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Electrons exposed to a two-dimensional (2D) periodic potential and a uniform, perpendicular magnetic field exhibit a fractal, self-similiar energy spectrum known as the Hofstadter butterfly. Recently, related high-temperature quantum oscillations (Brown-Zak oscillations) were discovered in graphene moir\'{e} systems, whose origin lie in the repetitive occurrence of extended minibands/magnetic Bloch states at rational fractions of magnetic flux per unit cell giving rise to an increase in band conductivity. In this work, we report on the experimental observation of band conductivity oscillations in an electrostatically defined and gate-tunable graphene superlattice, which are governed both by the internal structure of the Hofstadter butterfly (Brown-Zak oscillations) and by a commensurability relation between the cyclotron radius of electrons and the superlattice period (Weiss oscillations). We obtain a complete, unified description of band conductivity oscillations in two-dimensional superlattices, yielding a detailed match between theory and experiment.

Ultrafast dynamics in chemical systems provide a unique access to fundamental processes at the molecular scale. A proper description of such systems is often very challenging because of the quantum nature of the problem. The concept of matrix product states (MPS), however, has proven its performance in describing such correlated quantum system in recent years for a wide range of applications. In this work, we continue the development of the MPS approach to study ultrafast electron dynamics in quantum chemical systems. The method combines time evolution schemes, such as fourth-order Runge-Kutta and Krylov space time evolution, with MPS, in order to solve the time-dependent Schr\"odinger equation efficiently. This allows for describing electron dynamics in molecules on a full configurational interaction (CI) level for a few femtoseconds after excitation. As a benchmark, we compare MPS based calculations to full CI calculations for a chain of hydrogen atoms and for the water molecule. Krylov space time evolution is in particular suited for the MPS approach, as it provides a wide range of opportunities to be adjusted to the reduced MPS dimension case. Finally, we apply the MPS approach to describe charge migration effects in iodoacetylene and find direct agreement between our results and experimental observations.

The competition between intra molecular charge redistribution and fragmentation has been studied in small molecules containing iodine by using intense ultrashort pulses in the extreme ultraviolet regime (XUV). We show that after an element specific inner-shell photoionization of diiodomethane (CH$_2$I$_2$) and iodomethane (CH$_3$I), the induced positive charge is redistributed with a significantly different efficiency. Therefore, we analyze ion time-of-flight data obtained from XUV-pump XUV-probe experiments at the Free Electron Laser in Hamburg (FLASH). Theoretical considerations on the basis of ab initio electronic structure calculations including correlations relate this effect to a strongly molecule specific, purely electronic charge redistribution process that takes place directly after photoionization causing a distribution of the induced positive charge predominantly on the atoms which exhibit the lowest atomic ionization potential, i.e, in the molecules considered, the iodine atom(s). As a result of the very different initial charge distributions, the fragmentation timescales of the two molecules experimentally observed are strikingly different.

We investigate theoretically charge migration following prompt double ionization of a polyatomic molecule (C$_2$H$_4$BrI) and find that for double ionization, correlation-driven charge migration appears to be particularly prominent, i.e., we observe exceptionally rich dynamics solely driven by the electron-electron interaction even in the situation when the electrons are emitted from outer-valence orbitals. These strongly correlated electron dynamics are witnessed in the theoretically determined time-resolved transient absorption cross section. Strikingly, features in the cross section can be traced back to electron hole populations and time-dependent partial charges and hence, can be interpreted with surprising ease. Remarkably, by taking advantage of element specific core-to-valence transitions, the hole population dynamics can be followed both in time and space. With this, not only do we report the high relevance of correlation-driven charge migration following double ionization but our findings also highlight the outstanding role of attosecond transient absorption spectroscopy (ATAS) as one of the most promising techniques for monitoring ultrafast electron dynamics in complex molecular systems.

The importance of multi-electron dynamics during the tunnel ionization of a correlated quantum system is investigated. By comparison of the solution of the time-dependent Schr\"odinger equation (TDSE) with the time-dependent configuration interaction singles approach (TDCIS), we demonstrate the importance of a multi-electron description of the tunnel ionization process especially for weakly confined quantum systems. Within this context, we observe that adiabatic driving by an intense light field can even enhance the correlations between still trapped electrons.

Highly symmetric magnetic environments have been suggested to stabilize the magnetic information stored in magnetic adatoms on a surface. Utilized as memory devices such systems are subjected to electron tunneling and external magnetic fields. We analyze theoretically how such perturbations affect the switching probability of a single quantum spin for two characteristic symmetries encountered in recent experiments and suggest a third one that exhibits robust protection against surface induced spin flips. Further we illuminate how the switching of an adatom spin exhibits characteristic behavior with respect to low energy excitations from which the symmetry of the system can be inferred.

Two-component mixtures in optical lattices reveal a rich variety of different phases. We employ an exact diagonalization method to obtain the relevant correlation functions in hexagonal optical lattices to characterize those phases. We relate the occupation difference of the two species to the magnetic polarization. `Iso'-magnetic correlations disclose the nature of the system, which can be of easy-axis type, bearing phase segregation, or of easy-plane type, corresponding to super-counter-fluidity. In the latter case, the correlations reveal easy-plane segregation, involving a highly-entangled state. We identify striking correlated supersolid phases appearing within the superfluid limit.

We investigate theoretically the non-linear dynamics of a coupled nanomechanical oscillator. Under a weak radio frequency excitation, the resonators can be parametrically tuned into a self-sustained oscillatory regime. The transfer of electrons from one contact to the other is then mechanically assisted, generating a rectified current. The direction of the rectified current is, in most unstable regions, determined by the phase shift between the mechanical oscillations and the signal. However, we locate intriguing parametrical regions of uni-directional rectified current, suggesting a practical scheme for the realization of a self-powered device in the nanoscale. In these regions, a dynamical symmetry breaking is induced by the non-linear coupling of the mechanical and electrical degrees of freedom. When operating within the Coulomb blockade limit, we locate bands of instability of enhanced gain., Comment: 5 pages, 4 figures

We study the non-equilibrium dynamics of a spinful single-orbital quantum dot with an incorporated quantum mechanical spin-1/2 magnetic impurity. Due to the spin degeneracy, double occupancy is allowed, and Coulomb interaction together with the exchange coupling of the magnetic impurity influence the dynamics. By extending the iterative summation of real-time path integrals (ISPI) to this coupled system, we monitor the time-dependent non-equilibrium current and the impurity spin polarization to determine features of the time-dependent non-equilibrium dynamics. We particulary focus on the deep quantum regime, where all time and energy scales are of the same order of magnitude and no small parameter is available. We observe a significant influence of the non-equilibrium decay of the impurity spin polarization both in the presence and in the absence of Coulomb interaction. The exponential relaxation is faster for larger bias voltages, electron-impurity interactions and temperatures. We show that the exact relaxation rate deviates from the corresponding perturbative result. In addition, we study in detail the impurity's back action on the charge current and find a reduction of the stationary current for increasing coupling to the impurity. Moreover, our approach allows us to systematically distinguish mean-field Coulomb and impurity effects from the influence of quantum fluctuations and flip-flop scattering, respectively. In fact, we find a local maximum of the current for a finite Coulomb interaction due to the presence of the impurity., Comment: 32 pages, 15 figures

We report on resonant optical spectroscopy of self-assembled InGaAs quantum dots in which the number of electrons can accurately be tuned to N=0,1,2 by an external gate voltage. Polarization, wave vector and magnetic field dependent measurements enable us to clearly distinguish between resonant Raman and resonant photoluminescence processes. The Raman spectra for N=1 and 2 electrons considerably differ from each other. In particular, for N=2, the quantum-dot He, the spectra exhibit both singlet and triplet transitions reflecting the elementary many-particle interaction. Also the resonant photoluminescence spectra are significantly changing by varying the number of electrons in the QDs. For N=1 we observe strong polaronic effects which are suppressed for N=2.

We study the dependency of the quantum spin dynamics on the particle number in a system of ultracold spin-1 atoms within the single-spatial-mode approximation. We find, for all strengths of the spin-dependent interaction, convergence towards the mean-field dynamics in the thermodynamic limit. The convergence is, however, particularly slow when the spin-changing collisional energy and the quadratic Zeeman energy are equal, i.e. deviations between quantum and mean-field spin dynamics may be extremely large under these conditions. Our estimates show, that quantum corrections to the mean-field dynamics may play a relevant role in experiments with spinor Bose-Einstein condensates. This is especially the case in the regime of few atoms, which may be accessible in optical lattices. Here, spin dynamics is modulated by a beat note at large magnetic fields due to the significant influence of correlated many-body spin states.

We theoretically study the excitation spectrum of confined macroscopic optical lattices in the Mott-insulating limit. For large systems, a fast numerical method is proposed to calculate the ground state filling and excitation energies. We introduce many-particle on-site energies capturing multi-band effects and discuss tunnelling on a perturbative level using an effectively restricted Hilbert space. Results for small one-dimensional lattices obtained by this method are in good agreement with the exact multi-band diagonalization of the Hamiltonian. Spectral properties associated with the formation of regions with constant filling, so-called Mott shells, are investigated and interfaces between the shells with strong particle fluctuations are characterized by gapless local excitations.

The strength of the non-adiabatic spin torque is currently under strong debate, as its value differs by orders of magnitude as well in theoretical predictions as in measurements. Here, a measurement scheme is presented that allows to determine the strength of the non-adiabatic spin torque accurately and directly. Analytical and numerical calculations show that the scheme allows to separate the displacement due to the Oersted field and is robust against uncertainties of the exact current direction.

We present numerical results for electron spin relaxation rates for single and laterally coupled double GaAs quantum dots in a perpendicular magnetic field. As source of spin relaxation we consider hyperfine interaction with the nuclear spins in the GaAs substrate. Due to the differences in the energy scales of the nuclear and electronic Zeeman energies, the phonon bath system has to be taken into account for energy dissipation. The corresponding transition rates of second order show strong dependencies on correlations between the electrons and the electronic energy differences, and hence on the magnetic field. For a highly asymmetric double dot we have found a relatively low second order electron spin relaxation rate for a wide range of magnetic fields., Comment: 14 pages, 10 figures

We theoretically investigate the enhanced localization of bosonic atoms by fermionic atoms in three-dimensional optical lattices and find a self-trapping of the bosons for attractive boson-fermion interaction. Because of this mutual interaction, the fermion orbitals are substantially squeezed, which results in a strong deformation of the effective potential for bosons. This effect is enhanced by an increasing bosonic filling factor leading to a large shift of the transition between the superfluid and the Mott-insulator phase. We find a nonlinear dependency of the critical potential depth on the boson-fermion interaction strength. The results, in general, demonstrate the important role of higher Bloch bands for the physics of attractively interacting quantum gas mixtures in optical lattices and are of direct relevance to recent experiments with 87Rb - 40K mixtures, where a large shift of the critical point has been found., Comment: 4 pages, 4 figures. Published version

Non-equilibrium transport through a quantum dot with one spin-split single-particle level is studied in the cotunneling regime at low temperatures. The Coulomb diamond can be subdivided into parts differing in at least one of two respects: what kind of tunneling processes (i) determine the single-particle occupations and (ii) mainly contribute to the current. No finite systematic perturbation expansion of the occupations and the current can be found that is valid within the entire Coulomb diamond. We therefore construct a non-systematic solution, which is physically correct and perturbative in the whole cotunneling regime, while smoothly crossing-over between the different regions. With this solution the impact of an intrinsic spin-flip relaxation on the transport is investigated. We focus on peaks in the differential conductance that mark the onset of cotunneling-mediated sequential transport. It is shown that these peaks are maximally pronounced at a relaxation roughly as fast as sequential tunneling. The approach as well as the presented results can be generalized to quantum dots with few levels., Comment: 7 pages, 3 figures

In experiments the distinction between spin-torque and Oersted-field driven magnetization dynamics is still an open problem. Here, the gyroscopic motion of current- and field-driven magnetic vortices in small thin-film elements is investigated by analytical calculations and by numerical simulations. It is found that for small harmonic excitations the vortex core performs an elliptical rotation around its equilibrium position. The global phase of the rotation and the ratio between the semi-axes are determined by the frequency and the amplitude of the Oersted field and the spin torque.

We study bosonic atoms in small optical lattices by exact diagonalization and observe a striking similarity to the superfluid to Mott insulator transition in macroscopic systems. The momentum distribution, the formation of an energy gap, and the pair correlation function show only a weak size dependence. For noncommensurate filling we reveal in deep lattices a mixture of localized and delocalized particles, which is sensitive to lattice imperfections. Breaking the lattice symmetry causes a Bose-glass-like behavior. We discuss the nature of excited states and orbital effects by using an exact diagonalization technique that includes higher bands., Comment: 8 pages, 10 figures. Published version

We present an exact analytical solution of the fundamental system of quasi-one-dimensional spin-1 bosons with infinite delta-repulsion. The eigenfunctions are constructed from the wave functions of non-interacting spinless fermions, based on Girardeau's Fermi-Bose mapping, and from the wave functions of distinguishable spins. We show that the spinor bosons behave like a compound of non-interacting spinless fermions and non-interacting distinguishable spins. This duality is especially reflected in the spin densities and the energy spectrum. We find that the momentum distribution of the eigenstates depends on the symmetry of the spin function. Furthermore, we discuss the splitting of the ground state multiplet in the regime of large but finite repulsion., Comment: Revised to discuss large but finite interactions

We study properties of two different atoms at a single optical lattice site at a heteronuclear atomic Feshbach resonance. We calculate the energy spectrum, the efficiency of rf association and the lifetime as a function of magnetic field and compare the results with the experimental data obtained for K-40 and Rb-87 [C. Ospelkaus et al., Phys. Rev. Lett. 97, 120402 (2006)]. We treat the interaction in terms of a regularized delta function pseudopotential and consider the general case of particles with different trap frequencies, where the usual approach of separating center-of-mass and relative motion fails. We develop an exact diagonalization approach to the coupling between center-of-mass and relative motion and numerically determine the spectrum of the system. At the same time, our approach allows us to treat the anharmonicity of the lattice potential exactly. Within the pseudopotential model, the center of the Feshbach resonance can be precisely determined from the experimental data., Comment: 9 pages, 7 figures, revised discussion of transfer efficiency

Using exact diagonalization we examine the response of several most prominent fractional quantum Hall states to a single local impurity. The 2/3 singlet state is found to be more inert than the polarized one in spite of its smaller incompressibility gap. Based on its spin-spin correlation functions we interpret it as a liquid of electron pairs with opposite spin. A comparison of different types of impurities, non-magnetic and magnetic, is presented., Comment: 6 pages, 9 figures, submitted to PRB

The current-induced motion of a domain wall in a semicircle nanowire with applied Zeeman field is investigated. Starting from a micromagnetic model we derive an analytical solution which characterizes the domain-wall motion as a harmonic oscillation. This solution relates the micromagnetic material parameters with the dynamical characteristics of a harmonic oscillator, i.e., domain-wall mass, resonance frequency, damping constant, and force acting on the wall. For wires with strong curvature the dipole moment of the wall as well as its geometry influence the eigenmodes of the oscillator. Based on these results we suggest experiments for the determination of material parameters which otherwise are difficult to access. Numerical calculations confirm our analytical solution and show its limitations.

We study ground state properties of spinless, quasi one-dimensional bosons which are confined in a harmonic trap and interact via repulsive delta-potentials. We use the exact diagonalization method to analyze the pair correlation function, as well as the density, the momentum distribution, different contributions to the energy and the population of single-particle orbitals in the whole interaction regime. In particular, we are able to trace the fascinating transition from bosonic to fermi-like behavior in characteristic features of the momentum distribution which is accessible to experiments. Our calculations yield quantitative measures for the interaction strength limiting the mean-field regime on one side and the Tonks-Girardeau regime on the other side of an intermediate regime., Comment: 5 pages, 5 figures

We study electron transport through double quantum dots in series. The tunnel coupling of the discrete dot levels to external leads causes a shift of their energy. This energy renormalization affects the transport characteristics even in the limit of weak dot-lead coupling, when sequential transport dominates. We propose an experimental setup which reveals the renormalization effects in either the current-voltage characteristics or in the stability diagram.

We study the spectrum and the transport properties of two identical, vertically coupled quantum dots in a perpendicular magnetic field. We find correlation-induced energy crossings in a magnetic field sweep between states differing only in the vertical degree of freedom. Considering the influence of a slight asymmetry between the dots caused by the applied source-drain voltage in vertical transport experiments these crossings convert to anticrossings accompanied by the build-up of charge polarization which is tunable by the perpendicular magnetic field. The polarization strongly affects the vertical transport through the double quantum dot and is manifest in an isospin blockade and the appearance of negative differential conductances in the magnetic field range where the charge localization occurs.

The elementary low energy excitations in the fractional quantum Hall (FQH) regime are known to be fractionally charged quasiparticles and quasiholes. This work focusses on quasiholes in a finite system of a few electrons treated by exact numerical diagonalization. Recent experimental [Chung et al., PRB 67, 201104 (2003)] and theoretical [Kane, Fisher, PRB 67, 045307 (2003)] work on quantum point contacts in the FQH regime showed strong evidence for single quasiparticle tunneling to be forbidden at low temperature. We want to gain insight into such constricted FQH systems by a numerical approach. Initially the basics of numerically treating a system in rectangular geometry and procedures to insert a quasihole excitation are presented. The excitations' stability and fractional charge is confirmed for different interactions. The question of quasihole tunneling is approached in two different systems: 1. A system posessing bound, localized states of a quasihole shows evidence for tunnel coupling between these states to exist. 2. Different potential forms to model a quantum point contact are investigated and the injection of a single quasihole near the constriction is surveyed in the system's time evolution., Comment: 92 pages, 72 ps-figures

Charge localization seems unlikely to occur in two vertically coupled symmetric quantum dots even if a small bias voltage breaks the exact isospin-symmetry of the system. However for a three-electron double quantum dot we find a strong localization of charges at certain vertically applied magnetic fields. The charge localization is directly connected to new ground state transitions between eigenstates differing only in parity. The transitions are driven by magnetic field dependent Coulomb correlations between the electrons and give rise to strong isospin blockade signatures in transport through the double dot system., Comment: 10 pages, 4 figures

The influence of the tip-substrate bias induced electric field in a scanning-tunneling-spectroscopy experiment on charged InAs nanocrystals is studied. Calculating the ground and first excited many-particle state for five electrons occupying the quantum dot reveals a Stark-induced reordering of states by increasing the electric field strength. It is shown that this reordering of states is accompanied by a symmetry change of the local density of states (LDOS), which in principal is observable in a wave-function mapping experiment. Since in the usually performed experiments the electric field can not be directly controlled, we investigate the crystal size dependence of the 5-electron LDOS symmetry. It is found that the symmetry changes from spherical to torus-like by increasing the nanocrystal radius., Comment: 8 pages, 6 figures, LaTeX, iopart, in proceedings of the 26th ICPS

The influence of the tip-substrate bias induced electrical field in a scanning tunneling spectroscopy experiment on colloidal InAs nanocrystals has been studied. Calculating the Stark induced splitting of the degenerate 1P_e state perturbatively within a particle-in-a-sphere model, revealed a possible explanation of recently published experimental wave function mapping data by Millo et al. (Ref. 1)., Comment: 4 pages, including 5 figures

The role of electronic interactions in the level structure of semiconductor quantum dots is analyzed in terms of the correspondence to the integrability of a classical system that models these structures. We find that an otherwise simple system is made strongly non-integrable in the classical regime by the introduction of particle interactions. In particular we present a two-particle classical system contained in a $d$-dimensional billiard with hard walls. Similarly, a corresponding two-dimensional quantum dot problem with three particles is shown to have interesting spectral properties as function of the interaction strength and applied magnetic fields., Comment: Proceed of Dresden Conf on Mesoscopic Systems

We consider the influence of an external periodic potential on the fractional quantum Hall effect of two-dimensional interacting electron systems. For many electrons on a torus, we find that the splitting of incompressible ground state degeneracies by a weak external potential diminishes as $\exp ( - L/ \xi)$ at large system size $L$. We present numerical results consistent with a scenario in which $\xi$ diverges at continuous phase transitions from fractional to integer quantum Hall states which occur with increasing external potential strength., Comment: 4 pages, REVTeX, 3 epsf-embedded color postscript figures, submitted to PRB (Rapid Comm.), added reference in revised version

We calculate the energy spectrum of an electron moving in a two-dimensional lattice which is defined by an electric potential and an applied perpendicular magnetic field modulated by a periodic surface magnetization. The spatial direction of this magnetization introduces complex phases into the Fourier coefficients of the magnetic field. We investigate the effect of the relative phases between electric and magnetic modulation on band width and internal structure of the Landau levels., Comment: 5 LaTeX pages with one gif figure to appear in Phys. Rev. B

Tunneling of electrons traversing a few-electron quantum dot is strongly influenced by the Coulomb interaction leading to Coulomb blockade effects and single-electron tunneling. We present calculations which demonstrate that correlations between the electrons cause a strong suppression of most of the energetically allowed tunneling processes involving excited dot states. The excitation of center-of-mass modes, in contrast, is unaffected by the Coulomb interaction. Therefore, channels connected to these modes dominate the excitation spectra in transport measurements., Comment: REVTEX manuscript with 3 Figures included in uu file. Published in Phys. Rev. Lett. 74, 1194--1197 (1995)