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arXiv:2608.03029

Physics-Informed Quantum Machine Learning with Hard Constraint Embedding for Nonlinear Differential Equations of the First Order

Mengke Xu, Xi Li, Xiao Chen, Xunan Wang, Wanli Huo, Long Ma, Weiqi Yan

quant-phSubmitted Aug 4, 2026• Announced Aug 5, 2026• 0 citations
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Abstract

Quantum algorithms based on linear-system approaches for solving differential equations demand qubit and precision resources beyond near-term capabilities. To address these challenges, this work proposes a physics-informed quantum machine learning (PIQML) framework with hard constraint embedding, specifically designed for NISQ era. Within this framework, parameterized quantum circuits serve as machine learning models, where the input variable is encoded into a high-dimensional feature space via a Fourier feature map. Subsequently, to eliminate approximation errors in critical physical conditions, the solution is constructed through a rigorously designed function mapper that analytically enforces initial conditions as hard constraints. Crucially, we compute derivatives with respect to the input variable using the parameter-shift rule---a quantum native gradient evaluation technique that avoids classical discretization. Unlike generic loss functions that target abstract data patterns, our loss function focuses on the differential equation residual and reference data. This design ensures that the trained model not only approximates the data but also intrinsically satisfies the physical constraint expressed by the DE itself. Our method is validated on several differential equations, including highly oscillatory ones, demonstrating its capability to tackle challenging nonlinear dynamics. Results demonstrate that our quantum model successfully learns the solution, showing close agreement with a high-precision classical numerical benchmark.

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We propose a physics-informed quantum algorithm to solve nonlinear and multidimensional differential equations (DEs) in a quantum latent space. We suggest a strategy for building quantum models as state overlaps, where exponentially large sets of independent basis functions are used for implicitly representing solutions. By measuring the overlaps between states which are representations of DE terms, we construct a loss that does not require independent sequential function evaluations on grid points. In this sense, the solver evaluates the loss in an intrinsically parallel way, utilizing a global type of the model. When the loss is trained variationally, our approach can be related to the differentiable quantum circuit protocol, which does not scale with the training grid size. Specifically, using the proposed model definition and feature map encoding, we represent function- and derivative-based terms of a differential equation as corresponding quantum states. Importantly, we propose an efficient way for encoding nonlinearity, for some bases requiring only an additive linear increase of the system size $\mathcal{O}(N + p)$ in the degree of nonlinearity $p$. By utilizing basis mapping, we show how the proposed model can be evaluated explicitly. This allows to implement arbitrary functions of independent variables, treat problems with various initial and boundary conditions, and include data and regularization terms in the physics-informed machine learning setting. On the technical side, we present toolboxes for exponential Chebyshev and Fourier basis sets, developing tools for automatic differentiation and multiplication, implementing nonlinearity, and describing multivariate extensions. The approach is compatible with, and tested on, a range of problems including linear, nonlinear and multidimensional differential equations.

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Adaptive Quantum Physics-Informed Neural Networks for Differential Equations with Applications to Fluid Dynamics

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Physics-informed neural networks (PINNs) have emerged as a versatile approach for solving nonlinear partial differential equations (PDEs), yet achieving high accuracy efficiently using these techniques remains challenging for high-dimensional or multiscale systems. Here, we present a hybrid quantum-classical framework that enhances Quantum PINNs (QPINNs) through adaptive collocation point sampling and loss-aware attention mechanisms. By dynamically prioritizing points in regions with large PDE residuals or steep solution gradients, our method mitigates the spectral bias inherent in conventional PINNs. Current Quantum Physics-Informed Neural Networks are commonly assumed to be limited by the expressive power of quantum circuits. In our work, we observed that, across diverse differential equations, optimization - not only expressivity - can be an important bottleneck. Furthermore, a trainable loss-weighting scheme balances contributions from physics residuals, boundary conditions, and data fidelity during training. Integrating these strategies with quantum computing techniques (including variational quantum circuits and quantum gradient estimation) can yield at least a 60% improvement in solution accuracy under specific regimes for benchmark fluid flows and reaction-diffusion systems. Finally, we argue that merely increasing model expressivity is insufficient for resolving complex PDEs via QPINNs, as they remain constrained by the structural optimization limitations of classical PINNs. This framework provides a scalable pathway for quantum-enhanced scientific machine learning, bridging physics-based modeling with emerging quantum computational capabilities.

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Physics-informed neural networks (PINNs) and hybrid quantum-classical extensions provide a promising framework for solving partial differential equations (PDEs) by embedding physical laws directly into the learning process. In this work, we study embedding strategies for trainable embedding quantum physics-informed neural networks (TE-QPINNs) in the context of nonlinear reaction-diffusion (RD) systems. We introduce an extended TE-QPINN (x-TE-QPINN) architecture that supports both classical and fully quantum embeddings, enabling a controlled comparison between feedforward neural network-based feature maps and parameterized quantum circuit embeddings. The first architecture is the classical embedding feed-forward neural network-based TE-QPINN (FNN-TE-QPINN), while the latter variant is a purely quantum one, referred to as quantum embedding neural network-based TE-QPINN (QNN-TE-QPINN). The proposed framework employs hardware-efficient variational quantum circuits and species-specific readout operators to approximate coupled multi-field dynamics while enforcing governing equations, boundary conditions, and initial conditions through a physics-informed loss function. By isolating the embedding mechanism while keeping the variational ansatz, loss formulation, and optimization procedure fixed, we analyze the impact of embedding design on gradient structure, parameter scaling, and quantum resource requirements. Numerical experiments on one- and two-dimensional RD equations demonstrate that quantum embeddings can replace classical embeddings without degradation in solution accuracy and, in certain regimes, exhibit improved optimization behavior compared to classical PINNs and hybrid quantum models with fixed embeddings. These results provide architectural insight into hybrid quantum PDE solvers and inform the design of resource-efficient quantum physics-informed learning methods.

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Quantum physics-informed neural networks (QPINNs) solve partial differential equations (PDEs) by training parameterized quantum circuits against physics-based residuals, yet the role of the embedding that maps coordinates into quantum states remains insufficiently understood. In this research, we introduce a unified embedding framework that formulates embedding as a functional transformation shaping the feature representation available to the variational circuit, and we propose two embeddings within it. The Linear Quantum Neural Network Trainable Embedding QPINN (LQNN-TE-QPINN) generates data-dependent features with an auxiliary quantum circuit and adds them to the input coordinates, instead of multiplying them as in our previous formulation. The adaptive-frequency QPINN (AdaFreq-QPINN) promotes the frequency-scaling factors of an arccos-Chebyshev encoding to trainable parameters. We evaluate both against direct and fixed analytical frequency encodings and alternative hybrid architectures on one- and two-dimensional Burgers equations. In one dimension, LQNN-TE-QPINN achieves a relative $L_2$ error of 0.0916 with 720 trainable parameters, compared with 0.4501 for direct-encoding QPINN and 0.1233 for a locally adaptive classical physics-informed neural network with approximately eleven times more parameters, while AdaFreq-QPINN attains the lowest error among the analytical embeddings with only four additional parameters. In two dimensions, LQNN-TE-QPINN attains the lowest training objective, although its solution error is not clearly separated from that of a data re-uploading QPINN. Under simulated hardware noise, LQNN-TE-QPINN retains the lowest absolute derivative error while degrading most relative to its noiseless baseline. These results demonstrate that embedding design substantially influences the approximation and optimization behavior of QPINNs.

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We propose a distinct approach to solving linear and nonlinear differential equations (DEs) on quantum computers by encoding the problem into ground states of effective Hamiltonian operators. Our algorithm relies on constructing such operators in the Chebyshev space, where an effective Hamiltonian is a sum of global differential and data constraints. Once the effective Hamiltonian is formed, solutions of differential equations can be obtained using the ground state preparation techniques (e.g. imaginary-time evolution and quantum singular value transformation), bypassing variational search. Unlike approaches based on discrete grids, the algorithm enables evaluation of solutions beyond fixed grid points and implements constraints in the physics-informed way. Our proposal inherits the best traits from quantum machine learning-based DE solving (compact basis representation, automatic differentiation, nonlinearity) and quantum linear algebra-based approaches (fine-grid encoding, provable speed-up for state preparation), offering a robust strategy for quantum scientific computing in the early fault-tolerant era.

arXiv:2504.13174•Apr 17, 2025•0 citations
Quantum algorithms based on linear-system approaches for solving differential equations demand qubit and precision resources beyond near-term capabilities. To address these challenges, this work proposes a physics-informed quantum machine learning (PIQML) framework with hard constraint embedding, specifically designed for NISQ era. Within this framework, parameterized quantum circuits serve as machine learning models, where the input variable is encoded into a high-dimensional feature space via a Fourier feature map. Subsequently, to eliminate approximation errors in critical physical conditions, the solution is constructed through a rigorously designed function mapper that analytically enforces initial conditions as hard constraints. Crucially, we compute derivatives with respect to the input variable using the parameter-shift rule---a quantum native gradient evaluation technique that avoids classical discretization. Unlike generic loss functions that target abstract data patterns, our loss function focuses on the differential equation residual and reference data. This design ensures that the trained model not only approximates the data but also intrinsically satisfies the physical constraint expressed by the DE itself. Our method is validated on several differential equations, including highly oscillatory ones, demonstrating its capability to tackle challenging nonlinear dynamics. Results demonstrate that our quantum model successfully learns the solution, showing close agreement with a high-precision classical numerical benchmark.
We propose a physics-informed quantum algorithm to solve nonlinear and multidimensional differential equations (DEs) in a quantum latent space. We suggest a strategy for building quantum models as state overlaps, where exponentially large sets of independent basis functions are used for implicitly representing solutions. By measuring the overlaps between states which are representations of DE terms, we construct a loss that does not require independent sequential function evaluations on grid points. In this sense, the solver evaluates the loss in an intrinsically parallel way, utilizing a global type of the model. When the loss is trained variationally, our approach can be related to the differentiable quantum circuit protocol, which does not scale with the training grid size. Specifically, using the proposed model definition and feature map encoding, we represent function- and derivative-based terms of a differential equation as corresponding quantum states. Importantly, we propose an efficient way for encoding nonlinearity, for some bases requiring only an additive linear increase of the system size O(N+p)\mathcal{O}(N + p)O(N+p) in the degree of nonlinearity ppp. By utilizing basis mapping, we show how the proposed model can be evaluated explicitly. This allows to implement arbitrary functions of independent variables, treat problems with various initial and boundary conditions, and include data and regularization terms in the physics-informed machine learning setting. On the technical side, we present toolboxes for exponential Chebyshev and Fourier basis sets, developing tools for automatic differentiation and multiplication, implementing nonlinearity, and describing multivariate extensions. The approach is compatible with, and tested on, a range of problems including linear, nonlinear and multidimensional differential equations.
Physics-informed neural networks (PINNs) have emerged as a versatile approach for solving nonlinear partial differential equations (PDEs), yet achieving high accuracy efficiently using these techniques remains challenging for high-dimensional or multiscale systems. Here, we present a hybrid quantum-classical framework that enhances Quantum PINNs (QPINNs) through adaptive collocation point sampling and loss-aware attention mechanisms. By dynamically prioritizing points in regions with large PDE residuals or steep solution gradients, our method mitigates the spectral bias inherent in conventional PINNs. Current Quantum Physics-Informed Neural Networks are commonly assumed to be limited by the expressive power of quantum circuits. In our work, we observed that, across diverse differential equations, optimization - not only expressivity - can be an important bottleneck. Furthermore, a trainable loss-weighting scheme balances contributions from physics residuals, boundary conditions, and data fidelity during training. Integrating these strategies with quantum computing techniques (including variational quantum circuits and quantum gradient estimation) can yield at least a 60% improvement in solution accuracy under specific regimes for benchmark fluid flows and reaction-diffusion systems. Finally, we argue that merely increasing model expressivity is insufficient for resolving complex PDEs via QPINNs, as they remain constrained by the structural optimization limitations of classical PINNs. This framework provides a scalable pathway for quantum-enhanced scientific machine learning, bridging physics-based modeling with emerging quantum computational capabilities.
Physics-informed neural networks (PINNs) and hybrid quantum-classical extensions provide a promising framework for solving partial differential equations (PDEs) by embedding physical laws directly into the learning process. In this work, we study embedding strategies for trainable embedding quantum physics-informed neural networks (TE-QPINNs) in the context of nonlinear reaction-diffusion (RD) systems. We introduce an extended TE-QPINN (x-TE-QPINN) architecture that supports both classical and fully quantum embeddings, enabling a controlled comparison between feedforward neural network-based feature maps and parameterized quantum circuit embeddings. The first architecture is the classical embedding feed-forward neural network-based TE-QPINN (FNN-TE-QPINN), while the latter variant is a purely quantum one, referred to as quantum embedding neural network-based TE-QPINN (QNN-TE-QPINN). The proposed framework employs hardware-efficient variational quantum circuits and species-specific readout operators to approximate coupled multi-field dynamics while enforcing governing equations, boundary conditions, and initial conditions through a physics-informed loss function. By isolating the embedding mechanism while keeping the variational ansatz, loss formulation, and optimization procedure fixed, we analyze the impact of embedding design on gradient structure, parameter scaling, and quantum resource requirements. Numerical experiments on one- and two-dimensional RD equations demonstrate that quantum embeddings can replace classical embeddings without degradation in solution accuracy and, in certain regimes, exhibit improved optimization behavior compared to classical PINNs and hybrid quantum models with fixed embeddings. These results provide architectural insight into hybrid quantum PDE solvers and inform the design of resource-efficient quantum physics-informed learning methods.
Physics-informed neural networks (PINNs) have emerged as a powerful framework for solving partial differential equations (PDEs) by embedding governing physical laws directly into the training objective. Recent advances in quantum machine learning have motivated hybrid quantum-classical extensions aimed at enhancing representational capacity while remaining compatible with near-term quantum hardware. In this work, we investigate trainable embedding strategies within quantum-assisted PINNs for solving parabolic PDEs, using one- and two-dimensional heat equations as canonical benchmarks. We introduce two quantum-assisted architectures that differ in their embedding components. In the first approach, a classical feed-forward neural network generates trainable feature maps for quantum data encoding (FNN-TE-QPINN). In the second, the embedding stage is realized entirely by a parameterized quantum circuit (QNN-TE-QPINN), yielding a fully quantum feature map. Our findings emphasize the critical role of embedding design and support hybrid quantum-classical approaches for parabolic PDE modeling in the NISQ era.
Quantum physics-informed neural networks (QPINNs) solve partial differential equations (PDEs) by training parameterized quantum circuits against physics-based residuals, yet the role of the embedding that maps coordinates into quantum states remains insufficiently understood. In this research, we introduce a unified embedding framework that formulates embedding as a functional transformation shaping the feature representation available to the variational circuit, and we propose two embeddings within it. The Linear Quantum Neural Network Trainable Embedding QPINN (LQNN-TE-QPINN) generates data-dependent features with an auxiliary quantum circuit and adds them to the input coordinates, instead of multiplying them as in our previous formulation. The adaptive-frequency QPINN (AdaFreq-QPINN) promotes the frequency-scaling factors of an arccos-Chebyshev encoding to trainable parameters. We evaluate both against direct and fixed analytical frequency encodings and alternative hybrid architectures on one- and two-dimensional Burgers equations. In one dimension, LQNN-TE-QPINN achieves a relative L2L_2L2​ error of 0.0916 with 720 trainable parameters, compared with 0.4501 for direct-encoding QPINN and 0.1233 for a locally adaptive classical physics-informed neural network with approximately eleven times more parameters, while AdaFreq-QPINN attains the lowest error among the analytical embeddings with only four additional parameters. In two dimensions, LQNN-TE-QPINN attains the lowest training objective, although its solution error is not clearly separated from that of a data re-uploading QPINN. Under simulated hardware noise, LQNN-TE-QPINN retains the lowest absolute derivative error while degrading most relative to its noiseless baseline. These results demonstrate that embedding design substantially influences the approximation and optimization behavior of QPINNs.
We propose a distinct approach to solving linear and nonlinear differential equations (DEs) on quantum computers by encoding the problem into ground states of effective Hamiltonian operators. Our algorithm relies on constructing such operators in the Chebyshev space, where an effective Hamiltonian is a sum of global differential and data constraints. Once the effective Hamiltonian is formed, solutions of differential equations can be obtained using the ground state preparation techniques (e.g. imaginary-time evolution and quantum singular value transformation), bypassing variational search. Unlike approaches based on discrete grids, the algorithm enables evaluation of solutions beyond fixed grid points and implements constraints in the physics-informed way. Our proposal inherits the best traits from quantum machine learning-based DE solving (compact basis representation, automatic differentiation, nonlinearity) and quantum linear algebra-based approaches (fine-grid encoding, provable speed-up for state preparation), offering a robust strategy for quantum scientific computing in the early fault-tolerant era.