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Evgeny Kozik

Publications and source records attributed to Evgeny Kozik.

At least 19 recordsLinked to original sources

Origin of misleading convergence in self-consistent many-electron theories: Fundamental aspects and practical implications

Self-consistent approaches in many-electron problems typically converge to an unphysical solution in strongly correlated regimes. By deriving the mathematical condition for the stability of the physical solution, we unveil the precise relation between two distinct issues previously considered equivalent: the misleading convergence in self-consistent schemes and the multivaluedness of the Luttinger-Ward functional. Although these problems are fundamentally linked through the divergences of the irreducible vertex function, we show that misleading convergence can occur even in the absence of such divergences. Eventually, a systematic procedure for stabilizing the physical solution is proposed.

cond-mat.str-el

Fractional quantum Hall states by Feynman's diagrammatic expansion

The fractional quantum Hall (FQH) effect arises from strong electron correlations in a quantising magnetic field, and features exotic emergent phenomena such as electron fractionalisation. Using the diagrammatic Monte Carlo approach with the combinatorial summation (CoS) algorithm, we obtain results with controlled accuracy for the microscopic model of interacting electrons in the lowest Landau level (LLL) in the thermodynamic limit. Starting from the macroscopically degenerate LLL at finite temperature, including interactions order by order, and applying a controlled resummation to the resulting series, we observe the emergence of the incompressible 1/3-filled state as the temperature is lowered. By analysing the long-time decay of the Green's function, we find spectral properties consistent with an energy gap at 1/3-filling, whereas at 1/2-filling our results are consistent with the pseudogapped behaviour previously observed experimentally and suggested theoretically. Our work provides the first demonstration that fractionalised phases of matter can be reliably described with Feynman's diagrammatic technique in terms of the fundamental electronic degrees of freedom, while also showing applicability of expansions in the bare Coulomb potential for precision calculations.

cond-mat.str-el

Anisotropic scattering rates in strain-tuned Sr$_2$RuO$_4$

Motivated by recent angle-resolved photoemission spectroscopy (ARPES) experiments, we analyze the temperature, frequency, and momentum dependence of the single-particle scattering rate in a model of the $γ$-band of Sr$_2$RuO$_4$ under strain, with particular emphasis on the behavior near the Lifshitz transition where the Fermi energy crosses a single Van Hove point. While the scattering rate is only moderately anisotropic at zero strain, we find that it becomes strongly anisotropic at the Lifshitz point. At the lowest energies, we recover the expected universal behavior: the scattering rate varies (ignoring logarithmic corrections) as $τ^{-1}\sim ω$ at the Van Hove point and as $τ^{-1}\sim ω^{3/2}$ away from it. At higher energies, however, corrections of order $ω^2$ become important in both regimes. We show that the experimentally observed behavior $τ^{-1} \sim ω^α$ with $α\approx 1.4(2)$ at the Van Hove point can be quantitatively explained by a superposition of linear and quadratic contributions to the scattering rate, which are comparable in magnitude at the intermediate energies probed by experiment, rather than in terms of a new universal power law. We further predict a distinctive anisotropy, strain dependence, and a non-monotonic frequency dependence of the scattering rate at a Lifshitz transition, all of which may be directly tested in experiments.

cond-mat.str-el

Numerical validation of an ultracold Hubbard quantum simulator

We apply the formally exact Diagrammatic Monte Carlo (DiagMC) method to probe the unprecedentedly low-temperature regime recently achieved in an ultracold-atom quantum simulation of the 2D Hubbard model [Xu et al., Nature 642, 909 (2025)]. Computing the experimentally measured observables directly in the thermodynamic limit with a priori control of systematic errors, we find striking agreement with the experimental data across all accessible temperatures -- including the lowest, where existing numerical benchmarks show significant deviations. This validates the quantum simulator's control over systematic errors in this challenging regime and delivers unbiased benchmarks for future method development. Our results demonstrate that classical algorithms remain competitive with state-of-the-art analogue quantum simulators, and emphasise the importance of controlled numerical methods for continuing the development of these experiments.

cond-mat.quant-gas

Strange diffusivity of incoherent metal in half-filled two-dimensional Hubbard model

We study charge transport across the metal-insulator crossover in the half-filled two-dimensional Hubbard model, with particular emphasis on precision control. The dynamic current-current correlation function is obtained directly in the thermodynamic limit, and the optical conductivity is extracted using numerical analytic continuation. To achieve this, we develop a multiscale approach: the non-perturbative low-frequency behavior is computed using the unbiased diagrammatic Monte Carlo technique, while the high-frequency physics is captured via a self-consistent (semi-)analytic diagrammatic theory. We found that across a broad temperature range where the DC resistivity displays anomalous scaling, $\sim T^α$ with $0<α\lesssim 1$, the Nernst-Einstein relation implies the diffusion constant with the characteristic $\sim 1/\sqrt{T}$ "strange metal" behavior. It was also revealed that the insulating regime is entered through a peculiar non-Fermi liquid state-which we call a Pseudogap Metal-characterized by insulating charge compressibility coexisting with metallic transport. Diagrammatically, the high-temperature incoherent transport is captured by the dressed polarization bubble, whereas near the metal-insulator crossover, the effective interaction vertex between opposite-spin particles is responsible for transferring the Drude weight to a high-frequency continuum.

cond-mat.str-el

Exploiting Parallelism for Fast Feynman Diagrammatics

Diagrammatic expansions are a paradigmatic and powerful tool of quantum many-body theory. Their evaluation to high order, e.g., by the Diagrammatic Monte Carlo technique, can provide unbiased results in strongly correlated and challenging regimes. However, calculating a factorial number of terms to acceptable precision remains very costly even for state-of-the-art methods. We achieve a dramatic acceleration of evaluating Feynman's diagrammatic series by use of specialised hardware architecture within the recently introduced combinatorial summation (CoS) framework. We present how exploiting the massive parallelism and concurrency available from GPUs leads to orders of magnitude improvement in computation time even on consumer-grade hardware. This provides a platform for making probes of novel phenomena of strong correlations much more accessible.

cond-mat.str-el

Combinatorial summation of Feynman diagrams: Equation of state of the 2D SU(N) Hubbard model

Feynman's diagrammatic series is a common language for a formally exact theoretical description of systems of infinitely-many interacting quantum particles, as well as a foundation for precision computational techniques. Here we introduce a universal framework for efficient summation of connected or skeleton Feynman diagrams for generic quantum many-body systems. It is based on an explicit combinatorial construction of the sum of the integrands by dynamic programming, at a computational cost that can be made only exponential in the diagram order on a classical computer and potentially polynomial on a quantum computer. We illustrate the technique by an unbiased diagrammatic Monte Carlo calculation of the equation of state of the $2D$ $SU(N)$ Hubbard model in an experimentally relevant regime, which has remained challenging for state-of-the-art numerical methods.

cond-mat.str-el

Strange Metal to Insulator Transitions in the Lowest Landau Level

We study the microscopic model of electrons in the partially-filled lowest Landau level interacting via the Coulomb potential by the diagrammatic theory within the GW approximation. In a wide range of filling fractions and temperatures, we find a homogeneous non-Fermi liquid (nFL) state similar to that found in the Sachdev-Ye-Kitaev (SYK) model, with logarithmic corrections to the anomalous dimension. In addition, the phase diagram is qualitatively similiar to that of SYK: a first-order transition terminating at a critical end-point separates the nFL phase from a band insulator that corresponds to the fully-filled Landau level. This critical point, as well as that of the SYK model -- whose critical exponents we determine more precisely -- are shown to both belong to the Van der Waals universality class. The possibility of a charge density wave (CDW) instability is also investigated, and we find the homogeneous nFL state to extend down to the ground state for fillings $0.2 \lesssim ν\lesssim 0.8$, while a CDW appears outside this range of fillings at sufficiently low temperatures. Our results suggest that the SYK-like nFL state should be a generic feature of the partially-filled lowest Landau level at intermediate temperatures.

cond-mat.str-el

Misleading convergence of the skeleton diagrammatic technique: when the correct solution can be found

Convergence of the self-consistent skeleton diagrammatic technique (SDT) -- in which the full Green's function is determined through summation of Feynman diagrams in terms of itself -- to the wrong answer has been associated with the existence of non-perturbative branches of the Luttinger-Ward functional. Although it has been possible to detect misleading convergence without the knowledge of the exact result, the SDT has remained inapplicable in the regimes where this happens. We show that misleading convergence does not always preclude recovering the exact solution. In addition to the established mechanism, convergence of the SDT to the wrong answer can stem from divergence of the inherent diagrammatic series, which allows us to recover the exact solution by a modified SDT protocol based on controlled analytic continuation. We illustrate this approach by its application to the analytically solvable (0+0)d Hubbard model, the Hubbard atom, and the 2d Hubbard model in a challenging strong-coupling regime, for which the SDT is solved with controlled accuracy by the diagrammatic Monte Carlo (DiagMC) technique.

cond-mat.str-el

Evaluating second-order phase transitions with Diagrammatic Monte Carlo: Néel Transition in the doped three-dimensional Hubbard model

Diagrammatic Monte Carlo -- the technique for numerically exact summation of all Feynman diagrams to high orders -- offers a unique unbiased probe of continuous phase transitions. Being formulated directly in the thermodynamic limit, the diagrammatic series is bound to diverge and is not resummable at the transition due to the non-analyticity of physical observables. This enables the detection of the transition with controlled error bars from an analysis of the series coefficients alone, avoiding the challenge of evaluating physical observables near the transition. We demonstrate this technique by the example of the Néel transition in the $3d$ Hubbard model. At half-filling and higher temperatures, the method matches the accuracy of state-of-the-art finite-size techniques, but surpasses it at low temperatures and allows us to map the phase diagram in the doped regime, where finite-size techniques struggle from the fermion sign problem. At low temperatures and sufficient doping, the transition to an incommensurate spin density wave state is observed.

cond-mat.str-el

GW space-time method: Energy band-gap of solid hydrogen

We implement the GW space-time method at finite temperatures, in which the Green's function G and the screened Coulomb interaction W are represented in the real space on a suitable mesh and in imaginary time in terms of Chebyshev polynomials, paying particular attention to controlling systematic errors of the representation. Having validated the technique by the canonical application to silicon and germanium, we apply it to calculation of band gaps in hexagonal solid hydrogen with the bare Green's function obtained from density functional approximation and the interaction screened within the random phase approximation (RPA). The band gap results, obtained from the asymptotic decay of the full Green's function without resorting to analytic continuation, suggest that the solid hydrogen above 270 GPa can not adopt the hexagonal-closed-pack (hcp) structure. The demonstrated ability of the method to store the full G and W functions in memory with sufficient accuracy is crucial for its subsequent extensions to include higher orders of the diagrammatic series by means of diagrammatic Monte Carlo algorithms.

cond-mat.mtrl-sci

Superfluid ground state phase diagram of the two-dimensional Hubbard model in the emergent Bardeen-Cooper-Schrieffer regime

In nonperturbative regimes, the superfluid instability in the two-dimensional Hubbard model can be described by an emergent BCS theory with small effective pairing constants. We compute the effective couplings using a controlled bold-line diagrammatic Monte Carlo approach, which stochastically sums all skeleton Feynman diagrams dressed in the one- and two-particle channels to high expansion orders, and map out the resulting superfluid ground-state phase diagram in a range of next-nearest-neighbor hopping $0 \leq t^{\prime} \leq 0.3t$, interaction strength $0 \leq U \leq 3t$, and lattice filling $0 \leq n \leq 2$. The phase diagram is dramatically transformed in the hole-doped region and becomes particularly rich at larger doping and $t'$. At $t'=0.3$, the weak-coupling picture with the dominant triplet pairing sharply peaked at $n \approx 0.73$ due to the Van Hove singularity is replaced by a plateau of the singlet $d_{x^2-y^2}$ paring, while for $U \gtrsim 3t$ the effective couplings are consistent with the $d_{x^2-y^2}$ high-temperature superconductivity in the hole-doped region near cuprates' optimal doping.

cond-mat.str-el

Homotopic Action: A Pathway to Convergent Diagrammatic Theories

The major obstacle preventing Feynman diagrammatic expansions from accurately solving many-fermion systems in strongly correlated regimes is the series slow convergence or divergence problem. Several techniques have been proposed to address this issue: series resummation by conformal mapping, changing the nature of the starting point of the expansion by shifted action tools, and applying the homotopy analysis method to the Dyson-Schwinger equation. They emerge as dissimilar mathematical procedures aimed at different aspects of the problem. The proposed homotopic action offers a universal and systematic framework for unifying the existing -- and generating new -- methods and ideas to formulate a physical system in terms of a convergent diagrammatic series. It eliminates the need for resummation, allows one to introduce effective interactions, enables a controlled ultraviolet regularization of continuous-space theories, and reduces the intrinsic polynomial complexity of the diagrammatic Monte Carlo method. We illustrate this approach by an application to the Hubbard model.

cond-mat.str-el

Tracking the Footprints of Spin Fluctuations: A MultiMethod, MultiMessenger Study of the Two-Dimensional Hubbard Model

The Hubbard model represents the fundamental model for interacting quantum systems and electronic correlations. Using the two-dimensional half-filled Hubbard model at weak coupling as a testing ground, we perform a comparative study of a comprehensive set of state of the art quantum many-body methods. Upon cooling into its insulating antiferromagnetic ground-state, the model hosts a rich sequence of distinct physical regimes with crossovers between a high-temperature incoherent regime, an intermediate temperature metallic regime and a low-temperature insulating regime with a pseudogap created by antiferromagnetic fluctuations. We assess the ability of each method to properly address these physical regimes and crossovers through the computation of several observables probing both quasiparticle properties and magnetic correlations, with two numerically exact methods (diagrammatic and determinantal quantum Monte Carlo) serving as a benchmark. By combining computational results and analytical insights, we elucidate the nature and role of spin fluctuations in each of these regimes. Based on this analysis, we explain how quasiparticles can coexist with increasingly long-range antiferromagnetic correlations, and why dynamical mean-field theory is found to provide a remarkably accurate approximation of local quantities in the metallic regime. We also critically discuss whether imaginary time methods are able to capture the non-Fermi liquid singularities of this fully nested system.

cond-mat.str-el

Entropy in the non-Fermi-liquid regime of the doped $2d$ Hubbard model

We study thermodynamic properties of the doped Hubbard model on the square lattice in the regime of strong charge and spin fluctuations at low temperatures near the metal-to-insulator crossover and obtain results with controlled accuracy using the diagrammatic Monte Carlo method directly in the thermodynamic limit. The behavior of the entropy reveals a non-Fermi-liquid state at sufficiently high interactions near half-filling: a maximum in the entropy at non-zero doping develops as the coupling strength is increased, along with an inflection point, evidencing a metal to non-Fermi-liquid crossover. The specific heat exhibits additional distinctive features of a non-Fermi-liquid state. Measurements of the entropy can therefore be used as a probe of the state of the system in quantum simulation experiments with ultracold atoms in optical lattices.

cond-mat.str-el

Strange Metal Solution in the Diagrammatic Theory for the $2d$ Hubbard Model

We show that the numerically exact bold-line diagrammatic theory for the $2d$ Hubbard model exhibits a non-Fermi-liquid (NFL) strange metal state, which is connected to the SYK NFL in the strong-interaction limit. The solution for the doped system features the expected phenomenology with the NFL near half-filling at strong couplings and in a wide temperature range enclosed by the atomic state at high temperatures and a Fermi liquid at low temperatures. We demonstrate, however, that this behavior in the weakly doped regime is due to the unphysical branch of the Luttinger-Ward functional. On the other hand, our analysis shows that the NFL physics is realized at larger doping.

cond-mat.str-el

Spin and charge correlations across the metal-to-insulator crossover in the half-filled $2d$ Hubbard model

The $2d$ Hubbard model with nearest-neighbour hopping on the square lattice and an average of one electron per site is known to undergo an extended crossover from metallic to insulating behavior driven by proliferating antiferromagnetic correlations. We study signatures of this crossover in spin and charge correlation functions and present results obtained with controlled accuracy using diagrammatic Monte Carlo in the range of parameters amenable to experimental verification with ultracold atoms in optical lattices. The qualitative changes in charge and spin correlations associated with the crossover are observed at well-separated temperature scales, which encase the intermediary regime of non-Fermi-liquid character, where local magnetic moments are formed and non-local fluctuations in both channels are essential.

cond-mat.str-el

Extended crossover from Fermi liquid to quasi-antiferromagnet in the half-filled 2D Hubbard model

The ground state of the Hubbard model with nearest-neighbor hopping on the square lattice at half filling is known to be that of an antiferromagnetic (AFM) band insulator for any on-site repulsion. At finite temperature, the absence of long-range order makes the question of how the interaction-driven insulator is realized nontrivial. We address this problem with controlled accuracy in the thermodynamic limit using self-energy diagrammatic determinant Monte Carlo and dynamical cluster approximation methods and show that development of long-range AFM correlations drives an extended crossover from Fermi liquid to insulating behavior in the parameter regime that precludes a metal-to-insulator transition. The intermediate crossover state is best described as a non-Fermi liquid with a partially gapped Fermi surface.

cond-mat.str-el