Half-filled One-dimensional Extended Hubbard Model Research Articles

Glassy dynamics of the one-dimensional Mott insulator excited by a strong terahertz pulse

The elucidation of nonequilibrium states in strongly correlated systems holds the key to emergence of novel quantum phases. The nonequilibrium-induced insulator-to-metal transition is particularly interesting since it reflects the fundamental nature of competition between itinerancy and localization of the charge degrees of freedom. We investigate pulse-excited insulator-to-metal transition of the half-filled one-dimensional extended Hubbard model. Calculating the time-dependent optical conductivity with the time-dependent density-matrix renormalization group, we find that strong mono- and half-cycle pulses inducing quantum tunneling strongly suppress spectral weights contributing to the Drude weight σD, even if we introduce a large number of carriers Δnd. This is in contrast to a metallic behavior of σD∝Δnd induced by photon absorption and chemical doping. The strong suppression of σD in quantum tunneling is a result of the emergence of the Hilbert-space fragmentation, which makes pulse-excited states glassy.Received 9 February 2022Revised 15 May 2022Accepted 18 July 2022DOI:https://doi.org/10.1103/PhysRevResearch.4.L032019Published by the American Physical Society under the terms of the Creative Commons Attribution 4.0 International license. Further distribution of this work must maintain attribution to the author(s) and the published article's title, journal citation, and DOI.Published by the American Physical SocietyPhysics Subject Headings (PhySH)Research AreasLocalizationNonequilibrium statistical mechanicsOptical conductivityPhotoinduced effectQuantum statistical mechanicsPhysical Systems1-dimensional systemsGlassy systemsMott insulatorsCondensed Matter, Materials & Applied PhysicsStatistical PhysicsQuantum Information

Theoretical investigation of four-body interaction in the one-dimensional extended Hubbard model

In the weak-coupling regime, we analytically investigate phase diagram of a one-dimensional half-filled extended Hubbard model with nearest neighboring four-electron interaction (Q), in addition to the usual two-electron couplings (U,V>0). The additional four-electron coupling splits independent Gaussian and spin-gap transitions and also leads to the charge-gap transition. For the positive Q, the ground state exhibits three insulating phases, charge-density-wave (CDW), spin-density-wave (SDW) and bond-spin-density-wave (BSDW). For the negative Q, the phase diagram consists of five phases, which, besides the SDW and CDW phases, contain bond-charge-density-wave (BCDW), Luttinger liquid (LL) and Luther–Emery (LE) phases.

Characterization of photoexcited states in the half-filled one-dimensional extended Hubbard model assisted by machine learning

Photoinduced nonequilibrium states can provide new insight into dynamical properties of strongly correlated electron systems. One of the typical and extensively studied systems is the half-filled one-dimensional extended Hubbard model (1DEHM). Here, we propose that the supervised machine learning (ML) can provide useful information for characterizing photoexcited states in 1DEHM. Using entanglement spectra as a training dataset, we construct neural network. Judging from the trained network, we find that bond-spin-density wave (BSDW) order can be enhanced in photoexcited states if the frequency of a driving pulse nearly resonates with gap. We separately calculate the time evolution of local and non-local order parameters and confirm that the correlation functions of BSDW are actually enhanced by photoexcitation as predicted by ML. The successful prediction of BSDW demonstrates the advantage of ML to assist characterizing photoexcited quantum states.

Photoinduced enhancement of bond order in the one-dimensional extended Hubbard model

We investigate the real-time dynamics of the half-filled one-dimensional extended Hubbard model in the strong-coupling regime, when driven by a transient laser pulse. Starting from a wide regime displaying a charge-density wave in equilibrium, a robust photoinduced in-gap state appears in the optical conductivity, depending on the parameters of the pulse. Here, by tuning its conditions, we maximize the overlap of the time-evolving wavefunction with excited states displaying the elusive bond-ordered wave of this model. Finally, we make a clear connection between the emergence of this order and the formation of the aforementioned in-gap state, suggesting the potential observation of purely electronic (i.e., not associated with a Peierls instability) bond-ordered waves in experiments involving molecular crystals.

Machine Learning Phase Diagram in the Half-filled One-dimensional Extended Hubbard Model

We demonstrate that supervised machine learning (ML) with entanglement spectrum can give useful information for constructing phase diagram in the half-filled one-dimensional extended Hubbard model. Combining ML with infinite-size density-matrix renormalization group, we confirm that bond-order-wave phase remains stable in the thermodynamic limit.

Numerical method to compute optical conductivity based on pump-probe simulations

A numerical method to calculate optical conductivity based on a pump-probe setup is presented. Its validity and limits are tested and demonstrated via the concrete numerical simulations on the half-filled one-dimensional extended Hubbard model both in equilibrium and out of equilibrium. By employing either a step- or a Gaussian-like probing vector potential, it is found that in nonequilibrium, the method in the narrow-probe-pulse limit can be identified with variant types of linear response theory, which, in equilibrium, produce identical results. The observation reveals the underlying probe-pulse dependence of the optical conductivity calculations in nonequilibrium, which may have its applications in the theoretical analysis of ultrafast spectroscopy measurements.

Direct evidence of the BOW and TS states in the half-filled one-dimensional extended Hubbard model

Taking periodic boundary condition into account, we study the quantum phase diagram of the half-filled one-dimensional extended Hubbard model using the density matrix renormalization group (DMRG) approach. The entanglement entropy clarifies the controversy about the existence of the bond-order-wave state, and the crossover from the first order to continuous phase transition along the phase transition line between the charge-density-wave and bound-order phases is clearly demonstrated. Meanwhile, we show the direct evidences of the phase transition from the singlet to triplet superconducting phases as well as the triplet superconducting to the spin-density-wave phase transition from the entanglement point of view.

Criticality at the Haldane-insulator charge-density-wave quantum phase transition

Exploiting the entanglement concept within a matrix-product-state based infinite density-matrix renormalization group approach, we show that the spin-density-wave and bond-order-wave ground states of the one-dimensional half-filled extended Hubbard model give way to a symmetry-protected topological Haldane state in case an additional alternating ferromagnetic spin interaction is added. In the Haldane insulator the lowest entanglement level features a characteristic twofold degeneracy. Increasing the ratio between nearest-neighbor and local Coulomb interaction $V/U$, the enhancement of the entanglement entropy, the variation of the charge, spin and neutral gaps, and the dynamical spin/density response signal a quantum phase transition to a charge-ordered state. Below a critical point, which belongs to the universality class of the tricritical Ising model with central charge 7/10, the model is critical with $c=1/2$ along the transition line. Above this point, the transition between the Haldane insulator and charge-density-wave phases becomes first order.

Photoinduced in-gap excitations in the one-dimensional extended Hubbard model

We investigate the time evolution of optical conductivity in the half-filled one-dimensional extended Hubbard model driven by a transient laser pulse, by using the time-dependent Lanczos method. Photoinduced in-gap excitations exhibit a qualitatively different structure in the spin-density wave (SDW) in comparison to the charge-density-wave (CDW) phase. In the SDW, the origin of a low-energy in-gap excitation is attributed to the even-odd parity of the photoexcited states, while in the CDW an in-gap state is due to confined photogenerated carriers. The signature of the in-gap excitations can be identified as a characteristic oscillation in the time evolution of physical quantities.

Double-pulse deexcitations in a one-dimensional strongly correlated system

We investigate the ultrafast optical response of the one-dimensional half-filled extended Hubbard model exposed to two successive laser pulses. By using the time-dependent Lanczos method, we find that following the first pulse, the excitation and deexcitation process between the ground state and excitonic states can be precisely controlled by the relative temporal displacement of the pulses. The underlying physics can be understood in terms of a modified Rabi model. Our simulations clearly demonstrate the controllability of ultrafast transition between excited and deexcited phases in strongly correlated electron systems.

Photoinduced spin-order destructions in one-dimensional extended Hubbard model

By employing the time-dependent Lanczos method, the nonequilibrium process of the half-filled one-dimensional extended Hubbard model under the irradiation of a transient laser pulse is investigated. We show that in the spin-density-wave (SDW) phase, the antiferromagnetic spin correlations are impaired by the photoinduced charge carriers. Near the phase boundary between the SDW and charge-density-wave (CDW) phases, a local enhancement of charge (spin) order that is absent in the original SDW (CDW) phase can be realized with proper laser frequency and strength. The possibility of restoration of spin orders from the CDW phase by optical means is discussed.

Enhanced Charge Order in a Photoexcited One-Dimensional Strongly Correlated System

We present a compelling response of a low-dimensional strongly correlated system to an external perturbation. Using the time-dependent Lanczos method we investigate a nonequilibrium evolution of the half-filled one-dimensional extended Hubbard model, driven by a transient laser pulse. When the system is close to the phase boundary, by tuning the laser frequency and strength, a sustainable charge order enhancement is found that is absent in the Mott insulating phase. We analyze the conditions and investigate possible mechanisms of emerging charge order enhancement. Feasible experimental realizations are proposed.

SPIN GAPLESS BOND-ORDERED PHASE IN THE EXTENDED HUBBARD CHAIN WITH SPIN-DEPENDENT REPULSION

Using the field theoretical bosonization and renormalization group techniques, we analytically study quantum phase diagram of a one-dimensional half-filled extended Hubbard model with on-site (U) and spin-dependent nearest-neighbor interactions (V⊥, V‖) in the weak coupling regime. In the case of easy-plane anisotropy (V⊥ > V‖) and at V‖ < U/2, the existence of bond-ordered spin-density-wave phase, corresponding to spin gapless transverse magnetization located on bonds (BSDW±) is shown.

Bond-located phases driven by exchange interaction in the one-dimensional t-U-V-J model

The one-dimensional half-filled extended Hubbard model with on-site repulsion (U) and nearest-neighbor interactions including Coulomb repulsion (V) and exchange (J) is studied in the weak-coupling regime. We present a theoretical argument for the occurrence of bond-located phases. The bond–charge–density–wave (BCDW) is realized for J>0 and bond–spin–density–wave (BSDW) occurs for J<0.

Quantum information analysis of the phase diagram of the half-filled extended Hubbard model

We examine the phase diagram of the half-filled one-dimensional extended Hubbard model using quantum information entropies within the density-matrix renormalization group. It is well known that there is a charge-density-wave phase at large nearest-neighbor and a small on-site Coulomb repulsion and a spin-density wave at small nearest-neighbor and large on-site Coulomb repulsion. At intermediate Coulomb interaction strength, we find an additional narrow region of a bond-order phase between these two phases. The phase transition line for the transition out of the charge-density-wave phase changes from first order at strong coupling to second order in a parameter regime where all three phases are present. We present evidence that the additional phase-transition line between the spin-density-wave and bond-order phases is infinite order. While these results are in agreement with recent numerical work, our study provides an independent unbiased means of determining the phase boundaries by using quantum information analysis, yields values for the location of some of the phase boundaries that differ from those previously found, and provides insight into the limitations of numerical methods in determining phase boundaries, especially those of infinite-order transitions.

Tuning the bond-order wave phase in the half-filled extended Hubbard model

Theoretical and computational studies of the quantum phase diagram of the one-dimensional half-filled extended Hubbard model (EHM) indicate a narrow bond-order wave (BOW) phase with finite magnetic gap E-m for on-site repulsion U < U-*, the critical point, and nearest-neighbor interaction V-c approximate to U/2 near the boundary of the charge-density wave (CDW) phase. Potentials with more extended interactions that retain the EHM symmetry are shown to have a less cooperative CDW transition with higher U-* and wider BOW phase. Density-matrix renormalization group is used to obtain E-m directly as the singlet-triplet gap, with finite E-m marking the BOW boundary V-s(U). The BOW/CDW boundary V-c(U) is obtained from exact finite-size calculations that are consistent with previous EHM determinations. The kinetic energy or bond order provides a convenient new estimate of U-* based on a metallic point at V-c(U) for U < U-*. Tuning the BOW phase of half-filled Hubbard models with different intersite potentials indicates a ground state with large charge fluctuations and magnetic frustration. The possibility of physical realizations of a BOW phase is raised for Coulomb interactions.

Phase Diagram of the One-Dimensional Half-Filled Extended Hubbard Model

We determine the ground-state phase diagram of the one-dimensional half-filled Hubbard model with on-site (nearest-neighbor) repulsive interaction U (V) and nearest-neighbor hopping t using the density-matrix renormalization group technique. Based on the results of the excitation gaps, Luttinger-liquid exponents, and bond-order-wave (BOW) order parameter, we confirm that the BOW phase appears in a substantial region between the charge-density-wave (CDW) and spin-density-wave phases. Each phase boundary is determined by multiple means and it allows us to make a cross-check on the validity of our estimations. We also find that the BOW-CDW transition changes from continuous to first order at the tricritical point (U(t),V(t)) approximately (5.89 t,3.10 t) and the BOW phase shrinks to zero at the critical end point (U(c),V(c)) approximately (9.25 t,4.76 t).

Half-filled one-dimensional extended Hubbard model: Phase diagram and thermodynamics

We study the thermodynamics of the one-dimensional extended Hubbard model at half filling using a density-matrix renormalization group method applied to transfer matrices. We show that the various phase transitions in this system can be detected by measuring usual thermodynamic quantities such as the isothermal compressibility and the uniform magnetic susceptibility. For the isothermal compressibility, we show that universal crossing points exist, which allow us to accurately determine the line where the charge gap vanishes. By studying, in addition, several correlation functions, we confirm the existence of a phase with long-range dimer order (bond order), which has been a matter of debate for several years. According to our calculations, this phase is located in a narrow region between the spin-density and charge-density wave phases up to a tricritical point, which we estimate to be at ${U}_{t}=6.7\ifmmode\pm\else\textpm\fi{}0.2$, ${V}_{t}=3.5\ifmmode\pm\else\textpm\fi{}0.1$. Our results for the phase diagram are in good agreement with the most recent zero-temperature density-matrix renormalization group study; however, they disagree in some important aspects from the most recent Quantum-Monte-Carlo study.

Evolution of Bond-Order-Wave Phase in One-DimensionalMott Insulators

In this paper, by using the level spectroscopy method andbosonization theory, we discuss the evolution of thebond-order-wave (BOW) phase in a one-dimensional half-filledextended Hubbard model with the on-site Coulomb repulsion U aswell as the inter-site Coulomb repulsion V and antiferromagneticexchange J. After clarifying the generic phase diagrams in threelimiting cases with one of the parameters being fixed at zeroindividually, we find that the BOW phase in the U-V phase diagramis initially enlarged as J increases from zero but is eventuallysuppressed as J increases further in the strong-coupling regime.A three-dimensional phase diagram is suggested where the BOW phaseexists in an extended region separated from the spin-density-waveand charge-density-wave phases.

Functional Renormalization Group Analysis of the Half-Filled One-Dimensional Extended Hubbard Model

We study the phase diagram of the half-filled one-dimensional extended Hubbard model at weak coupling using a novel functional renormalization group (FRG) approach. The FRG method includes in a systematic manner the effects of the scattering processes involving electrons away from the Fermi points. Our results confirm the existence of a finite region of bond charge density wave, also known as a "bond order wave" near U=2V and clarify why earlier g-ology calculations have not found this phase. We argue that this is an example in which formally irrelevant corrections change the topology of the phase diagram. Whenever marginal terms lead to an accidental symmetry, this generalized FRG method may be crucial to characterize the phase diagram accurately.