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arXiv:2305.02019 · Physical Review A

Deep-learning-based quantum algorithms for solving nonlinear partial differential equations

Lukas Mouton, Florentin Reiter, Ying Chen, Patrick Rebentrost

Published Aug 14, 2024• 8 citations
arXivHTMLPDF

Abstract

Partial differential equations frequently appear in the natural sciences and related disciplines. In this work, we explore the potential for enhancing a classical deep-learning-based method for solving high-dimensional nonlinear partial differential equations with suitable quantum subroutines. In a first approach, we construct a deep-learning architecture based on variational quantum circuits without provable guarantees. In a second approach, tailored towards fault-tolerant quantum computers, find that quantum-accelerated Monte Carlo methods offer the potential to speed up the estimation of the loss function. In addition, we identify and analyze the trade-offs when using quantum-accelerated Monte Carlo methods to estimate the gradients with different methods, including a recently developed backpropagation-free forward gradient method. Finally, we discuss the usage of a suitable quantum algorithm for accelerating the training of feed-forward neural networks. Hence, this work provides different avenues with the potential for polynomial speedups for deep-learning-based methods for nonlinear partial differential equations.

DOI
10.1103/physreva.110.022612

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Quantum computing promises to speed up some of the most challenging problems in science and engineering. Quantum algorithms have been proposed showing theoretical advantages in applications ranging from chemistry to logistics optimization. Many problems appearing in science and engineering can be rewritten as a set of differential equations. Quantum algorithms for solving differential equations have shown a provable advantage in the fault-tolerant quantum computing regime, where deep and wide quantum circuits can be used to solve large linear systems like partial differential equations (PDEs) efficiently. Recently, variational approaches to solving non-linear PDEs also with near-term quantum devices were proposed. One of the most promising general approaches is based on recent developments in the field of scientific machine learning for solving PDEs. We extend the applicability of near-term quantum computers to more general scientific machine learning tasks, including the discovery of differential equations from a dataset of measurements. We use differentiable quantum circuits (DQCs) to solve equations parameterized by a library of operators, and perform regression on a combination of data and equations. Our results show a promising path to Quantum Model Discovery (QMoD), on the interface between classical and quantum machine learning approaches. We demonstrate successful parameter inference and equation discovery using QMoD on different systems including a second-order, ordinary differential equation and a non-linear, partial differential equation.
We propose a quantum machine learning framework for approximating solutions to high-dimensional parabolic partial differential equations (PDEs) that can be reformulated as backward stochastic differential equations (BSDEs). In contrast to popular quantum-classical network hybrid approaches, this study employs the pure Variational Quantum Circuit (VQC) as the core solver without trainable classical neural networks. The quantum BSDE solver performs pathwise approximation via temporal discretization and Monte Carlo simulation, framed as model-based reinforcement learning. We benchmark VQCbased and classical deep neural network (DNN) solvers on two canonical PDEs as representatives: the Black-Scholes and nonlinear Hamilton-Jacobi-Bellman (HJB) equations. The VQC achieves lower variance and improved accuracy in most cases, particularly in highly nonlinear regimes and for out-of-themoney options, demonstrating greater robustness than DNNs. These results, obtained via quantum circuit simulation, highlight the potential of VQCs as scalable and stable solvers for highdimensional stochastic control problems.
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Partial differential equations (PDEs) form the backbone of simulations of many natural phenomena, for example in climate modeling, material science, and even financial markets. The application of physics-informed neural networks to accelerate the solution of PDEs is promising, but not competitive with numerical solvers yet. Here, we show how quantum computing can improve the ability of physics-informed neural networks to solve partial differential equations. For this, we develop hybrid networks consisting of quantum circuits combined with classical layers and systematically test them on various non linear PDEs and boundary conditions in comparison with purely classical networks. We demonstrate that the advantage of using quantum networks lies in their ability to achieve an accurate approximation of the solution in substantially fewer training epochs, particularly for more complex problems. These findings provide the basis for targeted developments of hybrid quantum neural networks with the goal to significantly accelerate numerical modeling.
Quantum computing holds significant promise for scientific computing due to its potential for polynomial to even exponential speedups over classical methods, which are often hindered by the curse of dimensionality. While neural networks present a mesh-free alternative to solve partial differential equations (PDEs), their accuracy is difficult to achieve since one needs to solve a high-dimensional non-convex optimization problem using the stochastic gradient descent method and its variants, the convergence of which is difficult to prove and cannot be guaranteed. The classical random feature method (RFM) effectively merges advantages from both classical numerical analysis and neural network based techniques, achieving spectral accuracy and a natural adaptability to complex geometries. In this work, we introduce a quantum random feature method (QRFM) that leverages quantum computing to accelerate the classical RFM framework. Our method constructs PDE solutions using quantum-generated random features and enforces the governing equations via a collocation approach. A complexity analysis demonstrates that this hybrid quantum-classical algorithm can achieve a quadratic speedup over the classical RFM.
This paper proposes a novel approach for solving nonlinear partial differential equations (PDEs) with a quantum computer, the trainable embedding quantum physics informed neural network (TE-QPINN). We combine quantum machine learning (QML) with physics informed neural networks (PINNs) in a hybrid approach. By leveraging the advantages of classical and quantum computers, we can create algorithms that have a potential to be run on noisy intermediate-scale quantum devices (NISQ). We use feedforward neural networks (FNN) as problem-agnostic embedding functions, giving the used quantum circuit greater expressibility than previously introduced embedding. This expressibility allows us to solve a wide range of problems without using a problem specific ansatz. Additionally, we introduce a hybrid backpropagation algorithm that allows efficient updates of the used weights and biases in the FNN embedding functions. In this paper we showcase the capabilities of TE-QPINNs of a wide range of problems, including the two-dimensional Poisson, Burgers and Navier-Stokes equations. In direct comparison with classical PINNs, this approach showed an ability to achieve superior results while using the same number of parameters, highlighting their potential for more efficient optimization in high-dimensional parameter spaces, which could be transformative for future applications.