittings with $Δ_K>Δ_0$ as it was observed in recent experiments.

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arXiv2011

Comment on "Scaling feature of magnetic field induced Kondo-peak splittings"

In a recent work Zhang and coworkers (PRB 82, 075111 (2010)) studied the Zeeman splitting of the Kondo resonance for the single impurity Anderson model in a finite magnetic field $B$ with the numerical renormalization group (NRG) method. There, it was found that with increasing magnetic field $B$ the position of the Kondo resonance in the total spectral function \textit{does not} approach its position in the spin resolved spectral function. Additionally, the position of the Kondo maximum exceeded the Zeeman energy for $B/ T_K\gtrsim 5-10$, where $T_K$ is the low energy Kondo scale of the model ($g=2$, $μ_B=k_B=\hbar=1$). In this comment we argue that both these findings are produced by an improper choice of NRG parameter values. However, we reproduce the crossover in the splitting from Kondo-like behavior to a non-universal splitting larger than the Zeeman energy, but this crossover occurs at much larger fields of the order of the charge scale.

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arXiv2010

Multiple-charge transfer and trapping in DNA dimers

We investigate the charge transfer characteristics of one and two excess charges in a DNA base-pair dimer using a model Hamiltonian approach. The electron part comprises diagonal and off-diagonal Coulomb matrix elements such a correlated hopping and the bond-bond 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 super-ohmic 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 self-trapped. The transfer rate reaches its maximum when the difference of the on-site and inter-site Coulomb matrix element is equal to the reorganization energy which is the case in a GC-GC dimer. Charge transfer is completely suppressed for two excess electrons in AT-AT in an ohmic bath and replaced by damped coherent electron-pair oscillations in a super-ohmic bath. A finite bond-bond 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.

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arXiv2010

Comparison between scattering-states numerical renormalization group and the Kadanoff-Baym-Keldysh approach to quantum transport: Crossover from weak to strong correlations

The quantum transport through nanoscale junctions is governed by the charging energy $U$ of the device. We employ the recently developed scattering-states numerical renormalization group approach to open quantum systems to study nonequilibrium Green functions and current-voltage characteristics of such junctions for small and intermediate values of $U$. The reliability of the approach is established by the excellent agreement with diagrammatic Kadanoff-Baym-Keldysh results at small values of the $U$. We demonstrate the limits of the diagrammatic approaches at intermediate Coulomb repulsion. These approaches predict two different low-energy scale for magnetic and charge fluctuations in zero bias while the numerical renormalization group approach correctly yields only one single, universal scale. At large voltages and intermediate values of the Coulomb repulsion the self-consistent second Born as well as the GW approximation reproduce the SNRG spectral functions quite well for a symmetric junctions, while for the asymmetric model the voltage-dependent redistribution of spectral weight differs significantly. The second-order perturbation theory does not capture the correct single-particle dynamics at large bias and violates current conservation for asymmetric junctions.

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arXiv2009

Interplay between Kondo physics and spin-orbit coupling in carbon nanotube quantum dots

We investigate the influence of spin-orbit coupling on the Kondo effects in carbon nanotube quantum dots, using the numerical renormalization group technique. A sufficiently large spin-orbit coupling is shown to destroy the SU(4) Kondo effects at zero magnetic field, leaving only two SU(2) Kondo effects in the one- and three-electron Coulomb blockade valleys. On applying a finite magnetic field, two additional, spin-orbit induced SU(2) Kondo effects arise in the three- and two-electron valleys. Using physically realistic model parameters, we calculate the differential conductance over a range of gate voltages, temperatures and fields. The results agree well with measurements from two different experimental devices in the literature, and explain a number of observations that are not described within the standard framework of the SU(4) Anderson impurity model.

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