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Hamilton's equations of motion form a fundamental framework in various branches of physics, including astronomy, quantum mechanics, particle physics, and climate science. Classical numerical solvers are typically employed to compute the…

Machine Learning · Computer Science 2024-10-25 Priscilla Canizares , Davide Murari , Carola-Bibiane Schönlieb , Ferdia Sherry , Zakhar Shumaylov

Diffusion models have gained significant popularity in image generation tasks. However, generating high-quality content remains notably slow because it requires running model inference over many time steps. To accelerate these models, we…

Computer Vision and Pattern Recognition · Computer Science 2025-01-28 Zichen Fan , Steve Dai , Rangharajan Venkatesan , Dennis Sylvester , Brucek Khailany

Compact representations of fermionic Hamiltonians are necessary to perform calculations on quantum computers that lack error-correction. A fermionic system is typically defined within a subspace of fixed particle number and spin while…

Quantum Physics · Physics 2022-05-25 Diana Chamaki , Mekena Metcalf , Wibe A. de Jong

We present a new primitive for quantum algorithms that implements a discrete Hermite transform efficiently, in time that depends logarithmically in both the dimension and the inverse of the allowable error. This transform, which maps basis…

Quantum Physics · Physics 2025-10-07 Siddhartha Jain , Vishnu Iyer , Rolando D. Somma , Ning Bao , Stephen P. Jordan

Transformers are central to advances in artificial intelligence (AI), excelling in fields ranging from computer vision to natural language processing. Despite their success, their large parameter count and computational demands challenge…

Hardware Architecture · Computer Science 2025-03-10 Qunyou Liu , Marina Zapater , David Atienza

We develop a fourth-order Magnus expansion based quantum algorithm for the simulation of many-body problems involving two-level quantum systems with time-dependent Hamiltonians, $\mathcal{H}(t)$. A major hurdle in the utilization of the…

Quantum Physics · Physics 2023-12-14 Guannan Chen , Mohammadali Foroozandeh , Chris Budd , Pranav Singh

In order to characterize and benchmark computational hardware, software, and algorithms, it is essential to have many problem instances on-hand. This is no less true for quantum computation, where a large collection of real-world problem…

Solving linear systems of equations is a fundamental problem with a wide variety of applications across many fields of science, and there is increasing effort to develop quantum linear solver algorithms. [Suba\c{s}i et al., Phys. Rev. Lett.…

Quantum Physics · Physics 2026-01-09 David Jennings , Matteo Lostaglio , Sam Pallister , Andrew T Sornborger , Yiğit Subaşı

Sparse Matrix-Matrix Multiplication (SpMM) is a fundamental operation in graph computing and analytics. However, the irregularity of real-world graphs poses significant challenges to achieving efficient SpMM operation for graph data on…

Distributed, Parallel, and Cluster Computing · Computer Science 2024-12-13 Zhonggen Li , Xiangyu Ke , Yifan Zhu , Yunjun Gao , Yaofeng Tu

Convolution operations are foundational to classical image processing and modern deep learning architectures, yet their extension into the quantum domain has remained algorithmically and physically costly due to inefficient data encoding…

Quantum Physics · Physics 2025-07-29 Mohammad Rasoul Roshanshah , Payman Kazemikhah , Hossein Aghababa

Quantum computing promises transformative impacts in simulating Hamiltonian dynamics, essential for studying physical systems inaccessible by classical computing. However, existing compilation techniques for Hamiltonian simulation, in…

Simulating the unitary dynamics of a quantum system is a fundamental problem of quantum mechanics, in which quantum computers are believed to have significant advantage over their classical counterparts. One prominent such instance is the…

Quantum Physics · Physics 2024-09-04 John M. Martyn , Yuan Liu , Zachary E. Chin , Isaac L. Chuang

A central challenge in quantum machine learning is the design and training of parameterized quantum circuits (PQCs). Much like in deep learning, vanishing gradients pose significant obstacles to the trainability of PQCs, arising from…

A primary objective of quantum computation is to efficiently simulate quantum physics. Scientifically and technologically important quantum Hamiltonians include those with spin-$s$, vibrational, photonic, and other bosonic degrees of…

Quantum Physics · Physics 2020-12-11 Nicolas P. D. Sawaya , Gian Giacomo Guerreschi , Adam Holmes

We address the non-convex optimisation problem of finding a sparse matrix on the Stiefel manifold (matrices with mutually orthogonal columns of unit length) that maximises (or minimises) a quadratic objective function. Optimisation problems…

Optimization and Control · Mathematics 2021-10-04 Florian Bernard , Daniel Cremers , Johan Thunberg

Sparse matrices are the key ingredients of several application domains, from scientific computation to machine learning. The primary challenge with sparse matrices has been efficiently storing and transferring data, for which many sparse…

Hardware Architecture · Computer Science 2023-05-12 Bahar Asgari , Ramyad Hadidi , Joshua Dierberger , Charlotte Steinichen , Amaan Marfatia , Hyesoon Kim

Here we describe an approach for simulating electronic structure on quantum computers with significantly lower asymptotic complexity than prior work. The approach uses a real-space first-quantised representation of the molecular Hamiltonian…

The importance of general matrix multiplication (GEMM) is motivating new instruction set extensions for multiplying dense matrices in almost all contemporary ISAs, and these extensions are often implemented using high-performance systolic…

Hardware Architecture · Computer Science 2025-02-18 Tuan Ta , Joshua Randall , Christopher Batten

In recent years, novel AI accelerators have emerged as promising alternatives to GPU for AI model training and inference tasks. One such accelerator, the Cerebras CS-3, achieves strong performance on large model training as well as…

Distributed, Parallel, and Cluster Computing · Computer Science 2026-05-01 Milan Shah , Sheng Di , Michela Becchi

Quantum Hamiltonian identification is important for characterizing the dynamics of quantum systems, calibrating quantum devices and achieving precise quantum control. In this paper, an effective two-step optimization (TSO) quantum…

Quantum Physics · Physics 2018-06-05 Yuanlong Wang , Daoyi Dong , Bo Qi , Jun Zhang , Ian R. Petersen , Hidehiro Yonezawa