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Unitary coupled cluster (UCC) theory offers a promising Hermitian alternative to conventional coupled cluster (CC) theory, but its practical implementation is hindered by the non-truncating nature of the Baker-Campbell-Hausdorff (BCH)…

Chemical Physics · Physics 2025-05-05 Justin T. Phillips , Lauren N. Koulias , Stephen H. Yuwono , A. Eugene DePrince

Magnetron sputtering is an essential technique in combinatorial materials science, enabling the efficient synthesis of thin-film materials libraries with continuous compositional gradients. For exploring multidimensional search spaces,…

Materials Science · Physics 2024-11-22 Felix Thelen , Rico Zehl , Jan Lukas Bürgel , Diederik Depla , Alfred Ludwig

We propose a variational alternative to the Trotter-Suzuki decomposition that provides greater control over errors while preserving the unitary structure of time evolution. The variational parameters in our ansatz are derived from a global…

Quantum Physics · Physics 2025-11-20 Ibsal Assi , Michael Vogl , Meenu Kumari , J. P. F. LeBlanc

Sequence model based NLP applications can be large. Yet, many applications that benefit from them run on small devices with very limited compute and storage capabilities, while still having run-time constraints. As a result, there is a need…

Computation and Language · Computer Science 2020-10-08 Urmish Thakker , Jesse Beu , Dibakar Gope , Ganesh Dasika , Matthew Mattina

In this paper, we present a robust adaptive model predictive control (MPC) scheme for linear systems subject to parametric uncertainty and additive disturbances. The proposed approach provides a computationally efficient formulation with…

Systems and Control · Electrical Eng. & Systems 2020-03-12 Johannes Köhler , Elisa Andina , Raffaele Soloperto , Matthias A. Müller , Frank Allgöwer

Hamiltonian simulation is one of the most promising candidates for the demonstration of quantum advantage within the next ten years, and several studies have proposed end-to-end resource estimates for executing such algorithms on…

Quantum Physics · Physics 2025-06-11 Tyler LeBlond , Ryan S. Bennink

We provide a quantum method for simulating Hamiltonian evolution with complexity polynomial in the logarithm of the inverse error. This is an exponential improvement over existing methods for Hamiltonian simulation. In addition, its scaling…

Quantum Physics · Physics 2013-10-24 Dominic W. Berry , Richard Cleve , Rolando D. Somma

Nonequispaced discrete Fourier transformation (NDFT) is widely applied in all aspects of computational science and engineering. The computational efficiency and accuracy of NDFT has always been a critical issue in hindering its…

Mathematical Software · Computer Science 2020-08-06 Sheng-Chun Yang , Yong-Lei Wang

Non-negative Matrix Factorization (NMF) is a key kernel for unsupervised dimension reduction used in a wide range of applications, including topic modeling, recommender systems and bioinformatics. Due to the compute-intensive nature of…

Machine Learning · Computer Science 2019-04-18 Gordon E. Moon , Aravind Sukumaran-Rajam , Srinivasan Parthasarathy , P. Sadayappan

Efficient error estimates for the Trotter product formula are central in quantum computing, mathematical physics, and numerical simulations. However, the Trotter error's dependency on the input state and its application to unbounded…

Quantum Physics · Physics 2024-11-28 Daniel Burgarth , Paolo Facchi , Alexander Hahn , Mattias Johnsson , Kazuya Yuasa

This article considers Hamiltonian mechanical systems with potential functions admitting jump discontinuities. The focus is on accurate and efficient numerical approximations of their solutions, which will be defined via the laws of…

Numerical Analysis · Mathematics 2022-01-05 Molei Tao , Shi Jin

Hamiltonian simulation is a central task in quantum computing, with wide-ranging applications in quantum chemistry, condensed matter physics, and combinatorial optimization. A fundamental challenge lies in approximating the unitary…

Quantum Physics · Physics 2025-05-15 Molena Nguyen , Naihuan Jing

A complex but important challenge in understanding quantum mechanical phenomena is the simulation of quantum many-body dynamics. Although quantum computers offer significant potential to accelerate these simulations, their practical…

Quantum Physics · Physics 2025-09-26 Gian Gentinetta , Friederike Metz , Giuseppe Carleo

Simulating quantum dynamics is one of the central applications of quantum computing. For Hamiltonians written as a sum of many terms, deterministic Trotter--Suzuki product formulas can require applying a large number of term-wise evolutions…

Quantum Physics · Physics 2026-05-20 Pegah Mohammadipour , Xiantao Li

Efficiently simulating many-body quantum systems with Coulomb interactions is a fundamental question in quantum physics, quantum chemistry, and quantum computing, yet it presents unique challenges: the Hamiltonian is an unbounded operator…

Quantum Physics · Physics 2026-04-10 Di Fang , Xiaoxu Wu

The quantum circuit model is the de-facto way of designing quantum algorithms. Yet any level of abstraction away from the underlying hardware incurs overhead. In the era of near-term, noisy, intermediate-scale quantum (NISQ) hardware with…

Quantum Physics · Physics 2021-08-27 Laura Clinton , Johannes Bausch , Toby Cubitt

Trotterization is a technique that allows one to approximate a time evolution of a Hamiltonian by repeatedly evolving the individual terms of the Hamiltonian one-at-a-time for small time durations. Bounds on the error of this approximation…

Quantum Physics · Physics 2026-04-28 Reuben Tate , Shamminuj Aktar , Stephan Eidenbenz

Quantum computers offer the potential to efficiently simulate the dynamics of quantum systems, a task whose difficulty scales exponentially with system size on classical devices. To assess the potential for near-term quantum computers to…

Quantum Physics · Physics 2023-07-06 Nathan M. Myers , Ryan Scott , Kwon Park , Vito W. Scarola

The rapid growth of entanglement under unitary time evolution is the primary bottleneck for modern tensor-network techniques--such as Matrix Product States (MPS)--when computing time-dependent expectation values. This {entanglement barrier}…

Quantum Physics · Physics 2025-06-10 Stefano Carignano , Guglielmo Lami , Jacopo De Nardis , Luca Tagliacozzo

We propose a framework to design concurrently a frustration-free quantum many-body Hamiltonian and its numerically exact ground states on a sufficiently large finite-size cluster in one and two dimensions using an elementary matrix product…

Strongly Correlated Electrons · Physics 2024-12-17 Hidehiro Saito , Chisa Hotta
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