QuantumNAS: Noise-Adaptive Search for Robust Quantum Circuits

Simulation of the dynamics of quantum materials is emerging as a promising scientific application for noisy intermediate-scale quantum (NISQ) computers. Due to their high gate-error rates and short decoherence times, however, NISQ computers can only produce high-fidelity results for those quantum circuits smaller than some given circuit size. Dynamic simulations, therefore, pose a challenge as current algorithms produce circuits that grow in size with each subsequent time-step of the simulation. This underscores the crucial role of quantum circuit compilers to produce executable quantum circuits of minimal size, thereby maximizing the range of physical phenomena that can be studied within the NISQ fidelity budget. Here, we present two domain-specific (DS) quantum circuit compilers for the Rigetti and IBM quantum computers, specifically designed to compile circuits simulating dynamics under a special class of time-dependent Hamiltonians. The compilers outperform state-of-the-art general-purpose compilers in terms of circuit size reduction by around 25%–30% as well as wall-clock compilation time by around 40% (dependent on system size and simulation time-step). Drawing on heuristic techniques commonly used in artificial intelligence, both compilers scale well with simulation time-step and system size. Code for both compilers is open-source and packaged into a full-stack quantum simulation software with tutorials included for ease of use for future researchers wishing to perform dynamic simulations of quantum materials on quantum computers. As our DS compilers provide significant improvements in both compilation time and simulation fidelity, they provide a building block for accelerating progress toward physical quantum supremacy.

While current quantum computers, referred to as Noisy Intermediate-Scale Quantum (NISQ) computers, are expected to be beneficial for different applications, they are prone to different types of errors. In order to enhance the reliability of quantum systems, noise-aware quantum compilers are used to generate physical quantum circuits to be executed on NISQ computers. The quantum hardware is calibrated very frequently and its error rates are computed accordingly. Based on the hardware error rates, a quantum compiler allocates physical qubits and schedules quantum operations. However, error rates may change post-calibration. To incorporate dynamic error rates into quantum circuit compilation with minimum cost, we propose a Machine Learning (ML)-based scheme to detect the incorrect output of the quantum circuit and predict the Probability of Successful Trials (PST) with high accuracy. Our approach can verify the error rates of the quantum hardware and validate the correctness of the extracted quantum circuit output. We provide a case study of our ML-based reliability models using IBM Q16 Melbourne quantum computer. Our results show that the proposed scheme achieves a very high prediction accuracy.

Rapid advancement in the domain of quantum technologies have opened up researchers to the real possibility of experimenting with quantum circuits, and simulating small-scale quantum programs. Nevertheless, the quality of currently available qubits and environmental noise pose a challenge in smooth execution of the quantum circuits. Therefore, efficient design automation flows for mapping a given algorithm to the Noisy Intermediate Scale Quantum (NISQ) computer becomes of utmost importance. State-of-the-art quantum design automation tools are primarily focused on reducing logical depth, gate count and qubit counts with recent emphasis on topology-aware (nearest-neighbour compliance) mapping. In this work, we extend the technology mapping flows to simultaneously consider the topology and gate fidelity constraints while keeping logical depth and gate count as optimization objectives. We provide a comprehensive problem formulation and multi-tier approach towards solving it. The proposed automation flow is compatible with commercial quantum computers, such as IBM QX and Rigetti. Our simulation results over 10 quantum circuit benchmarks, show that the fidelity of the circuit can be improved up to 3.37 × with an average improvement of 1.87 ×.

Quantum state preparation is a key step in all digital quantum simulation algorithms. Here we propose methods to initialize on a gate-based quantum computer a general class of quantum spin wave functions, the so-called valence-bond-solid (VBS) states, that are important for two reasons. First, VBS states are the exact ground states of a class of interacting quantum spin models introduced by Affleck, Kennedy, Lieb, and Tasaki (AKLT). Second, the two-dimensional VBS states are universal resource states for measurement-based quantum computing. We find that schemes to prepare VBS states based on their tensor-network representations yield quantum circuits that are too deep to be within reach of noisy intermediate-scale quantum (NISQ) computers. We then apply the general nondeterministic method herein proposed to the preparation of the spin-1 and spin-3/2 VBS states, the ground states of the AKLT models defined in one dimension and in the honeycomb lattice, respectively. Shallow quantum circuits of depth independent of the lattice size are explicitly derived for both cases, making use of optimization schemes that outperform standard basis gate decomposition methods. The probabilistic nature of the proposed routine translates into an average number of repetitions to successfully prepare the VBS state that scales exponentially with the number of lattice sites N. However, two strategies to quadratically reduce this repetition overhead for any bipartite lattice are devised. Our approach should permit to use NISQ processors to explore the AKLT model and variants thereof, outperforming conventional numerical methods in the near future.

Calculations of molecular spectral properties, like photodissociation rates and absorption bands, rely on knowledge of the excited state energies of the molecule of interest. Protocols based on the variational quantum eigensolver (VQE) are promising candidates to calculate such energies on emerging noisy intermediate-scale quantum (NISQ) computers. The successful implementation of these protocols on NISQ computers, relies on ans\"atze that can accurately approximate the molecular states and that can be implemented by shallow quantum circuits. We introduce the excited qubit-excitation-based adaptive (e-QEB-ADAPT)-VQE protocol to calculate molecular-excited-state energies. The e-QEB-ADAPT-VQE constructs efficient problem-tailored ans\"atze by iteratively appending evolutions of qubit excitation operators. The e-QEB-ADAPT-VQE also improves on previous ADAPT-VQE protocol in that it is designed to be independent on the choice of initial reference state. We perform classical numerical simulations for LiH and ${\mathrm{BeH}}_{2}$ to benchmark the performance of the e-QEB-ADAPT-VQE. We demonstrate that the e-QEB-ADAPT-VQE can construct highly accurate ans\"atze that require at least an order of magnitude fewer cnot gates than standard fixed unitary coupled-cluster ans\"atze, such as the UCCSD and the GUCCSD. We also show that the e-QEB-ADAPT-VQE is more successful in constructing ans\"atze for excited molecular states than other ADAPT-VQE protocols.

The development of near-term quantum computers, referred to as Noisy Intermediate-Scale Quantum (NISQ) computers, has progressed rapidly in the past few years resulting in several quantum computers which vary in their underlying technology and physical constraints. The performance of these computers also varies from one quantum algorithm to another. To enable efficient selection of the quantum computer that provides the highest output fidelity for a given application, an accurate noise modeling of each quantum hardware is required. However, noise modeling for a given application is a complex problem because of the unknown interaction between the quantum circuit parameters and the noise parameters of NISQ devices. We propose the use of Machine Learning (ML) to model the performance of different quantum computers at the application level. The ML models predict the output fidelity of the quantum application executed on different quantum computers given their publicly available physical constraints. We use a diverse training dataset to cover the key features for application-level benchmarking of the quantum hardware. Our results obtained from different superconducting quantum devices show that our proposed ML models enable cost-effective quantum computer selection for different quantum applications with different fidelity metrics.

Noisy Intermediate-Scale Quantum (NISQ) computers impose severe architectural constraints that prevent direct execution of logical quantum circuits. As a result, quantum circuit mapping—transforming ideal circuits into hardware-compatible forms—has become a critical task in quantum software toolchains. This paper presents a comparative study of key mapping techniques, focusing on circuit depth, SWAP gate overhead, and fidelity awareness. Through a case analysis on a 5-qubit Quantum Fourier Transform (QFT) circuit, we demonstrate the performance trade-offs of several prominent mapping strategies, including naive greedy routing, Qiskit’s SABRE, and CQC’s t|ket>. Our findings reveal that mapping technique selection has a profound impact on circuit quality and feasibility on real NISQ hardware.

Compiling high-level quantum programs to machines that are size constrained (i.e. limited number of quantum bits) and time constrained (i.e. limited number of quantum operations) is challenging. In this paper, we present SQUARE (Strategic QUantum Ancilla REuse), a compilation infrastructure that tackles allocation and reclamation of scratch qubits (called ancilla) in modular quantum programs. At its core, SQUARE strategically performs uncomputation to create opportunities for qubit reuse. Current Noisy Intermediate-Scale Quantum (NISQ) computers and forward-looking Fault-Tolerant (FT) quantum computers have fundamentally different constraints such as data locality, instruction parallelism, and communication overhead. Our heuristic-based ancilla-reuse algorithm balances these considerations and fits computations into resource-constrained NISQ or FT quantum machines, throttling parallelism when necessary. To precisely capture the workload of a program, we propose an improved metric, the "active quantum volume," and use this metric to evaluate the effectiveness of our algorithm. Furthermore, our results show that SQUARE improves the average success rate of NISQ applications by 1.47X. Surprisingly, the additional gates for uncomputation create ancilla with better locality, and result in substantially fewer swap gates and less gate noise overall. SQUARE also achieves an average reduction of 1.5X (and up to 9.6X) in active quantum volume for FT machines.

Quantum computing has already demonstrated great computational potential across multiple domains and has received more and more attention. However, due to the connectivity limitations of Noisy Intermediate-Scale Quantum (NISQ) devices, most of the quantum algorithms cannot be directly executed without the help of inserting SWAP gates. Nevertheless, more SWAP gates lead to a longer execution time and, inevitably, lower fidelity of the algorithm. To this end, this paper proposes an optimized qubit mapping algorithm based on a dynamic look-ahead strategy to minimize the number of SWAP gates inserted. Firstly, a heuristic algorithm is proposed based on maximizing physical qubit connectivity to generate the optimal initial qubit mapping, which reduces the need for logical qubit shifts during subsequent SWAP gate insertion. Secondly, in the form of directed acyclic graphs, we identify quantum gates that violate the constraints of physical coupling and insert SWAP gates to remap qubits, thereby overcoming the limitations of qubit interactions. Finally, the optimal SWAP gate insertion strategy is built by comparing the cost of different SWAP gate insertion strategies through a multi-window look-ahead strategy to reduce the number of SWAP gates inserted. The experimental results show that the strategy in this paper decreases the number of SWAP gate insertions and significantly reduces the depth of quantum circuits when performing qubit mapping compared with state-of-the-art methods.

In this work, we introduce the Quantum Adaptive Excitation Network (QAE-Net), a hybrid quantum-classical framework designed to enhance channel attention mechanisms in Convolutional Neural Networks (CNNs). QAE-Net replaces the classical excitation block of Squeeze-and-Excitation modules with a shallow Variational Quantum Circuit (VQC), leveraging quantum superposition and entanglement to capture higher-order inter-channel dependencies that are challenging to model with purely classical approaches. We evaluate QAE-Net on benchmark image classification tasks, including MNIST, FashionMNIST, and CIFAR-10, and observe consistent performance improvements across all datasets, with particularly notable gains on tasks involving three-channel inputs. Furthermore, experimental results demonstrate that increasing the number of variational layers in the quantum circuit leads to progressively higher classification accuracy, underscoring the expressivity benefits of deeper quantum models. These findings highlight the potential of integrating VQCs into CNN architectures to improve representational capacity while maintaining compatibility with nearterm quantum devices. The proposed approach is tailored for the Noisy Intermediate-Scale Quantum (NISQ) era, offering a scalable and feasible pathway for deploying quantum-enhanced attention mechanisms in practical deep learning workflows.

Quantum Machine Learning (QML) is an emerging, powerful paradigm at the intersection of quantum computing and artificial intelligence, with the potential to enhance medical image analysis. We compared their performance with classical counterparts, while critically examining the gap between theoretical quantum advantages and the practical constraints of current Noisy Intermediate-Scale Quantum (NISQ) implementations. This review explored the current landscape of QML-based methodologies applied to key medical imaging modalities - Magnetic Resonance Imaging (MRI), Computed Tomography (CT), X-rays, and histopathology. We systematically analyzed how quantum-enhanced models were employed for critical tasks such as image classification, segmentation, and reconstruction, and we compared their performance with that of classical counterparts. The review delved into the architectural innovations that enabled these quantum approaches, including hybrid quantum-classical frameworks, variational quantum circuits, and quantum convolutional neural networks. Particular emphasis was given to the clinical relevance of QML applications, from early diagnostics to real-time surgery planning, and how quantum advantage might influence data efficiency, interpretability, along computational scalability. Finally, we highlighted current challenges in data encoding, noise resilience, and hardware limitations, and discussed promising future directions that could enable the practical deployment of QML in healthcare settings. This comprehensive review aimed to serve as a foundational reference for researchers and practitioners looking to harness quantum computing in medical imaging and precision medicine.

One of the key challenges in current Noisy Intermediate-Scale Quantum (NISQ) computers is to control a quantum system with high-fidelity quantum gates. There are many reasons a quantum gate can go wrong - for superconducting transmon qubits in particular, one major source of gate error is the unwanted crosstalk between neighboring qubits due to a phenomenon called frequency crowding. We motivate a systematic approach for understanding and mitigating the crosstalk noise when executing near-term quantum programs on superconducting NISQ computers. Here, we present a general software solution to alleviate frequency crowding by systematically tuning qubit frequencies according to input programs, trading parallelism for higher gate fidelity when necessary. The net result is that our work dramatically improves the crosstalk resilience of tunable-qubit, fixed-coupler hardware, matching or surpassing other more complex architectural designs such as tunable-coupler systems. On NISQ benchmarks, we improve worst-case program success rate by 13.3x on average, compared to existing traditional serialization strategies.

Variational Quantum Circuits (VQCs) have emerged as a cornerstone of hybrid quantum–classical algorithms designed to harness the computational potential of near-term quantum devices. By combining parameterized quantum gates with classical optimization, VQCs provide a flexible framework for tackling machine learning, chemistry, and optimization problems intractable for classical methods. This review comprehensively overviews VQC design principles, ansatz structures, optimization strategies, and real-world applications. Furthermore, we discuss fundamental challenges such as barren plateaus, the expressibility–trainability trade-off, and current noisy intermediate-scale quantum (NISQ) hardware limitations. Finally, we highlight emerging directions that could enable scalable, noise-resilient, and physically interpretable variational quantum models for future quantum computing applications

Quantum Random Access Memory (QRAM) plays a pivotal role in accelerating quantum algorithms, especially in quantum machine learning. However, its implementation on noisy intermediate-scale quantum (NISQ) computers faces major challenges due to high qubit requirements and large circuit depth. These factors amplify quantum noise, limiting QRAM performance and scalability. In this work, we introduce a gate-pruning strategy that mitigates noise while preserving QRAM functionality. Our approach reduces circuit depth by eliminating small-angle rotation gates which are particularly noise-sensitive on NISQ hardware. This pruning significantly improves QRAM resilience without compromising data-loading efficiency or superposition-based querying. We further show that the pruned QRAM supports a variational quantum classifier capable of parallel training with logarithmic qubit scaling. Experiments on benchmark datasets confirm that our approach enhances noise resilience and classification accuracy, underscoring its potential for practical quantum machine learning in the NISQ era.

Distributed quantum computing (DQC) architectures offer a scalable solution for the computational demands of large-scale quantum computing. In near-term DQC architectures, the costly remote quantum communication and the execution cost within quantum chips together significantly limit the execution efficiency of quantum circuits. To comprehensively optimize both costs, we propose DMapS, which consists of end-to-end algorithms for qubit mapping and routing. The qubit mapping component, DMapS-M, adopts a two-stage mapping strategy that decomposes a large quantum circuit into smaller ones and parallelizes the qubit mapping on quantum chips. The qubit routing component, DMapS-R, reduces remote quantum communication overhead by prioritizing the insertion of local SWAP gates and further improves transpilation efficiency by exploiting parallelism within chips. Our experimental results show that DMapS-M reduces overall overhead (including both remote quantum communication overhead and local SWAP gate overhead) by an average of 43.44% and 59.72%, respectively, compared to two baseline algorithms, and achieves an average speedup of 87.05x. DMapS-R, compared to the baseline algorithm, reduces overall overhead by an average of 8.85% and achieves an average transpilation speedup of 2.78×. Moreover, compared to the DQC-oriented quantum compiler, DMapS reduces remote communication overhead by an average of 75.16%.