Challenges
Datasets
Workspaces
Papers
Discussions
Leaderboard
Log inSign up
Challenges
Datasets
Workspaces
Papers
Discussions
Leaderboard
Blog
Job Board
Q3AS

© 2026 Aqora Quantum S.A.S.

TermsPrivacyLegal Notice

arXiv:1607.03407 · Physical review. B./Physical review. B

Detecting phase transitions and crossovers in Hubbard models using the fidelity susceptibility

Li Huang, Yilin Wang, Lei Wang, Philipp Werner

Published Dec 5, 2016• 14 citations
arXivHTMLPDF

Abstract

A generalized version of the fidelity susceptibility of single-band and multiorbital Hubbard models is systematically studied using single-site dynamical mean-field theory in combination with a hybridization expansion continuous-time quantum Monte Carlo impurity solver. We find that the fidelity susceptibility is extremely sensitive to changes in the state of the system. It can be used as a numerically inexpensive tool to detect and characterize a broad range of phase transitions and crossovers in Hubbard models, including (orbital-selective) Mott metal-insulator transitions, magnetic phase transitions, high-spin to low-spin transitions, Fermi-liquid to non-Fermi-liquid crossovers, and spin-freezing crossovers.

DOI
10.1103/physrevb.94.235110

Related papers

Improved Hubbard-I approximation impurity solver for quantum impurity models

Huanhuan Qiu, Jianing Zhuang, Li Huang +2 more

We develop a fast impurity solver which is based on the combination of Hubbard-I approximation and hybridization expansion continuous-time quantum Monte Carlo algorithm. This solver inherits the advantages of both algorithms. In order to demonstrate the power and usefulness of this solver, we use it to study the magnetic phase transitions of single-band and two-band Hubbard models in the framework of single-site dynamical mean-field theory. The calculated results agree well with those obtained by hybridization expansion quantum impurity solver. It is suggested that this solver is very suitable to solve the multi-orbital quantum impurity models efficiently and can be used to study more realistic systems with magnetic long-range order in the future.

Journal of Physics Condensed Matter•Nov 6, 2018•0 citations

Benchmarkings for a semiclassical impurity solver for dynamical-mean-field theory: Self-energies and magnetic transitions of the single-orbital Hubbard model

Satoshi Okamoto, Andreas Fuhrmann, Armin Comanac +1 more

An investigation is presented of the utility of semiclassical approximations for solving the quantum-impurity problems arising in the dynamical-mean-field approach to correlated-electron models. The method is based on performing an exact numerical integral over the zero-Matsubara-frequency component of the spin part of a continuous Hubbard-Stratonovich field, along with a spin-field-dependent steepest descent treatment of the charge part. We test this method by applying it to one- or two-site approximations to the single-band Hubbard model with different band structures, and comparing the results to quantum Monte Carlo and simplified exact diagonalization calculations. The resulting electron self-energies, densities of states, and magnetic transition temperatures show reasonable agreement with the quantum Monte Carlo simulation over wide parameter ranges, suggesting that the semiclassical method is useful for obtaining a reasonable picture of the physics in situations where other techniques are too expensive.

arXiv:cond-mat/0502067•Physical Review B•Jun 24, 2005•17 citations

Intricately entangled spin and charge diffusion and the coherence-incoherence crossover in the high-dimensional Hubbard model

Gopal Prakash, Syed R. Hassan, M. S. Laad +2 more

Abstract Correlation-driven metal–insulator transitions and temperature-driven coherence–incoherence crossovers strongly influence the dynamical responses of correlated electron systems. Motivated by recent experimental probes of spin and charge excitations, we investigate the real-frequency local spin and charge dynamical susceptibilities of the one-band Hubbard model within dynamical mean-field theory (DMFT), employing numerical renormalization group (NRG) impurity solvers. We analyze both the interaction-driven transition at half filling and the temperature evolution in the doped regime proximate to the Mott insulator. To characterize low-energy relaxation processes within the local DMFT framework, we examine normalized dissipative spectra constructed from the imaginary parts of the local susceptibilities. From these spectra we extract characteristic fluctuation scales and track their evolution with interaction strength, temperature, and band filling. At half filling, the spin and charge channels exhibit qualitatively distinct low-frequency structures governed by symmetry and correlation effects. In the doped Mott regime, we find that spin and charge fluctuations reorganize on parametrically different temperature scales, signaling a separation of local coherence scales within a purely local theory. We emphasize that our analysis pertains to on-site dynamical relaxation within DMFT rather than hydrodynamic transport. Nevertheless, the distinct temperature evolution of spin and charge fluctuation scales is qualitatively consistent with multistage crossover behavior observed in transport quantities. These results highlight how local two-particle dynamics reorganize across interaction- and temperature-driven crossovers near the Mott transition.

Physica Scripta•Mar 27, 2026•0 citations

Out-of-time-ordered correlators of the Hubbard model: Sachdev-Ye-Kitaev strange metal in the spin-freezing crossover region

Naoto Tsuji, Philipp Werner

The Sachdev-Ye-Kitaev (SYK) model describes a strange metal that shows peculiar non-Fermi-liquid properties without quasiparticles. It exhibits a maximally chaotic behavior characterized by out-of-time-ordered correlators (OTOCs), and is expected to be a holographic dual to black holes. While a faithful realization of the SYK model in condensed-matter systems may be involved, a striking similarity between the SYK model and the Hund-coupling-induced spin-freezing crossover in multiorbital Hubbard models has recently been pointed out. To further explore this connection, we study OTOCs for fermionic single-orbital and multiorbital Hubbard models, which are prototypical models for strongly correlated electrons in solids. We introduce an imaginary-time four-point correlation function with an appropriate time ordering, which by means of the spectral representation and the out-of-time-order fluctuation-dissipation theorem can be analytically continued to real-time OTOCs. Based on this approach, we numerically evaluate real-time OTOCs for Hubbard models in the thermodynamic limit, using the dynamical mean-field theory in combination with a numerically exact continuous-time Monte Carlo impurity solver. The results for the single-orbital model show that a certain spin-related OTOC captures local moment formation in the vicinity of the metal-insulator transition, while the self-energy does not show SYK-type non-Fermi-liquid behavior. On the other hand, for the two- and three-orbital models with nonzero Hund coupling we find that the OTOC exhibits a rapid damping at short times and an approximate power-law decay at longer times in the spin-freezing crossover regime characterized by fluctuating local moments and a non-Fermi-liquid self-energy $\mathrm{\ensuremath{\Sigma}}(\ensuremath{\omega})\ensuremath{\sim}\sqrt{\ensuremath{\omega}}$. These results are in a good agreement with the behavior of the SYK model, providing firm evidence for the close relation between the spin-freezing crossover physics of multiorbital Hubbard models and the SYK strange metal.

arXiv:1812.04217•Physical review. B./Physical review. B•Mar 21, 2019•14 citations

Fidelity susceptibility, scaling, and universality in quantum critical phenomena

Shi-Jian Gu, Ho-Man Kwok, Wen-Qiang Ning +1 more

We study fidelity susceptibility in the one-dimensional asymmetric Hubbard model and show that the fidelity susceptibility can be used to identify the universality class of the quantum phase transitions in this model. The Kosterlitz--Thouless-type transition occurred at half-filling and the Landau transition away from half-filling can be discriminated from distinct critical exponents of the fidelity susceptibility.

arXiv:0706.2495•Physical Review B•Jun 9, 2008•211 citations

Fidelity susceptibilities in the one-dimensional extended Hubbard model

Wing Chi Yu, Shi-Jian Gu, Hai‐Qing Lin

We investigated the fidelity susceptibility in the one-dimension (1D) Hubbard model and the extended Hubbard model at half-filling via the density matrix renormalization group. From the numerical results, we argue that in the 1D Hubbard model, the fidelity susceptibility shows a divergence at two points which is infinitesimally close to the critical point while it is always extensive exactly at the critical point. For the extended Hubbard model, we found that for a properly chosen driving parameter, the fidelity susceptibility is able to reveal the quantum phase transitions between the PS (phase separation)-superconducting, superconducting-CDW (charge-density wave), CDW-SDW(spin-density wave), SDW-PS, CDW-BOW (bond-order wave), and the BOW-SDW phases.

arXiv:1408.2642•Aug 12, 2014•1 citation
A generalized version of the fidelity susceptibility of single-band and multiorbital Hubbard models is systematically studied using single-site dynamical mean-field theory in combination with a hybridization expansion continuous-time quantum Monte Carlo impurity solver. We find that the fidelity susceptibility is extremely sensitive to changes in the state of the system. It can be used as a numerically inexpensive tool to detect and characterize a broad range of phase transitions and crossovers in Hubbard models, including (orbital-selective) Mott metal-insulator transitions, magnetic phase transitions, high-spin to low-spin transitions, Fermi-liquid to non-Fermi-liquid crossovers, and spin-freezing crossovers.
We develop a fast impurity solver which is based on the combination of Hubbard-I approximation and hybridization expansion continuous-time quantum Monte Carlo algorithm. This solver inherits the advantages of both algorithms. In order to demonstrate the power and usefulness of this solver, we use it to study the magnetic phase transitions of single-band and two-band Hubbard models in the framework of single-site dynamical mean-field theory. The calculated results agree well with those obtained by hybridization expansion quantum impurity solver. It is suggested that this solver is very suitable to solve the multi-orbital quantum impurity models efficiently and can be used to study more realistic systems with magnetic long-range order in the future.
An investigation is presented of the utility of semiclassical approximations for solving the quantum-impurity problems arising in the dynamical-mean-field approach to correlated-electron models. The method is based on performing an exact numerical integral over the zero-Matsubara-frequency component of the spin part of a continuous Hubbard-Stratonovich field, along with a spin-field-dependent steepest descent treatment of the charge part. We test this method by applying it to one- or two-site approximations to the single-band Hubbard model with different band structures, and comparing the results to quantum Monte Carlo and simplified exact diagonalization calculations. The resulting electron self-energies, densities of states, and magnetic transition temperatures show reasonable agreement with the quantum Monte Carlo simulation over wide parameter ranges, suggesting that the semiclassical method is useful for obtaining a reasonable picture of the physics in situations where other techniques are too expensive.
Abstract Correlation-driven metal–insulator transitions and temperature-driven coherence–incoherence crossovers strongly influence the dynamical responses of correlated electron systems. Motivated by recent experimental probes of spin and charge excitations, we investigate the real-frequency local spin and charge dynamical susceptibilities of the one-band Hubbard model within dynamical mean-field theory (DMFT), employing numerical renormalization group (NRG) impurity solvers. We analyze both the interaction-driven transition at half filling and the temperature evolution in the doped regime proximate to the Mott insulator. To characterize low-energy relaxation processes within the local DMFT framework, we examine normalized dissipative spectra constructed from the imaginary parts of the local susceptibilities. From these spectra we extract characteristic fluctuation scales and track their evolution with interaction strength, temperature, and band filling. At half filling, the spin and charge channels exhibit qualitatively distinct low-frequency structures governed by symmetry and correlation effects. In the doped Mott regime, we find that spin and charge fluctuations reorganize on parametrically different temperature scales, signaling a separation of local coherence scales within a purely local theory. We emphasize that our analysis pertains to on-site dynamical relaxation within DMFT rather than hydrodynamic transport. Nevertheless, the distinct temperature evolution of spin and charge fluctuation scales is qualitatively consistent with multistage crossover behavior observed in transport quantities. These results highlight how local two-particle dynamics reorganize across interaction- and temperature-driven crossovers near the Mott transition.
The Sachdev-Ye-Kitaev (SYK) model describes a strange metal that shows peculiar non-Fermi-liquid properties without quasiparticles. It exhibits a maximally chaotic behavior characterized by out-of-time-ordered correlators (OTOCs), and is expected to be a holographic dual to black holes. While a faithful realization of the SYK model in condensed-matter systems may be involved, a striking similarity between the SYK model and the Hund-coupling-induced spin-freezing crossover in multiorbital Hubbard models has recently been pointed out. To further explore this connection, we study OTOCs for fermionic single-orbital and multiorbital Hubbard models, which are prototypical models for strongly correlated electrons in solids. We introduce an imaginary-time four-point correlation function with an appropriate time ordering, which by means of the spectral representation and the out-of-time-order fluctuation-dissipation theorem can be analytically continued to real-time OTOCs. Based on this approach, we numerically evaluate real-time OTOCs for Hubbard models in the thermodynamic limit, using the dynamical mean-field theory in combination with a numerically exact continuous-time Monte Carlo impurity solver. The results for the single-orbital model show that a certain spin-related OTOC captures local moment formation in the vicinity of the metal-insulator transition, while the self-energy does not show SYK-type non-Fermi-liquid behavior. On the other hand, for the two- and three-orbital models with nonzero Hund coupling we find that the OTOC exhibits a rapid damping at short times and an approximate power-law decay at longer times in the spin-freezing crossover regime characterized by fluctuating local moments and a non-Fermi-liquid self-energy $\mathrm{\ensuremath{\Sigma}}(\ensuremath{\omega})\ensuremath{\sim}\sqrt{\ensuremath{\omega}}$. These results are in a good agreement with the behavior of the SYK model, providing firm evidence for the close relation between the spin-freezing crossover physics of multiorbital Hubbard models and the SYK strange metal.
We investigated the fidelity susceptibility in the one-dimension (1D) Hubbard model and the extended Hubbard model at half-filling via the density matrix renormalization group. From the numerical results, we argue that in the 1D Hubbard model, the fidelity susceptibility shows a divergence at two points which is infinitesimally close to the critical point while it is always extensive exactly at the critical point. For the extended Hubbard model, we found that for a properly chosen driving parameter, the fidelity susceptibility is able to reveal the quantum phase transitions between the PS (phase separation)-superconducting, superconducting-CDW (charge-density wave), CDW-SDW(spin-density wave), SDW-PS, CDW-BOW (bond-order wave), and the BOW-SDW phases.