We present a complementary experimental and theoretical investigation of relaxation dynamics in the charge-density-wave (CDW) system TbTe$_3$ after ultrafast optical excitation. Using time- and angle-resolved photoemission spectroscopy, we observe an
unusual transient modulation of the relaxation rates of excited photocarriers. A detailed analysis of the electron self-energy based on a nonequilibrium Greens function formalism reveals that the phase space of electron-electron scattering is critically modulated by the photoinduced collective CDW excitation, providing an intuitive microscopic understanding of the observed dynamics.
Staring from the kicked rotator as a paradigm for a system exhibiting classical chaos, we discuss the role of quantum coherence resulting in dynamical localization in the kicked quantum rotator. In this context, the disorder-induced Anderson localiza
tion is also discussed. Localization in interacting, quantum many-body systems (many-body localization) may also occur in the absence of disorder, and a practical way to identify its occurrence is demonstrated for an interacting spin chain.
In contrast to the Hubbard model, the extended Hubbard model, which additionally accounts for non-local interactions, lacks systemic studies of thermodynamic properties especially across the metal-insulator transition. Using a variational principle,
we perform such a systematic study and describe how non-local interactions screen local correlations differently in the Fermi-liquid and in the insulator. The thermodynamics reveal that non-local interactions are at least in parts responsible for first-order metal-insulator transitions in real materials.
Many-body localization (MBL) is an emergent phase in correlated quantum systems with promis- ing applications, particularly in quantum information. Here, we unveil the existence and analyse this phase in a chiral multiferroic model system. Convention
ally, MBL occurrence is traced via level statistics by implementing a standard finite-size scaling procedure. Here, we present an approach based on the full distribution of the ratio of adjacent energy spacings. We find a strong broadening of the histograms of counts of these level spacings directly at the transition point from MBL to the ergodic phase. The broadening signals reliably the transition point without relying on an averaging procedure. The fast convergence of the histograms even for relatively small systems allows moni- toring the MBL dynamics with much less computational effort. Numerical results are presented for a chiral spin chain with a dynamical Dzyaloshinskii Moriya (DM) interaction, an established model to describe the spin excitations in a single phase spin-driven multiferroic system. The multiferroic MBL phase is uncovered and it is shown how to steer it via electric fields.
Nanostructures with open shell transition metal or molecular constituents host often strong electronic correlations and are highly sensitive to atomistic material details. This tutorial review discusses method developments and applications of theoret
ical approaches for the realistic description of the electronic and magnetic properties of nanostructures with correlated electrons. First, the implementation of a flexible interface between density functional theory and a variant of dynamical mean field theory (DMFT) highly suitable for the simulation of complex correlated structures is explained and illustrated. On the DMFT side, this interface is largely based on recent developments of quantum Monte Carlo and exact diagonalization techniques allowing for efficient descriptions of general four fermion Coulomb interactions, reduced symmetries and spin-orbit coupling, which are explained here. With the examples of the Cr (001) surfaces, magnetic adatoms, and molecular systems it is shown how the interplay of Hubbard U and Hunds J determines charge and spin fluctuations and how these interactions drive different sorts of correlation effects in nanosystems. Non-local interactions and correlations present a particular challenge for the theory of low dimensional systems. We present our method developments addressing these two challenges, i.e., advancements of the dynamical vertex approximation and a combination of the constrained random phase approximation with continuum medium theories. We demonstrate how non-local interaction and correlation phenomena are controlled not only by dimensionality but also by coupling to the environment which is typically important for determining the physics of nanosystems.
While the Hubbard model is the standard model to study Mott metal-insulator transitions, it is still unclear to which extent it can describe metal-insulator transitions in real solids, where non-local Coulomb interactions are always present. By using
a variational principle, we clarify this issue for short- and long-ranged non-local Coulomb interactions for half-filled systems on bipartite lattices. We find that repulsive non-local interactions generally stabilize the Fermi-liquid regime. The metal-insulator phase boundary is shifted to larger interaction strengths to leading order linearly with non-local interactions. Importantly, non-local interactions can raise the order of the metal-insulator transition. We present a detailed analysis of how the dimension and geometry of the lattice as well as the temperature determine the critical non-local interaction leading to a first-order transition: for systems in more than two dimensions with non-zero density of states at the Fermi energy the critical non-local interaction is arbitrarily small; otherwise it is finite.
Recent experimental progress in creating and controlling singular electron beams that carry orbital angular momentum allows for new types of local spectroscopies. We theoretically investigate the twisted-electron energy loss spectroscopy (EELS) from
the C60 fullerene. Of particular interest are the strong multipolar collective excitations and their selective response to the orbital angular momentum of the impinging electron beam. Based on ab-initio calculations for the collective response we compute EELS signals with twisted electron beams and uncover the interplay between the plasmon polarity and the amount of angular momentum transfer.
We investigate the Peierls-Feynman-Bogoliubov variational principle to map Hubbard models with nonlocal interactions to effective models with only local interactions. We study the renormalization of the local interaction induced by nearest-neighbor i
nteraction and assess the quality of the effective Hubbard models in reproducing observables of the corresponding extended Hubbard models. We compare the renormalization of the local interactions as obtained from numerically exact determinant Quantum Monte Carlo to approximate but more generally applicable calculations using dual boson, dynamical mean field theory, and the random phase approximation. These more approximate approaches are crucial for any application with real materials in mind. Furthermore, we use the dual boson method to calculate observables of the extended Hubbard models directly and benchmark these against determinant Quantum Monte Carlo simulations of the effective Hubbard model.
