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arXiv:2607.21688

Explainable quantum-compressed machine learning for complex fluid flows

Xiao Xue, Maida Wang, Mingyang Gao, Minh Chung, Peter V. Coveney

physics.flu-dyncs.LGquant-phSubmitted Jul 23, 2026• Announced Jul 24, 2026• 0 citations
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Abstract

Machine-learning surrogates of physical systems face a paradox: explainable models facing the challenge of expressivity to capture complex nonlinear flows, whereas expressive deep surrogates match high-fidelity simulations only through massive parameterisations that turn the learned dynamics into a black box. Here, we introduce quantum-compressed machine learning (QCML), which resolves this tension by compressing the latent propagator of a flow surrogate from $524{,}288$ trainable parameters to no more than $8$. This parameter reduction brings the learned dynamical law to the parameter scale of a physical constitutive relation rather than a black-box neural network, making the surrogate directly interpretable and controllable without sacrificing expressivity. The compression is realised by a structured quantum circuit whose unitary propagator constrains the latent spectrum to the unit circle exactly and by construction, replacing exponential error growth with linear accumulation over autoregressive rollouts. Classical regularisation only approximates this constraint: even a quantum-inspired classical baseline penalised towards unitarity collapses within one Lyapunov time on turbulent channel flow, whereas QCML remains stable over the full rollout. Shared phase and coupling angles parameterising the circuit correspond directly to modal frequencies and inter-mode interactions, giving the learned dynamics a physical interpretation in spectral space. On two patient-specific cardiovascular benchmarks, the structured QCML propagator matches the predictive accuracy of its classical counterpart on surface pressure spectra, pressure drop, and wall shear stress. These results establish QCML as a working component of scientific machine learning and a concrete contribution towards practical quantum advantage in real-world prediction.

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Machine-learning surrogates of physical systems face a paradox: explainable models facing the challenge of expressivity to capture complex nonlinear flows, whereas expressive deep surrogates match high-fidelity simulations only through massive parameterisations that turn the learned dynamics into a black box. Here, we introduce quantum-compressed machine learning (QCML), which resolves this tension by compressing the latent propagator of a flow surrogate from 524,288524{,}288524,288 trainable parameters to no more than 888. This parameter reduction brings the learned dynamical law to the parameter scale of a physical constitutive relation rather than a black-box neural network, making the surrogate directly interpretable and controllable without sacrificing expressivity. The compression is realised by a structured quantum circuit whose unitary propagator constrains the latent spectrum to the unit circle exactly and by construction, replacing exponential error growth with linear accumulation over autoregressive rollouts. Classical regularisation only approximates this constraint: even a quantum-inspired classical baseline penalised towards unitarity collapses within one Lyapunov time on turbulent channel flow, whereas QCML remains stable over the full rollout. Shared phase and coupling angles parameterising the circuit correspond directly to modal frequencies and inter-mode interactions, giving the learned dynamics a physical interpretation in spectral space. On two patient-specific cardiovascular benchmarks, the structured QCML propagator matches the predictive accuracy of its classical counterpart on surface pressure spectra, pressure drop, and wall shear stress. These results establish QCML as a working component of scientific machine learning and a concrete contribution towards practical quantum advantage in real-world prediction.
We introduce a hybrid approach utilising a quantum machine learning surrogate model to approximate the non-linear collision dynamics of the LBM. It effectively offloads the non-unitary operations that challenge pure quantum solvers. The expressivity of the surrogate is built on the ability of parameterised quantum circuits to implement partial Fourier series, with data re-uploading extending the spectrum of representable frequencies. Unlike previous approaches with a fixed relaxation parameter, the surrogate recovers the complete Bhatnagar-Gross-Krook (BGK) collision dynamics across the full physically admissible range of relaxation without retraining. We reassess the relevance of standard variational quantum circuit (VQC) metrics, including expressibility, entanglement, and effective dimension, by relating them directly to task-specific surrogate performance and identifying the key architectural parameters that determine approximation accuracy. The proposed surrogate is validated against the classical BGK collision operator using established benchmark problems, including the Taylor-Green vortex for evaluating energy dissipation and the double shear layer for assessing shear-driven instabilities and nonlinear flow evolution. Our results demonstrate that the hybrid model achieves high accuracy and generalisability while closely replicating classical solutions. These findings suggest that hybrid quantum-classical strategies offer a practical path toward realising the potential of quantum computing in fluid engineering.
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Noise is a major obstacle in current quantum computing, and Machine Learning for Quantum Error Mitigation (ML-QEM) promises to address this challenge, enhancing computational accuracy while reducing the sampling overheads of standard QEM methods. Yet, existing models lack physical interpretability and rely heavily on extensive datasets, hindering their scalability in large-scale quantum circuits. To tackle these issues, we introduce the Neural Noise Accumulation Surrogate (NNAS), a physics-inspired neural network for ML-QEM that incorporates the structural characteristics of quantum noise accumulation within multi-layer circuits, endowing the model with physical interpretability. Experimental results demonstrate that NNAS outperforms current methods across a spectrum of metrics, including error mitigation capability, quantum resource consumption, and training dataset size. Notably, for deeper circuits where QEM methods typically struggle, NNAS achieves a remarkable reduction of over half in errors. NNAS also demands substantially fewer training data, reducing dataset reliance by at least an order of magnitude, due to its ability to rapidly capture noise accumulation patterns across circuit layers. This work pioneers the integration of quantum process-derived structural characteristics into neural network architectures, broadly enhancing QEM's performance and applicability, and establishes an integrative paradigm that extends to various quantum-inspired neural network architectures.
Recent advances in Machine Learning have transformed numerous industrial sectors, yet classical paradigms face fundamental limitations: rapidly growing data volumes, rising computational costs, significant energy consumption, and the physical scaling limits of conventional hardware architectures. Quantum computing has emerged as a promising computational paradigm to address these challenges, giving rise to the field of Quantum Machine Learning (QML). In this thesis, the theoretical foundations of QML are investigated, with a focus on near-term and future practical applications. Three central challenges are addressed: the trainability of variational quantum circuits, their expressivity, and their resistance to efficient classical simulation. The trainability of Hamming-weight preserving variational quantum circuits is first studied, and theoretical guarantees are established that resolve an open conjecture on the absence of barren plateaus for this circuit family. Subspace-preserving QML algorithms are then introduced, including photonic circuits and quantum convolutional neural networks, and are designed to mimic classical ML subroutines while offering polynomial quantum advantage. Finally, variational quantum circuits are analyzed as quantum Fourier models, and a framework is derived to jointly characterize expressivity and trainability, from which conditions are obtained under which quantum models provably separate from their classical counterparts. These contributions are intended to advance the theoretical roadmap for harnessing near-term and future quantum technologies in real-world applications.
Abstract Noise is a major obstacle in current quantum computing, and Machine Learning for Quantum Error Mitigation (ML-QEM) promises to address this challenge, enhancing computational accuracy while reducing the sampling overheads of standard QEM methods. Yet, existing models lack physical interpretability and rely heavily on extensive datasets, hindering their scalability in large-scale quantum circuits. To tackle these issues, we introduce the Neural Noise Accumulation Surrogate (NNAS), a physics-inspired neural network for ML-QEM that incorporates the structural characteristics of quantum noise accumulation within multi-layer circuits, endowing the model with physical interpretability. Experimental results demonstrate that NNAS outperforms current methods across a spectrum of metrics, including error mitigation capability, quantum resource consumption, and training dataset size. Notably, for deeper circuits where QEM methods typically struggle, NNAS achieves a remarkable reduction of over half in errors. NNAS also demands substantially fewer training data, reducing dataset reliance by at least an order of magnitude, due to its ability to rapidly capture noise accumulation patterns across circuit layers. This work pioneers the integration of quantum process-derived structural characteristics into neural network architectures, broadly enhancing QEM's performance and applicability, and establishes an integrative paradigm that extends to various quantum-inspired neural network architectures.