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arXiv:2509.20258 · Physical review. B./Physical review. B

Fidelity zeros and Lee-Yang theory of quantum phase transitions

Tian-Yi Gu, Gaoyong Sun

Published Dec 31, 2025• 3 citations
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Abstract

Lee-Yang theory is central to the analysis of thermal phase transitions. However, the underlying mechanism of the theory and the nature of Lee-Yang zeros in quantum many-body systems remains elusive. Here, we develop a unified framework for understanding quantum phase transitions from fidelity zeros induced by symmetry breaking. These zeros, arising from transitions between symmetry sectors, obey the Lee-Yang theorem and give rise to fidelity edges near critical points. Quantum criticality is further characterized through the finite-size scaling of fidelity zeros. As concrete examples, we analytically and numerically investigate fidelity zeros in one- and two-dimensional ferromagnetic Ising models under a complex magnetic field. Our results provide new insights into the mechanism of Lee-Yang theory and open avenues for exploring unexplored landscapes of phase transitions in quantum many-body systems.

DOI
10.1103/3x34-f53v

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Lee-Yang theory is central to the analysis of thermal phase transitions. However, the underlying mechanism of the theory and the nature of Lee-Yang zeros in quantum many-body systems remains elusive. Here, we develop a unified framework for understanding quantum phase transitions from fidelity zeros induced by symmetry breaking. These zeros, arising from transitions between symmetry sectors, obey the Lee-Yang theorem and give rise to fidelity edges near critical points. Quantum criticality is further characterized through the finite-size scaling of fidelity zeros. As concrete examples, we analytically and numerically investigate fidelity zeros in one- and two-dimensional ferromagnetic Ising models under a complex magnetic field. Our results provide new insights into the mechanism of Lee-Yang theory and open avenues for exploring unexplored landscapes of phase transitions in quantum many-body systems.
Lee-Yang theory offers a unifying framework for understanding classical phase transitions and dynamical quantum phase transitions through the analysis of partition functions and Loschmidt echoes. Recently, this framework was extended to characterize quantum phase transitions of quantum Ising models by introducing the concepts of non-Hermitian parity-symmetry breaking and fidelity zeros. Here, we generalize the theory by studying a broad class of quantum models, including the XY, the XXZ, the XYZ, and the Z_{p} clock models in one dimension, subject to a complex magnetic field. For the XY, XXZ, and XYZ models, we find that the complex field breaks parity symmetry and induces oscillations of the ground state between the two parity sectors, giving rise to fidelity zeros within the ordered phases. For the Z_{3} clock model, the complex field splits the real part of the ground-state energy between the neutral sector (q=0) and the charged sectors (q=1,2), while preserving the degeneracy within the charged sector. Fidelity zeros arise only after projecting out one of the charged sectors. For the Z_{4} and Z_{5} clock models, the ground states are instead projected to oscillate between the neutral sector (q=0) and the charged sectors q=2 and q=1, respectively, giving rise to fidelity zeros. Finite-size scaling of these zeros yields critical exponents in full agreement with analytical predictions, demonstrating that this approach is applicable not only to the Ising model with Z_{2} symmetry, but also to more general Heisenberg-type models and systems with higher discrete symmetries.
Lee-Yang theory offers a unifying framework for understanding classical phase transitions and dynamical quantum phase transitions through the analysis of partition functions and Loschmidt echoes. Recently, this framework is extended to characterize quantum phase transitions of quantum Ising models by introducing the concepts of non-Hermitian parity-symmetry breaking and fidelity zeros. Here, we generalize the theory by studying a broad class of quantum models, including the XY, the XXZ, the XYZ, and the Zp\mathbb{Z}_pZp​ clock models in one dimension, subject to a complex magnetic field. For the XY, XXZ and XYZ models, we find that the complex field breaks parity symmetry and induces oscillations of the ground state between the two parity sectors, giving rise to fidelity zeros within the ordered phases. For the Z3\mathbb{Z}_3Z3​ clock model, the complex field splits the real part of the ground-state energy between the neutral sector (q=0q=0q=0) and the charged sectors (q=1,2q=1,2q=1,2), while preserving the degeneracy within the charged sector. Fidelity zeros arise only after projecting out one of the charged sectors. For the Z4\mathbb{Z}_4Z4​ and Z5\mathbb{Z}_5Z5​ clock models, the ground states are instead projected to oscillate between the neutral sector (q=0q=0q=0) and the charged sectors q=2q=2q=2 and q=1q=1q=1, respectively, giving rise to fidelity zeros. Finite-size scaling of these zeros yields critical exponents in full agreement with analytical predictions, demonstrating that this approach is applicable not only to the Ising model with Z2\mathbb{Z}_2Z2​ symmetry, but also to more general Heisenberg-type models and systems with higher discrete symmetries.
Determining the phase diagram of interacting quantum many-body systems is an important task for a wide range of problems such as the understanding and design of quantum materials. For classical equilibrium systems, the Lee-Yang formalism provides a rigorous foundation of phase transitions, and these ideas have also been extended to the quantum realm. Here, we develop a Lee-Yang theory of quantum phase transitions that can include thermal fluctuations caused by a finite temperature, and it thereby provides a link between the classical Lee-Yang formalism and recent theories of phase transitions at zero temperature. Our methodology exploits analytic properties of the moment generating function of the order parameter in systems of finite size, and it can be implemented in combination with tensor-network calculations. Specifically, the onset of a symmetry-broken phase is signaled by the zeros of the moment generating function approaching the origin in the complex plane of a counting field that couples to the order parameter. Moreover, the zeros can be obtained by measuring or calculating the high cumulants of the order parameter. We determine the phase diagram of the two-dimensional quantum Ising model and thereby demonstrate the potential of our method to predict the critical behavior of two-dimensional quantum systems at finite temperatures.
The collective behavior of large numbers of interacting particles may give rise to a phase transition. A continuing challenge is to identify the underlying principles of this phenomenon emerging in many important systems in nature and characterize the critical behavior of interacting many-body systems. In this thesis, we present a theoretical and methodological framework for predicting the phase properties of a macroscopic system based on the behavior of just a few of its constituents. To this end, we devise a direct pathway from the detection of partition function zeros by measuring or simulating fluctuating observables in systems of finite size to the characterization of criticality and large deviation statistics in interacting many-body systems. Our approach combines ideas and concepts from the finite-size scaling analysis with the Lee-Yang formalism and theories of high cumulants and large deviations, and it can be applied in a wide range of critical systems from physics, chemistry, and biology, both in theory and experiment. The thesis consists of four publications. In publications I and II, we report a novel method that makes it possible to extract the partition function zeros in interacting many-body systems of finite size solely from the fluctuations of thermodynamic observables without any prior knowledge of the partition function. To illustrate the feasibility of our approach, we use the Fisher zeros and their relation to the energy fluctuations as a tool for probing criticality in Ising models in two and three dimensions. In particular, we suggest an alternative way of extracting the universal critical exponents from measured fluctuations in finite-size systems away from the phase transition. In publications III and IV, we develop a scaling analysis of the partition function zeros to investigate the criticality in higher dimensions where the hyperscaling breaks down. We also show that even if the system does not exhibit a sharp phase transition, the partition function zeros carry important information about the large-deviation statistics of the system and its symmetry properties. To this end, we determine the rare magnetization fluctuations from the asymptotic behavior of the Lee-Yang zeros, i.e., from the Yang-Lee edge singularities. This finding may constitute a profound connection between Lee-Yang theory and large-deviation statistics.
We study the Yang-Lee theory in quantum phase transitions from the perspective of quantum entanglement in one-dimensional many-body systems. We primarily focus on the distribution of Yang-Lee zeros and its associated Yang-Lee edge singularity of two prototypical models: the Su-Schrieffer-Heeger model and the XXZ spin chain. By taking the zero-temperature limit, we show how the Yang-Lee zeros approach the quantum phase transition points on the complex plane of parameters. To characterize the edge singularity induced by Yang-Lee zeros in a quantum phase transition, we introduce the entanglement entropy of the ground state to show that the edges of Yang-Lee zeros lead to the ground-state entanglement transition. We further show that our results are also applicable to the general noninteracting parity-time-symmetric Hamiltonians.
Yang-Lee edge singularities are the branch point of free energy on the complex plane of physical parameters and have been shown to be the simplest universality class of phase transitions.However, Yang-Lee edge singularities have not been regarded as experimentally observable since they occur at complex physical parameters which are unphysical.A recent discovery regarding the relation between partition functions and probe spin coherence makes it experimentally feasible to access the complex plane of physical parameters.However, how to extract the critical point and the critical exponent of Yang-Lee edge singularities in many-body systems, which occurs only at the thermodynamic limit, has still been elusive.Here we show that the quantum coherence of a probe spin coupled to finite-size Ising-type spin systems presents universal scaling behavior near the Yang-Lee edge singularity.The finite-size scaling behavior of the quantum coherence of the probe spin predicts that one can extract the critical point and the critical exponent of the Yang-Lee edge singularity of an Ising-type spin system in the thermodynamic limit from the spin coherence measurement of the probe spin coupled to finite-size Ising-type spin systems.This finding provides a practical approach to studying the nature of Yang-Lee edge singularities of many-body systems.In 1952, Yang and Lee [1, 2] initiated the examination of phase transitions by studying the partition function zeros, termed Lee-Yang zeros, on the complex plane of a magnetic field h (or fugacity z for fluids).They found that for a system above its critical temperature T c , the partition function must be nonzero throughout some neighborhood of the real axis of the magnetic field within a gap determined by two edges at  ( ) h T YL .Therefore the free energy is an analytic function of the real magnetic field.On the other hand, below the critical temperature T c , the Lee-Yang zeros will come arbitrarily to the real axis as the thermodynamic limit is taken, destroying the analyticity of the free energy in h for those real fields at which the Lee-Yang zeros accumulate.Kortman and Griffiths [3] pointed out that the edges of Lee-Yang zeros of a many-body system in the thermodynamic limit are singularity points, termed Yang-Lee edge singularities [4].Fisher [4] proposed that the Yang-Lee edge singularity could be considered as a new second order phase transition point with associated critical exponents.Renormalization group analyses [4] show that the Yang-Lee edge singularity is associated with an j i 3 theory and the crossover dimensionality of the Yang-Lee edge singularity is d c = 6.Later, the investigation of the Yang-Lee edge singularity has been extended to many other models, such as the classical nvector model [5], the quantum Heisenberg model [5], the spherical model [6], the quantum one-dimensional (1D) transverse Ising model [7], the hierarchical model [8], branched polymers [9], the directed-site animalsenumeration problem [10], Ising models on fractal lattices [11], Ising systems with correlated disorder [12], fluid models with repulsive-core interactions [13], the antiferromagnetic Ising model [14] etc.A comprehensive review of the study of Yang-Lee edge singularities can be found in [15, 16].Recently, Kibble-Zurek scaling was shown to appear at the Yang-Lee edge singularity [17], which supports that the Yang-Lee edge singularity is similar to conventional second order phase transitions.Yang-Lee edge singularity occurs in the ferromagnetic Ising models above its critical temperatures in a purely imaginary magnetic field  h i (figure 1).For  > ( ) h h T YL , the partition function acquires zeros, which becomes dense on the line with > ( ) Ih h T YL .The density of Lee-Yang zeros  ( ) g T h , in the thermodynamic limit behaves as  ~ -s ( ) | ( )| g T h h h T , YL when   ( ) h h T YL from above, with σ being the universal critical