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In the present paper, we present an efficient continuous-time quantum Monte Carlo impurity solver with high acceptance rate at low temperature for multi-orbital quantum impurity models with general interaction. In this hybridization…

Strongly Correlated Electrons · Physics 2019-02-20 Changming Yue , Yilin Wang , Junya Otsuki , Xi Dai

Harmonic inversion has already been proven to be a powerful tool for the analysis of quantum spectra and the periodic orbit orbit quantization of chaotic systems. The harmonic inversion technique circumvents the convergence problems of the…

Chaotic Dynamics · Physics 2009-10-31 K. Weibert , J. Main , G. Wunner

Mixed-monotone systems are separable via a decomposition function into increasing and decreasing components, and this decomposition function allows for embedding the system dynamics in a higher-order monotone embedding system. Embedding the…

Systems and Control · Electrical Eng. & Systems 2021-03-22 Matthew Abate , Samuel Coogan

We formulate a quantum embedding algorithm in real-space for the simultaneous theoretical treatment of nonlocal electronic correlations and disorder, the coherent cellular dynamical mean-field theory (C-CDMFT). This algorithm combines the…

Strongly Correlated Electrons · Physics 2026-01-09 Patrick Tscheppe , Marcel Klett , Henri Menke , Sabine Andergassen , Niklas Enderlein , Philipp Hansmann , Thomas Schäfer

Open quantum many body systems describe a number of experimental platforms relevant for quantum simulations, ranging from arrays of superconducting circuits to ultracold atoms in optical lattices. Their theoretical understanding is hampered…

Statistical Mechanics · Physics 2021-07-28 Orazio Scarlatella , Aashish A. Clerk , Rosario Fazio , Marco Schiró

In the pursuit of accurate descriptions of strongly correlated quantum many-body systems, dynamical mean-field theory (DMFT) has been an invaluable tool for elucidating the spectral properties and quantum phases of both phenomenological…

Strongly Correlated Electrons · Physics 2019-10-07 Carlos Mejuto-Zaera , Norm M. Tubman , K. Birgitta Whaley

Accurate determination of electronic properties of correlated oxides remains a significant challenge for computational theory. Traditional Hubbard-corrected density functional theory (DFT+U) frequently encounters limitations in precisely…

Materials Science · Physics 2024-03-19 Hyeondeok Shin , Kevin Gasperich , Tomas Rojas , Anh T. Ngo , Jaron T. Krogel , Anouar Benali

We discuss the recently developed bosonic dynamical mean-field (B-DMFT) framework, which maps a bosonic lattice model onto the selfconsistent solution of a bosonic impurity model with coupling to a reservoir of normal and condensed bosons.…

Strongly Correlated Electrons · Physics 2015-05-27 Peter Anders , Emanuel Gull , Lode Pollet , Matthias Troyer , Philipp Werner

We develop a method to study quantum impurity models, small interacting quantum systems linearly coupled to an environment, in presence of an additional Markovian quantum bath, with a generic non-linear coupling to the impurity. We aim at…

Quantum Physics · Physics 2025-03-10 Orazio Scarlatella , Marco Schirò

We describe the implementation of the frozen-orbital and downfolding approximations in the auxiliary-field quantum Monte Carlo (AFQMC) method. These approaches can provide significant computational savings compared to fully correlating all…

Computational Physics · Physics 2013-11-18 Wirawan Purwanto , Shiwei Zhang , Henry Krakauer

The nuclear many-body problem for medium-mass systems is commonly addressed using wave-function expansion methods that build upon a second-quantized representation of many-body operators with respect to a chosen computational basis. While…

Nuclear Theory · Physics 2021-02-02 J. Hoppe , A. Tichai , M. Heinz , K. Hebeler , A. Schwenk

We implement an efficient numerical method to calculate response functions of complex impurities based on the Density Matrix Renormalization Group (DMRG) and use it as the impurity-solver of the Dynamical Mean Field Theory (DMFT). This…

Strongly Correlated Electrons · Physics 2017-11-27 Y. Núñez Fernández , K. Hallberg

We propose a method for computing space-resolved correlation properties of the two-dimensional Hubbard model within a quantum-classical embedding strategy that uses a Noisy, Intermediate Scale Quantum (NISQ) computer to solve the embedded…

Quantum Physics · Physics 2022-03-08 Pauline Besserve , Thomas Ayral

We develop a nonequilibrium multi-orbital extension of the two-particle self-consistent theory and apply it to the bilayer Hubbard model as a minimal platform to investigate correlation effects in the presence of interlayer interactions and…

Strongly Correlated Electrons · Physics 2025-10-16 Jiawei Yan , Jonas B. Profe , Yuta Murakami , Philipp Werner

This paper presents a novel formulation and solution of orbit determination over finite time horizons as a learning problem. We present an approach to orbit determination under very broad conditions that are satisfied for n-body problems.…

Machine Learning · Statistics 2018-03-05 Srinagesh Sharma , James W. Cutler

A simple impurity solver is shown to capture the impurity-induced superconducting subgap states in quantitative agreement with the numerical renormalization group and quantum Monte-Carlo simulations. The solver is based on the exact…

Superconductivity · Physics 2023-12-21 Virgil V. Baran , Emil J. P. Frost , Jens Paaske

Quasi-equilibrium approximation is a widely used closure approximation approach for model reduction with applications in complex fluids, materials science, etc. It is based on the maximum entropy principle and leads to thermodynamically…

Numerical Analysis · Mathematics 2021-10-19 Shan Jiang , Haijun Yu

We describe the use of coupled-cluster theory as an impurity solver in dynamical mean-field theory (DMFT) and its cluster extensions. We present numerical results at the level of coupled-cluster theory with single and double excitations…

Strongly Correlated Electrons · Physics 2019-10-01 Tianyu Zhu , Carlos A. Jimenez-Hoyos , James McClain , Timothy C. Berkelbach , Garnet Kin-Lic Chan

We present a continuous-time Monte Carlo impurity solver for multiorbital impurity models which combines a strong-coupling hybridization expansion and a weak-coupling expansion in the Hund's coupling parameter J. This double-expansion…

Strongly Correlated Electrons · Physics 2015-09-14 Karim Steiner , Yusuke Nomura , Philipp Werner

Algorithms based on non-unitary evolution have attracted much interest for ground state preparation on quantum computers. One recently proposed method makes use of ancilla qubits and controlled unitary operators to implement weak…

Quantum Physics · Physics 2025-12-25 Tobias Stollenwerk , Stuart Hadfield