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arXiv:2002.07868 · Quantum

High-precision quantum algorithms for partial differential equations

Andrew M. Childs, Jin-Peng Liu, Aaron Ostrander

Published Nov 10, 2021• 154 citations
arXivHTMLPDF

Abstract

Quantum computers can produce a quantum encoding of the solution of a system of differential equations exponentially faster than a classical algorithm can produce an explicit description. However, while high-precision quantum algorithms for linear ordinary differential equations are well established, the best previous quantum algorithms for linear partial differential equations (PDEs) have complexity p o l y ( 1 / ϵ ) , where ϵ is the error tolerance. By developing quantum algorithms based on adaptive-order finite difference methods and spectral methods, we improve the complexity of quantum algorithms for linear PDEs to be p o l y ( d , log ⁡ ( 1 / ϵ ) ) , where d is the spatial dimension. Our algorithms apply high-precision quantum linear system algorithms to systems whose condition numbers and approximation errors we bound. We develop a finite difference algorithm for the Poisson equation and a spectral algorithm for more general second-order elliptic equations.

DOI
10.22331/q-2021-11-10-574

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In recent years, quantum linear system algorithms have been applied to partial differential equations (PDEs), particularly in high-dimensional settings, demonstrating an exponential speedup in dimension. Concurrently, randomized and quantum-inspired classical linear solvers have emerged, showing computational complexity comparable to their quantum counterparts in many application areas. In this paper, we investigate the applicability of these quantum-inspired classical algorithms to PDEs. We provide both upper and lower bounds on their computational complexity, proving that these methods cannot achieve exponential speedup in dimension for discretizations of high-dimensional Poisson problems. Our theoretical findings definitively demonstrate that quantum-inspired classical algorithms are not competitive with quantum algorithms for solving PDEs, confirming that quantum methods retain a significant advantage for high-dimensional problems.
Abstract. Partial differential equation (PDE) models with multiple temporal/spatial scales are prevalent in several disciplines such as physics, engineering, and many others. These models are of great practical importance but notoriously difficult to solve due to prohibitively small mesh and time step sizes limited by the scaling parameter and CFL condition. Another challenge in scientific computing could come from curse-of-dimensionality. In this paper, we aim to provide a quantum algorithm, based on either direct approximations of the original PDEs or their homogenized models, for prototypical multiscale problems inPDEs, including elliptic, parabolic, and hyperbolic PDEs. To achieve this, we will lift these problems to higher dimensions and leverage the recently developed Schrödingerization based quantum simulation algorithms to efficiently reduce the computational cost of the resulting high-dimensional and multiscale problems. We will examine the error contributions arising from discretization, homogenization, and relaxation, and analyze and compare the complexities of these algorithms in order to identify the best algorithms in terms of complexities for different equations in different regimes.
Abstract Quantum computers are predicted to outperform classical ones for solving partial differential equations, perhaps exponentially. Here we consider a prototypical PDE—the heat equation in a rectangular region—and compare in detail the complexities of ten classical and quantum algorithms for solving it, in the sense of approximately computing the amount of heat in a given region. We find that, for spatial dimension d≥2d \ge 2d≥2 d≥2 , there is an at most quadratic quantum speedup in terms of the allowable error ϵ\epsilon ϵ ϵ using an approach based on applying amplitude estimation to an accelerated classical random walk. However, an alternative approach based on a quantum algorithm for linear equations is never faster than the best classical algorithms.
Quantum methods for solving partial differential equations (PDEs) generally fall into a few general categories, each leveraging different quantum mechanisms to achieve potential speedups. One well-known approach is the quantum linear system solver, epitomized by the Harrow-Hassidim-Lloyd (HHL) algorithm, which uses phase estimation and eigenvalue inversion to solve large, sparse linear systems arising from discretized linear PDEs [1]. This method can yield exponential improvements over classical solvers under certain conditions (mostly when the matrix is well-conditioned and sparse). More recent developments, such as Quantum Singular Value Transformation (QSVT), provide a framework for matrix inversion in a more flexible way, often improving on the cost and error dependence of earlier solvers [2]. Time-dependent PDEs can be tackled via Hamiltonian simulations. The Trotter-Suzuki method decomposes the exponential of a Hamiltonian into products of exponentials of simpler sub-Hamiltonians, allowing a piecewise approximation of continuous dynamics [3]. Continuous-time quantum walks, which treat a PDE operator as a Hamiltonian that governs the walk, similarly simulate processes like diffusion or wave propagation on discretized grids or graphs [4]. Beyond direct simulation, variational quantum algorithms have emerged as a promising route in the noisy intermediate-scale quantum era. These approaches encode the PDE solution as a parameterized quantum state and optimize the parameters via classical feedback, thereby minimizing a cost function tied to the PDE residual or energy functional [5]. Quantum annealing or adiabatic methods, meanwhile, can solve optimization problems derived from PDE constraints by adiabatically evolving a simple initial Hamiltonian to the final problem Hamiltonian and staying in the system's ground state [3]. In our study, we implement a new parameterized quantum model, specifically designed to solve large linear systems on quantum hardware. This model is less deep and computationally faster than the proposed one in [5], reducing the complexity and speeding up convergence times. Such improvements are particularly valuable in cases where classical algorithms may fail due to the problem's size or complexity. Ongoing research is focusing on generalized quantum models that can be adapted to practical PDE problems for solving large electromagnetic problems where classical computers can fail.
Quantum computing has the potential to solve certain compute-intensive problems faster than classical computing by leveraging the quantum mechanical properties of superposition and entanglement. This capability can be particularly useful for solving Partial Differential Equations (PDEs), which are challenging to solve even for High-Performance Computing (HPC) systems, especially for multidimensional PDEs. This led researchers to investigate the usage of Quantum-Centric High-Performance Computing (QC-HPC) to solve multidimensional PDEs for various applications. However, the current quantum computing-based PDE-solvers, especially those based on Variational Quantum Algorithms (VQAs) suffer from limitations, such as low accuracy, long execution times, and limited scalability. In this work, we propose an innovative algorithm to solve multidimensional PDEs with two variants. The first variant uses Finite Difference Method (FDM), Classical-to-Quantum (C2Q) encoding, and numerical instantiation, whereas the second variant utilizes FDM, C2Q encoding, and Column-by-Column Decomposition (CCD). We evaluated the proposed algorithm using the Poisson equation as a case study and validated it through experiments conducted on noise-free and noisy simulators, as well as hardware emulators and real quantum hardware from IBM. Our results show higher accuracy, improved scalability, and faster execution times in comparison to variational-based PDE-solvers, demonstrating the advantage of our approach for solving multidimensional PDEs.