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We extend the natural orbital impurity solver [PRB 90, 085102 (2014)] to finite temperatures and apply it to calculate spectral and transport properties of correlated electrons within the dynamical mean-field theory. First, we benchmark our…
Starting from exact eigenstates for a symmetric ring, we derive a low-energy effective generalized Anderson Hamiltonian which contains two spin doublets with opposite momenta and a singlet for the neutral molecule. For benzene, the singlet…
State preparation is a cornerstone of quantum technologies, underpinning applications in computation, communication, and sensing. Its importance becomes even more pronounced in non-Markovian open quantum systems, where environmental memory…
Entanglement in J_1-J_2, S=1/2 quantum spin chains with an impurity is studied using analytic methods as well as large scale numerical density matrix renormalization group methods. The entanglement is investigated in terms of the von…
We study thermalization in open quantum systems using the Lindblad formalism. A method that both thermalizes and couples to Lindblad operators only at edges of the system is introduced. Our method leads to a Gibbs state of the system,…
Non-equilibrium steady states (NESS) describe particularly simple and stationary non-equilibrium situations. A possibility to obtain such states is to consider the asymptotic evolution of two infinite heat baths brought into thermal…
We develop a nonperturbative dynamical theory (NDT) that is useful for treating nonequilibrium transport in a system with strong correlation. We apply our NDT to the single-impurity Anderson model in equilibrium to check its reliability by…
A dynamic density-matrix renormalisation group approach to the spectral properties of quantum impurity problems is presented. The method is demonstrated on the spectral density of the flat-band symmetric single-impurity Anderson model. We…
A detailed derivation of the recently proposed time-dependent numerical renormalization-group (TD-NRG) approach to nonequilibrium dynamics in quantum impurity systems is presented. We demonstrate that the method is suitable for fermionic as…
We investigate the interplay of Coulomb interactions and short-range-correlated disorder in three dimensional systems where absent disorder the non-interacting band structure hosts a quadratic band crossing. Though the clean Coulomb problem…
We resolve the controversy regarding the ground state of the parallel double quantum dot system near half filling. The numerical renormalization group (NRG) predicts an underscreened Kondo state with residual spin-1/2 magnetic moment, ln 2…
The density-matrix renormalization-group (DMRG) algorithm is extended to treat time-dependent problems. The method provides a systematic and robust tool to explore out-of-equilibrium phenomena in quantum many-body systems. We illustrate the…
High-energy completeness of quantum electrodynamics (QED) can be induced by an interacting ultraviolet fixed point of the renormalization flow. We provide evidence for the existence of two of such fixed points in the subspace spanned by the…
The research on open quantum systems is important for both quantum computing and quantum sensing. So far, we can only use the main equation to make an approximate description. The dynamics of a single Fluxonium qubit under Markovian…
Lindbladian quantum master equations (LEs) are the most popular descriptions for quantum systems weakly coupled to baths. But, recent works have established that in many situations such Markovian descriptions are fundamentally limited: they…
We consider generic interacting chain of qubits, which are coupled at the edges to baths of fixed polarizations. We can determine the nonequilibrium steady states, described by the fixed point of the Lindblad Master Equation. Under rather…
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…
We propose a new concept upon the renormalization group (RG) procedure for an interacting many-electron correlated system in the framework of natural orbitals, and formulate an algorithm for this RG approach. To demonstrate its…
We derive asymptotically exact expressions for the thermopower and figure of merit of a quantum impurity connecting two noninteracting leads in the linear response regime where the chemical potential and temperature differences between the…
Geometrically frustrated quantum impurities coupled to metallic leads have been shown to exhibit rich behavior with a quantum phase transition separating Kondo screened and local moment phases. Frustration in the quantum impurity can…