In this review we recapitulate the basic features of the flat-band spin systems and briefly summarize earlier studies in the field. Main emphasis is made on recent developments which include results for both spin and electron flat-band models. In particular, for flat-band spin systems we highlight field-driven phase transitions for frustrated quantum Heisenberg antiferromagnets at low temperatures, chiral flat-band states, as well as the effect of a slight dispersion of a previously strictly flat band due to nonideal lattice geometry. For electronic systems, we discuss the universal low-temperature behavior of several flat-band Hubbard models, the emergence of ground-state ferromagnetism in the square-lattice Tasaki-Hubbard model and the related Pauli-correlated percolation problem, as well as the dispersion-driven ground-state ferromagnetism in flat-band Hubbard systems. Closely related studies and possible experimental realizations of the flat-band physics are also described briefly.
We perform exact numeric calculations for the two-orbital Hubbard model on the four-site cluster. In the limit of large on-site coupling the model becomes equivalent to the spin $S=1$ Heisenberg model. By comparing energy spectra of these two models, we quantified the range of interaction parameters for which the Heisenberg model satisfactorily reproduces the two-orbital Hubbard model. Then we examined how the spectrum evolves when we are outside of this region, focusing especially on checking of how it is modified when various ways of interatomic hoppings of electrons between different orbita…
We study the effects of charge degrees of freedom on the spin excitation dynamics in quasi-one dimensional magnetic materials. Using the density matrix renormalization group method, we calculate the dynamical spin structure factor of the Hubbard model at half electronic filling on a chain and on a ladder geometry, and compare the results with those obtained using the Heisenberg model, where charge degrees of freedom are considered frozen. For both chains and two-leg ladders, we find that the Hubbard model spectrum qualitatively resembles the Heisenberg spectrum -- with low-energy peaks resembl…
In this review paper, we illustrate a possible route to obtain a reliable solution of the 2D Hubbard model and an explanation for some of the unconventional behaviours of underdoped high-$T_\text{c}$ cuprate superconductors within the framework of the composite operator method. The latter is described exhaustively in its fundamental philosophy, various ingredients and robust machinery to clarify the reasons behind its successful applications to many diverse strongly correlated systems, controversial phenomenologies and puzzling materials.
We studied a multi-orbital Hubbard model at half-filling for two and three orbitals per site on a two-site cluster via full exact diagonalization, in a wide range for the onsite repulsion $U$, from weak to strong coupling, and multiple ratios of the Hund coupling $J_H$ to $U$. The hopping matrix elements among the orbitals were also varied extensively. At intermediate and large $U$, we mapped the results into a Heisenberg model. For two orbitals per site, the mapping is into a $S=1$ Heisenberg model where by symmetry both nearest-neighbor $(\mathbf{S}_{i}\cdot\mathbf{S}_{j})$ and $(\mathbf{S}_…
We illustrate how finite-temperature charge and thermal Drude weights of one-dimensional systems can be obtained from the relaxation of initial states featuring global (left-right) gradients in the chemical potential or temperature. The approach is tested for spinless interacting fermions as well as for the Fermi-Hubbard model, and the behaviour in the vicinity of singular points (such as half filling or isotropic chains) is discussed. We present technical details on how to implement the calculation in practice using the density matrix renormalization group and show that the non-equilibrium dy…
We numerically investigate the quantum criticality of the chiral Heisenberg universality class with the total number of fermion components $N$=8 in terms of the Gross-Neveu theory. Auxiliary-field quantum Monte Carlo simulations are performed for the square lattice Hubbard model in the presence of a $d$-wave pairing field, inducing Dirac cones in the single particle spectrum. This property makes the model particularly interesting because it turns out to belong to the same universality class of the Hubbard model on the honeycomb lattice, that is the canonical model for graphene, despite the uni…
We consider the antiferromagnetic Heisenberg and the repulsive Hubbard model on two $N$-site one-dimensional lattices, which support dispersionless one-particle states corresponding to localized states on triangular trapping cells. We calculate the degeneracy of the ground states in the subspaces with $n\le n_{\max}$, $n_{\max}\propto N$ magnons or electrons as well as the contribution of these states (independent localized states) to thermodynamic quantities. Moreover, we discuss another class of low-lying eigenstates (so-called interacting localized states) and calculate their contribution t…
Large-N solutions of the Heisenberg and Hubbard-Heisenberg models on the anisotropic triangular lattice: application to Cs$_2$CuCl$_4$ and to the layered organic superconductors $κ$-(BEDT-TTF)$_2$X
We examine the nature of the transition to the antiferromagnetically ordered state in the half-filled three-dimensional Hubbard model using the dual-fermion multiscale approach. Consistent with analytics, in the weak-coupling regime we find that spin-flip excitations across the Fermi surface are important, and that the strong coupling regime is described by Heisenberg physics. In the intermediate interaction, strong correlation regime we find aspects of both local and non-local correlations. We analyze the critical exponents of the transition in the strong coupling regime and find them to be c…
Comparison of the phase diagram of the half-filled layered organic superconductors with the phase diagram of the RVB theory of the Hubbard-Heisenberg model
We present a theoretical study of single-particle and many-body properties of twisted bilayer WSe$_2$. For single-particle physics, we calculate the band topological phase diagram and electron local density of states (LDOS), which are found to be correlated. By comparing our theoretical LDOS with those measured by scanning tunneling microscopy, we comment on the possible topological nature of the first moiré valence band. For many-body physics, we construct a generalized Hubbard model on a triangular lattice based on the calculated single-particle moiré bands. We show that a layer potential di…
Na$_2$IrO$_3$ was one of the first materials proposed to feature the Kane-Mele type topological insulator phase. Contemporaneously it was claimed that the very same material is in a Mott insulating phase which is described by the Kitaev-Heisenberg (KH) model. First experiments indeed revealed Mott insulating behavior in conjunction with antiferromagnetic long-range order. Further refined experiments established antiferromagnetic order of zigzag type which is not captured by the KH model. Since then several extensions and modifications of the KH model were proposed in order to describe the expe…
We review the fact that U(1) gauge symmetry enables the mapping of one-dimensional Hubbard chains with Rashba-type spin orbit coupling to renormalized Hubbard Hamiltonians. The existence of the mapping has important consequences for the interpretation of ARPES experiments on one-dimensional chains subject to Rashba spin orbit coupling and can be exploited to check for the applicability of the mapping. We show numerical applications of the mapping and consider the implications for bosonization as well as for the Heisenberg-limit of the Hubbard model. In addition we point out the consequences fo…
The route of frustrated cuprates from antiferromagnetic to ferromagnetic spin-1/2 Heisenberg chains: Li2ZrCuO4 as a missing link near the quantum critical point
The method for calculating the isotropic exchange interactions in the paramagnetic phase is proposed. It is based on the mapping of the high-temperature expansion of the spin-spin correlation function calculated for the Heisenberg model onto Hubbard Hamiltonian one. The resulting expression for the exchange interaction has a compact and transparent formulation. The quality of the calculated exchange interactions is estimated by comparing the eigenvalue spectra of the Heisenberg model and low-energy magnetic part of the Hubbard model. By the example of quantum rings with different hopping setup…
We study the microscopic dynamics of competing ordered phases in a two-dimensional correlated electron model, which is driven with a pulsed electric field of finite duration. In order to go beyond a mean-field treatment of the electronic interactions we adopt a large-$N$ generalization of the Hubbard model and combine it with the semiclassical fermionic truncated Wigner approximation as a time evolution method. This allows us to calculate dephasing corrections to the mean-field dynamics and to obtain stationary states, which we interpret as prethermal order. We use this framework to simulate t…
In the quest for quantum spin liquids in three spatial dimensions (3D), we study the half-filled Hubbard model on the simple cubic lattice with hopping processes up to third neighbors. Employing the variational cluster approach (VCA), we determine the zero-temperature phase diagram: In addition to a paramagnetic metal at small interaction strength $U$ and various antiferromagnetic insulators at large $U$, we find an intermediate-$U$ antiferromagnetic metal. Most interestingly, we also identify a non-magnetic insulating region, extending from intermediate to strong $U$. Using VCA results in the…
We derive an effective spin Hamiltonian for the one-dimensional half-filled asymmetric ionic Hubbard model with alternating on-site interaction in the limit of strong repulsion. It is shown that the effective Hamiltonian is that of a spin $S=1/2$ anisotropic $XXZ$ Heisenberg chain with alternating next-nearest-neighbor and three-spin couplings in the presence of a uniform and a staggered magnetic field.
We discuss how to locate critical points in the Berezinskii-Kosterlitz-Thouless (BKT) universality class by means of gap-scaling analyses. While accurately determining such points using gap extrapolation procedures is usually challenging and inaccurate due to the exponentially small value of the gap in the vicinity of the critical point, we show that a generic gap-scaling analysis, including the effects of logarithmic corrections, provides very accurate estimates of BKT transition points in a variety of spin and fermionic models. As a first example, we show how the scaling procedure, combined …
In spin-1/2 one-dimensional Heisenberg antiferromagnets and anisotropic triangular Heisenberg antiferromagnets, high-energy states carrying considerable spectral weights have been observed in a magnetic field using inelastic neutron scattering. Such high-energy properties cannot be explained in terms of either Nambu-Goldstone bosons due to spontaneous breaking of continuous symmetries or quasiparticles in a Tomonaga-Luttinger liquid. Here, we show that the mechanism causing the high-energy states is analogous to that of the upper Hubbard band in the one-dimensional Hubbard model, by theoretica…
We use the Gutzwiller ansatz and analyze the phase diagram of the extended Bose-Hubbard Hamiltonian with on-site (U) and nearest-neighbor (V) repulsions. For $d$-dimensional hypercubic lattices, when 2dV < U, it is well-known that the ground state alternates between the charge-density-wave (CDW) and Mott insulators, and the supersolid (SS) phase occupies small regions around the CDW insulators. However, when 2dV > U, in this paper, we show that the ground state has only CDW insulators, and more importantly, the SS phase occupies a much larger region in the phase diagram, existing up to very la…
In this work, we investigate the possible dramatic effects of Rashba or Dresselhaus spin-orbit coupling (SOC) on fermionic Hubbard model in a 2d square lattice. In the strong coupling limit, it leads to the Rotated Anti-ferromagnetic Heisenberg model which is a new class of quantum spin model. For a special equivalent class, we identify a new spin-orbital entangled commensurate ground ( Y-y ) state subject to strong quantum fluctuations at $T=0$. We evaluate the quantum fluctuations by the spin wave expansion up to order $ 1/S^2 $. In some SOC parameter regime, the Y-y state supports a massive…
While the existence of a spin-liquid ground state of the spin-1/2 kagome Heisenberg antiferromagnet (KHAF) is well established, the discussion of the effect of an interlayer coupling (ILC) by controlled theoretical approaches is still lacking. Here we study this problem by using the coupled-cluster method to high orders of approximation. We consider a stacked KHAF with a perpendicular ILC $J_\perp$, where we study ferro- as well as antiferromagnetic $J_\perp$. We find that the spin-liquid ground state (GS) persists until relatively large strengths of the ILC. Only if the strength of the ILC ex…
We study the effects of a periodically varying electric field on the Hubbard model at half-filling on a triangular lattice. The electric field is incorporated through the phase of the nearest-neighbor hopping amplitude via the Peierls prescription. When the on-site interaction $U$ is much larger than the hopping, the effective Hamiltonian $H_{eff}$ describing the spin sector can be found using a Floquet perturbation theory. To third order in the hopping, $H_{eff}$ is found to have the form of a Heisenberg antiferromagnet with three different nearest-neighbor couplings $(J_α,J_β,J_γ)$ on bonds …
The Hubbard model and its strong-coupling version, the Heisenberg one, have been widely studied on the triangular lattice to capture the essential low-temperature properties of different materials. One example is given by transition metal dichalcogenides, as 1T$-$TaS$_2$, where a large unit cell with $13$ Ta atom forms weakly-coupled layers with an isotropic triangular lattice. By using accurate variational Monte Carlo calculations, we report the phase diagram of the $t-t^\prime$ Hubbard model on the triangular lattice, highlighting the differences between positive and negative values of $t^\p…
We study the spin diffusion and spin conductivity in the square lattice Hubbard model by using the finite-temperature Lanczos method. We show that the spin diffusion behaves differently from the charge diffusion and has a nonmonotonic $T$ dependence. This is due to a progressive liberation of charges that contribute to spin transport and enhance it beyond that active at low temperature due to the Heisenberg exchange. We further show that going away from half-filling and zero magnetization increases the spin diffusion, but that the increase is insufficient to reconcile the difference between th…
We propose the $π$ flux triangular lattice Hubbard model ($π$-THM) as a prototypical setup to stabilize magnetically disordered quantum states of matter in the presence of charge fluctuations. The quantum paramagnetic domain of the $π$-THM which we identify for intermediate Hubbard U is framed by a Dirac semi-metal for weak coupling and by 120${}^{\circ}$ Néel order for strong coupling. Generalizing the Klein duality from spin Hamiltonians to tight-binding models, the $π$-THM maps to a Hubbard model which corresponds to the $(J_H, J_K)=(-1,2)$ Heisenberg-Kitaev model in its strong coupling lim…
We study the influence of ferromagnetic nonlocal exchange on correlated electrons in terms of a $SU(2)$-Hubbard-Heisenberg model and address the interplay of on-site interaction induced local moment formation and the competition of ferromagnetic direct and antiferromagnetic kinetic exchange interactions. In order to simulate thermodynamic properties of the system in a way that largely accounts for the on-site interaction driven correlations in the system, we advance the correlated variational scheme introduced in [M. Schüler et al., Phys. Rev. Lett. 111, 036601 (2013)] to account for expliciti…
The Kitaev-Hubbard model of interacting fermions is defined on the honeycomb lattice and, at strong coupling, interpolates between the Heisenberg model and the Kitaev model. It is basically a Hubbard model with ordinary hopping $t$ and spin-dependent hopping $t'$. We study this model in the weak to intermediate coupling regime, at half-filling, using the Cellular Dynamical Impurity Approximation (CDIA), an approach related to Dynamical Mean Field Theory but based on Potthoff's variational principle. We identify four phases in the $(U,t')$ plane: two semi-metallic phases with different numbers …
By means of the dynamical vertex approximation (D$Γ$A) we include spatial correlations on all length scales beyond the dynamical mean field theory (DMFT) for the half-filled Hubbard model in three dimensions. The most relevant changes due to non-local fluctuations are: (i) a deviation from the mean-field critical behavior with the same critical exponents as for the three dimensional Heisenberg (anti)-ferromagnet and (ii) a sizable reduction of the Néel temperature ($T_N$) by $\sim 30%$ for the onset of antiferromagnetic order. Finally, we give a quantitative estimate of the deviation of the sp…
We consider the extended Hubbard model and introduce a corresponding Heisenberg-like problem written in terms of spin operators. The derived formalism is reminiscent of Anderson's idea of the effective exchange interaction and takes into account nonlocal correlation effects. The results for the exchange interaction and magnetic susceptibility are expressed in terms of single-particle quantities, which can be obtained efficiently in realistic calculations of multiband systems. In the strongly spin-polarized limit, when the local magnetic moment is well-defined, the exchange interaction reduces …
