We discuss here some aspects related to the symmetries of a quantum many-body problem when trying to treat it on a quantum computer. Several features related to symmetry conservation, symmetry breaking, and possible symmetry restoration are reviewed. After briefly discussing some of the standard symmetries relevant for many-particle systems, we discuss the advantage of encoding some symmetries directly in quantum ansätze, especially to reduce the quantum register size. It is, however, well-known that the use of symmetry-breaking states can also be a unique way to incorporate specific internal correlations when a spontaneous symmetry breaking occurs. These aspects are discussed in the quantum computing context. Ultimately, an accurate description of quantum systems can be achieved only when the initially broken symmetries are properly restored. We review several methods explored previously to perform symmetry restoration on a quantum computer, for instance, the ones based on symmetry filtering by quantum phase estimation and by an iterative independent set of Hadamard tests. We propose novel methods that pave the new directions to perform symmetry restoration, like those based on the purification of the state employing the linear combination of unitaries (LCU) approach.
We discuss here some aspects related to the symmetries of a quantum many-body problem when trying to treat it on a quantum computer. Several features related to symmetry conservation, symmetry breaking, and possible symmetry restoration are reviewed. After briefly discussing some of the standard symmetries relevant for many-particle systems, we discuss the advantage of encoding some symmetries directly in quantum ansätze, especially to reduce the quantum register size. It is, however, well-known that the use of symmetry-breaking states can also be a unique way to incorporate specific internal correlations when a spontaneous symmetry breaking occurs. These aspects are discussed in the quantum computing context. Ultimately, an accurate description of quantum systems can be achieved only when the initially broken symmetries are properly restored. We review several methods explored previously to perform symmetry restoration on a quantum computer, for instance, the ones based on symmetry filtering by quantum phase estimation and by an iterative independent set of Hadamard tests. We propose novel methods that pave the new directions to perform symmetry restoration, like those based on the purification of the state employing the linear combination of unitaries (LCU) approach.
Symmetry is fundamental in the description and simulation of quantum systems. Leveraging symmetries in classical simulations of many-body quantum systems can result in significant overhead due to the exponentially growing size of some symmetry groups as the number of particles increases. Quantum computers hold the promise of achieving exponential speedup in simulating quantum many-body systems; however, a general method for utilizing symmetries in quantum simulations has not yet been established. In this work, we present a unified framework for incorporating symmetry group transforms on quantum computers to simulate many-body systems. The core of our approach lies in the development of efficient quantum circuits for symmetry-adapted projection onto irreducible representations of a group or pairs of commuting groups. We provide resource estimations for common groups, including the cyclic and permutation groups. Our algorithms demonstrate the capability to prepare coherent superpositions of symmetry-adapted states and to perform quantum evolution across a wide range of models in condensed-matter physics and ab initio electronic structure in quantum chemistry. Specifically, we execute a symmetry-adapted quantum subroutine for small molecules in first-quantization on noisy hardware and demonstrate the emulation of symmetry-adapted quantum phase estimation for preparing coherent superpositions of quantum states in various irreducible representations of a symmetry group. In addition, we present a discussion of open problems regarding treating symmetries in digital quantum simulations of many-body systems, paving the way for future systematic investigations into leveraging symmetries quantumly for practical quantum advantage. The broad applicability and rigorous resource estimation for symmetry transformations make our framework appealing for achieving provable quantum advantage on fault-tolerant quantum computers, especially for symmetry-related properties.
This thesis explores the application of the Symmetry-Breaking/Symmetry-Restoration methodology on quantum computers to better approximate a Hamiltonian's ground state energy within a variational framework in many-body physics. This involves intentionally breaking and restoring the symmetries of the wave function ansatz at different stages of the variational search for the ground state. The Variational Quantum Eigensolver (VQE) is utilized for the variational component together with an ansatz inspired by the Bardeen-Cooper-Schrieffer (BCS) theory. The applications were demonstrated using the pairing and Hubbard Hamiltonians. Two approaches were identified with the VQE method: varying the symmetry-breaking ansatz parameters before or after symmetry restoration, termed Quantum Projection After Variation and Quantum Variation After Projection, respectively. The main contribution of this thesis was the development of a variety of symmetry restoration techniques based on the principles of the Quantum Phase Estimation algorithm, the notion of a Quantum "Oracle," and the Classical Shadow formalism. In the final part, hybrid quantum-classical techniques were introduced to extract an approximation of the low-lying spectrum of a Hamiltonian. Assuming accurate Hamiltonian moment extraction from their generating function with a quantum computer, two methods were presented for spectral analysis: the t-expansion method and the Krylov method, which provides, in particular, information about the evolution of the survival probability. Furthermore, the Quantum Krylov method was introduced, offering similar insights without the need to estimate Hamiltonian moments, a task that can be difficult on near-term quantum computers.
Symmetries play a pivotal role in our understanding of the properties of quantum many-body systems. While there are theorems and a well-established toolbox for systems in thermal equilibrium, much less is known about the role of symmetries and their connection to dynamics out of equilibrium. This arises due to the direct link between a system’s thermal state and its Hamiltonian, which is generally not the case for nonequilibrium dynamics. Here we present a pathway to identify the effective symmetries and to extract them from data in nonequilibrium quantum many-body systems. Our approach is based on exact relations between correlation functions involving different numbers of spatial points, which can be viewed as nonequilibrium versions of (equal-time) Ward identities encoding the symmetries of the system. We derive symmetry witnesses, which are particularly suitable for the analysis of measured or simulated data at different snapshots in time. To demonstrate the potential of the approach, we apply our method to numerical and experimental data for a spinor Bose gas. We investigate the important question of a dynamical restoration of an explicitly broken symmetry of the Hamiltonian by the initial state. Remarkably, it is found that effective symmetry restoration can occur long before the system equilibrates. We also use the approach to define and identify spontaneous symmetry breaking far from equilibrium, which is of great relevance for applications to nonequilibrium phase transitions. Our work opens new avenues for the classification and analysis of quantum as well as classical many-body dynamics in a large variety of systems, ranging from ultracold quantum gases to cosmology.
Entanglement asymmetry, which serves as a diagnostic tool for symmetry breaking and a proxy for thermalization, has recently been proposed and studied in the context of symmetry restoration for quantum many-body systems undergoing a quench. In this Letter, we investigate symmetry restoration in various symmetric random quantum circuits, particularly focusing on the U(1) symmetry case. In contrast to nonsymmetric random circuits where the U(1) symmetry of a small subsystem can always be restored at late times, we reveal that symmetry restoration can fail in U(1)-symmetric circuits for certain weak symmetry-broken initial states in finite-size systems. In the early-time dynamics, we observe an intriguing quantum Mpemba effect implying that symmetry is restored faster when the initial state is more asymmetric. Furthermore, we also investigate the entanglement asymmetry dynamics for SU(2) and Z_{2} symmetric circuits and identify the presence and absence of the quantum Mpemba effect for the corresponding symmetries, respectively. A unified understanding of these results is provided through the lens of quantum thermalization with conserved charges.
We present systematic and resource-efficient constructions of continuous symmetry projectors, particularly U(1) particle number and SU(2) total spin, tailored for fault-tolerant quantum computations. Our approach employs a linear combination of unitaries (LCU) as well as generalized quantum signal processing (GQSP and GQSVT) to implement projectors. These projectors can then be coherently applied as state filters prior to quantum phase estimation (QPE). We analyze their asymptotic gate complexities for explicit circuit realizations. For the particle number and Sz symmetries, GQSP offers favorable resource usage features owing to its low ancilla qubit requirements and robustness to finite precision rotation gate synthesis. For the total spin projection, the structured decomposition of P^S,MS reduces the projector T gate count. Numerical simulations show that symmetry filtering substantially increases the QPE success probability, leading to a lower overall cost compared to that of unfiltered approaches across representative molecular systems. Resource estimates further indicate that the cost of symmetry filtering is 3 to 4 orders of magnitude lower than that of the subsequent phase estimation step This advantage is especially relevant in large, strongly correlated systems, such as FeMoco, a standard strongly correlated open-shell benchmark. For FeMoco, the QPE cost is estimated at ∼1010 T gates, while our symmetry projector requires only ∼106--107 T gates. These results establish continuous-symmetry projectors as practical and scalable tools for state preparation in quantum chemistry and provide a pathway toward realizing more efficient fault-tolerant quantum simulations.
Starting from the quantum-phase-estimate (QPE) algorithm, a method is proposed to construct entangled states that describe correlated many-body systems on quantum computers. Using operators for which the discrete set of eigenvalues is known, the QPE approach is followed by measurements that serve as projectors on the entangled states. These states can then be used as inputs for further quantum or hybrid quantum-classical processing. When the operator is associated with a symmetry of the Hamiltonian, the approach can be seen as a quantum-computer formulation of symmetry breaking followed by symmetry restoration. The method, called discrete spectra assisted, is applied to superfluid systems. By using the blocking technique adapted to qubits, the full spectra of a pairing Hamiltonian is obtained.