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arXiv:2212.04913 · Journal of Physics Conference Series

Review of ansatz designing techniques for variational quantum algorithms

Junhan Qin

Published Nov 1, 2023• 16 citations
arXivHTMLPDF

Abstract

Abstract For a large number of tasks, quantum computing demonstrates the potential for exponential acceleration over classical computing. In the NISQ era, variable-component subcircuits enable applications of quantum computing. To reduce the inherent noise and qubit size limitations of quantum computers, existing research has improved the accuracy and efficiency of Variational Quantum Algorithm (VQA). In this paper, we explore the various ansatz improvement methods for VQAs at the gate level and pulse level, and classify, evaluate and summarize them.

DOI
10.1088/1742-6596/2634/1/012043

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Abstract For a large number of tasks, quantum computing demonstrates the potential for exponential acceleration over classical computing. In the NISQ era, variable-component subcircuits enable applications of quantum computing. To reduce the inherent noise and qubit size limitations of quantum computers, existing research has improved the accuracy and efficiency of Variational Quantum Algorithm (VQA). In this paper, we explore the various ansatz improvement methods for VQAs at the gate level and pulse level, and classify, evaluate and summarize them.
Quantum computers promise a great computational advantage over classical computers, which might help solve various computational challenges such as the simulation of complicated quantum systems, finding optimum in large optimization problems, and solving large-scale linear algebra problems. Current available quantum devices have only a limited amount of qubits and a high level of noise, limiting the size of problems that can be solved accurately with those devices. Variational quantum algorithms (VQAs) have emerged as a leading strategy to address these limitations by optimizing cost function based on measurement results of shallow depth circuits. Recently, various pulse engineering methods were suggested in order to improve VQA results, including optimizing pulse parameters instead of gate angles as part of the VQA optimization process. In this paper, we suggest a novel pulse-based ansatz, which is parameterized mainly by pulses’ duration of pre-defined pulse structures. This ansatz structure provides relatively low amounts of optimization parameters while maintaining high expressibility, allowing fast convergence. In addition, the ansatz has structured adaptivity to the entanglement level required by the problem, allowing low noise and accurate results. We tested this ansatz against quantum chemistry problems. Specifically, finding the ground-state energy associated with the electron configuration problem, using the variational quantum eigensolver (VQE) algorithm for several different molecules. We manage to achieve chemical accuracy both in simulation for several molecules and on one of IBM’s NISQ devices for the H2 molecule in the STO-3G basis, without the need for extensive error mitigation. Our results are compared to a common gate-based ansatz and show better accuracy and significant latency reduction—up to 7× shorter ansatz schedules.
Variational quantum algorithms (VQAs) are the leading candidates for practical applications of noisy intermediate-scale quantum (NISQ) devices. Recently, pulse-based variational quantum algorithms (p-VQAs) have emerged as a compelling alternative to traditional gate-based VQAs. By optimizing continuous control fields directly on hardware-native Hamiltonians, pulse-based methods are easy to implement and can significantly reduce quantum resource overhead, thereby enhancing the overall performance of quantum algorithms on NISQ devices. In this review, we present a comprehensive survey over recent advances in p-VQAs, covering theory, algorithms, and hardware deployments across various quantum computing platforms. We also review applications of p-VQAs to variational quantum eigensolver in quantum chemistry, quantum approximate optimization algorithm for combinatorial optimization, and quantum machine learning tasks.
Variational quantum algorithms (VQAs) have demonstrated great potentials in the Noisy Intermediate Scale Quantum (NISQ) era. In the workflow of VQA, the parameters of ansatz are iteratively updated to approximate the desired quantum states. We have seen various efforts to draft better ansatz with less gates. Some works consider the physical meaning of the underlying circuits, while others adopt the ideas of neural architecture search (NAS) for ansatz generator. However, these designs do not exploit the full advantages of VQAs. Because most techniques target gate ansatz, and the parameters are usually rotation angles of the gates. In quantum computers, the gate ansatz will eventually be transformed into control signals such as microwave pulses on superconducting qubits. These control pulses need elaborate calibrations to minimize the errors such as over-rotation and under-rotation. In the case of VQAs, this procedure will introduce redundancy, but the variational properties of VQAs can naturally handle problems of over-rotation and under-rotation by updating the amplitude and frequency parameters. Therefore, we propose NAPA, a native-pulse ansatz generator framework for VQAs. We generate native-pulse ansatz with trainable parameters for amplitudes and frequencies. In our proposed NAPA, we are tuning parametric pulses, which are natively supported on NISQ computers. Given the limited availability of gradient-based optimizers for pulse-level quantum programs, we choose to deploy non-gradient optimizers in our framework. To constrain the number of parameters sent to the optimizer, we adopt a progressive way to generate our native-pulse ansatz. Experiments are conducted on both simulators and quantum devices for Variational Quantum Eigensolver (VQE) tasks to evaluate our methods.
Variational quantum algorithms (VQAs) have established themselves as a central computational paradigm in the Noisy Intermediate-Scale Quantum (NISQ) era. By coupling parameterized quantum circuits (PQCs) with classical optimization, they operate effectively under strict hardware limitations. However, as quantum architectures transition toward early fault-tolerant (EFT) and ultimate fault-tolerant (FT) regimes, the foundational principles and long-term viability of VQAs require systematic reassessment. This review offers an insightful analysis of VQAs and their progression toward the fault-tolerant regime. We deconstruct the core algorithmic framework by examining ansatz design and classical optimization strategies, including cost function formulation, gradient computation, and optimizer selection. Concurrently, we evaluate critical training bottlenecks, notably barren plateaus (BPs), alongside established mitigation strategies. The discussion then explores the EFT phase, detailing how the integration of quantum error mitigation and partial error correction can sustain algorithmic performance. Addressing the FT phase, we analyze the inherent challenges confronting current hybrid VQA models. Furthermore, we synthesize recent VQA applications across diverse domains, including many-body physics, quantum chemistry, machine learning, and mathematical optimization. Ultimately, this review outlines a theoretical roadmap for adapting quantum algorithms to future hardware generations, elucidating how variational principles can be systematically refined to maintain their relevance and efficiency within an error-corrected computational environment.
Variational quantum algorithms (VQAs) have demonstrated great potentials in the Noisy Intermediate Scale Quantum (NISQ) era. In the workflow of VQA, the parameters of ansatz are iteratively updated to approximate the desired quantum states. We have seen various efforts to draft better ansatz with less gates. Some works consider the physical meaning of the underlying circuits, while others adopt the ideas of neural architecture search (NAS) for ansatz generator. However, these designs do not exploit the full advantages of VQAs. Because most techniques target gate ansatz, and the parameters are usually rotation angles of the gates. In quantum computers, the gate ansatz will eventually be transformed into control signals such as microwave pulses on superconducting qubits. These control pulses need elaborate calibrations to minimize the errors such as over-rotation and under-rotation. In the case of VQAs, this procedure will introduce redundancy, but the variational properties of VQAs can naturally handle problems of over-rotation and under-rotation by updating the amplitude and frequency parameters. Therefore, we propose NAPA, a native-pulse ansatz generator framework for VQAs. We generate native-pulse ansatz with trainable parameters for amplitudes and frequencies. In our proposed NAPA, we are tuning parametric pulses, which are natively supported on NISQ computers. Given the limited availability of gradient-based optimizers for pulse-level quantum programs, we choose to deploy non-gradient optimizers in our framework. To constrain the number of parameters sent to the optimizer, we adopt a progressive way to generate our nativepulse ansatz. Experiments are conducted on both simulators and quantum devices for Variational Quantum Eigensolver (VQE) tasks to envaluate our methods. When adopted on NISQ machines, NAPA obtained improved the performance with decreased latency by an average of 86%. NAPA is able to achieve 96.482% and 99.336% accuracy for VQE tasks on H2 and HeH+ respectively. An average accuracy of 97.27% is achieved for medium-size quantum chemistry tasks on CO2, H2O, and NaH. NAPA also demonstrates advantages on quantum optimization tasks even with considerable noises in NISQ machines.
Variational quantum algorithms (VQAs) are a leading framework for realizing quantum advantages in the Noisy Intermediate-Scale Quantum (NISQ) era, with applications spanning discrete combinatorial problems and continuous optimization. While the topologies of parameterized quantum circuits (ansatzes) fundamentally govern both expressibility and trainability in continuous landscapes, existing reviews predominantly focus on static algorithmic classifications or discrete settings, leaving the structural evolution and practical limitations of ansatz architectures insufficiently explored. To address this gap, this review presents a systematic analysis of variational ansatz architectures, tracing their progression from static, pre-defined topologies to adaptive growth mechanisms. Beyond traditional gradient-driven and architecture-search paradigms, we evaluate supplementary strategies such as layerwise training and noise-adaptive construction, revealing inherent vulnerabilities such as local minima entrapment and the compilation overhead induced by calibration drift. The mathematical foundations of VQAs are outlined, and representative fixed ansatz architectures, including hardware-efficient, physics-inspired, and problem-specific designs, are characterized within continuous-domain mappings. Intrinsic limitations arising from barren plateaus (BPs) and noise-induced barren plateaus (NIBPs) are analyzed, revealing the fundamental coupling between circuit depth, parameter scaling, and trainability degradation. Furthermore, adaptive construction strategies and recent advances in automated variational quantum architecture search (VQAS) are examined. Through the synthesis of intrinsic limitations (BPs, NIBPs, and hardware-algorithm coupling) and the evaluation of standardized benchmarking protocols, this review rigorously assesses the resource trade-offs of current VQA frameworks. Ultimately, next-generation ansatz design will adopt hardware–software co-design principles grounded in physical constraints, enabling scalable and noise-resilient quantum optimization.