Quantum architecture search (QAS) has shown significant promise in automating quantum circuit design for Variational Quantum Algorithms (VQAs). However, a central challenge remains in the high computational cost of evaluating the ground-truth performance of numerous circuit architectures during the search process. This challenge is further complicated by factors such as inefficient gradient computation, the barren plateau phenomenon, and frequent data exchange between classical and quantum systems within VQAs, all of which restrict the scalability of QAS for increasingly complex VQAs. In this study, we investigate whether quantum architectures discovered on small-scale systems can be directly extended to large-scale quantum circuits. Our results demonstrate that the performance advantage of an optimal quantum architecture, identified on a small-scale system via a layerwise construction method, can be largely preserved and effectively transferred to large-scale systems. This work establishes a viable and efficient paradigm for designing effective large-scale quantum circuits, offering a practical shortcut that bypasses the primary bottlenecks of conventional QAS.
Quantum architecture search (QAS) has shown significant promise in automating quantum circuit design for Variational Quantum Algorithms (VQAs). However, a central challenge remains in the high computational cost of evaluating the ground-truth performance of numerous circuit architectures during the search process. This challenge is further complicated by factors such as inefficient gradient computation, the barren plateau phenomenon, and frequent data exchange between classical and quantum systems within VQAs, all of which restrict the scalability of QAS for increasingly complex VQAs. In this study, we investigate whether quantum architectures discovered on small-scale systems can be directly extended to large-scale quantum circuits. Our results demonstrate that the performance advantage of an optimal quantum architecture, identified on a small-scale system via a layerwise construction method, can be largely preserved and effectively transferred to large-scale systems. This work establishes a viable and efficient paradigm for designing effective large-scale quantum circuits, offering a practical shortcut that bypasses the primary bottlenecks of conventional QAS.
Designing efficient variational quantum algorithms (VQAs) is crucial for transforming the theoretical advantages of quantum algorithms into practical applications. In this context, quantum architecture search (QAS) has been introduced to automate the search and design of VQAs. However, current mainstream QAS algorithms typically perform both global and local searches simultaneously, which can result in high search space complexity and optimization challenges. In this paper, we propose a hierarchical quantum architecture search framework based on a two-stage search structure. In the first stage, global exploration of the overall quantum circuit structure is performed, while in the second stage, local optimization of quantum gate selection is carried out. We provide a numerical analysis of the theoretical advantages of the proposed framework in reducing the search space. To evaluate practical performance, we conduct experiments on quantum chemistry tasks with different algorithm combinations integrated into the framework. The results demonstrate the effectiveness of the hierarchical search structure in automating quantum circuit design.
Quantum error mitigation techniques are at the heart of quantum hardware implementation, and are the key to performance improvement of the variational quantum learning scheme (VQLS). Although VQLS is partially robust to noise, both empirical and theoretical results exhibit that noise would rapidly deteriorate the performance of most variational quantum algorithms in large-scale problems. Furthermore, VQLS suffers from the barren plateau phenomenon---the gradient generated by the classical optimizer vanishes exponentially with respect to the qubit number. Here we devise a resource and runtime efficient scheme, the quantum architecture search scheme (QAS), to maximally improve the robustness and trainability of VQLS. In particular, given a learning task, QAS actively seeks an optimal circuit architecture to balance benefits and side-effects brought by adding more quantum gates. Specifically, while more quantum gates enable a stronger expressive power of the quantum model, they introduce a larger amount of noise and a more serious barren plateau scenario. Consequently, QAS can effectively suppress the influence of quantum noise and barren plateaus. We implement QAS on both the numerical simulator and real quantum hardware, via the IBM cloud, to accomplish data classification and quantum chemistry tasks. Numerical and experimental results show that QAS significantly outperforms conventional variational quantum algorithms with heuristic circuit architectures. Our work provides practical guidance for developing advanced learning-based quantum error mitigation techniques on near-term quantum devices.
Variational quantum algorithms (VQAs) constitute a prominent paradigm for exploring the capabilities of near-term quantum computers. As the effectiveness of VQAs depends heavily on the design of variational quantum circuits, Quantum Architecture Search (QAS) has emerged as a critical research area to automate the discovery of high-performing circuit structures. This paper reviews key advancements in current research on QAS, including its core concepts, representative methodologies, applications, and emerging trends. The content is structured to ensure broad accessibility for a diverse audience of researchers while preserving the core principles of complex methodologies. In addition, we discuss remaining challenges and suggest potential research directions to offer perspectives on future exploration in this rapidly evolving field.
Variational Quantum Algorithms (VQAs) are central to the utility of Noisy Intermediate-Scale Quantum (NISQ) devices, but their performance is critically dependent on the design of the parameterized quantum circuit (PQC) ansatz. Manual design of these circuits is a complex, non-trivial task requiring significant expertise. To address this, Quantum Architecture Search (QAS) has emerged to automate the discovery of optimal circuit structures. However, many QAS methods incur substantial computational costs by requiring full training of candidate circuits. In this paper, we introduce QAS via iterative elimination, a novel framework that efficiently identifies high-performing circuits. Our method begins with a large, randomly generated population of circuits and iteratively prunes this set based on a composite score that evaluates both immediate performance and trainability. We introduce a dynamic weighting scheme that initially prioritizes trainability to avoid barren plateaus and gradually shifts focus to performance as the search progresses. We validate our approach on Variational Quantum Eigensolver (VQE) tasks for the 6-qubit Transverse Field Ising Model and the 5-qubit Heisenberg model. Experimental results show that our method, particularly with the dynamic weighting, discovers circuits that are competitive with those found by state-of-the-art training-free QAS methods, demonstrating a powerful balance between search efficiency and solution quality.
A significant hurdle in the noisy intermediate-scale quantum (NISQ) era is identifying functional quantum circuits. These circuits must also adhere to the constraints imposed by current quantum hardware limitations. Variational quantum algorithms (VQAs), a class of quantum-classical optimization algorithms, were developed to address these challenges in the currently available quantum devices. However, the overall performance of VQAs depends on the initialization strategy of the variational circuit, the structure of the circuit (also known as ansatz), and the configuration of the cost function. Focusing on the structure of the circuit, in this thesis, we improve the performance of VQAs by automating the search for an optimal structure for the variational circuits using reinforcement learning (RL). Within the thesis, the optimality of a circuit is determined by evaluating its depth, the overall count of gates and parameters, and its accuracy in solving the given problem. The task of automating the search for optimal quantum circuits is known as quantum architecture search (QAS). The majority of research in QAS is primarily focused on a noiseless scenario. Yet, the impact of noise on the QAS remains inadequately explored. In this thesis, we tackle the issue by introducing a tensor-based quantum circuit encoding, restrictions on environment dynamics to explore the search space of possible circuits efficiently, an episode halting scheme to steer the agent to find shorter circuits, a double deep Q-network (DDQN) with an ε-greedy policy for better stability. The numerical experiments on noiseless and noisy quantum hardware show that in dealing with various VQAs, our RL-based QAS outperforms existing QAS. Meanwhile, the methods we propose in the thesis can be readily adapted to address a wide range of other VQAs.
Balancing trainability and expressibility is a central challenge in variational quantum computing, and quantum architecture search (QAS) plays a pivotal role by automatically designing problem-specific parameterized circuits that address this trade-off. In this work, we introduce a scalable, training-free QAS framework that efficiently explores and evaluates quantum circuits through landscape fluctuation analysis. This analysis captures key characteristics of the cost function landscape, enabling accurate prediction of circuit learnability without costly training. By combining this metric with a streamlined two-level search strategy, our approach identifies high-performance, large-scale circuits with higher accuracy and fewer gates. We further demonstrate the practicality and scalability of our method, achieving significantly lower classical resource consumption compared to prior work. Notably, our framework attains robust performance on a challenging 50-qubit quantum many-body simulation, highlighting its potential for addressing complex quantum problems.