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Quantum computing holds promise for revolutionizing computational chemistry simulations, particularly in drug discovery. However, current quantum hardware is limited by noise and scale, necessitating bridging technologies. This study…

Quantum Physics · Physics 2025-04-16 Marek Kowalik , Ellen Michael , Peter Pogány , Phalgun Lolur

We present a quantum algorithm to solve systems of linear equations of the form $A\mathbf{x}=\mathbf{b}$, where $A$ is a tridiagonal Toeplitz matrix and $\mathbf{b}$ results from discretizing an analytic function, with a circuit complexity…

Quantum Physics · Physics 2022-01-17 Almudena Carrera Vazquez , Ralf Hiptmair , Stefan Woerner

The efficient implementation of matrix arithmetic operations underpins the speedups of many quantum algorithms. We develop a suite of methods to perform matrix arithmetics -- with the result encoded in the off-diagonal blocks of a…

Quantum Physics · Physics 2026-01-23 Christopher Kang , Yuan Su

We present a quantum algorithm for the dynamical simulation of time-dependent Hamiltonians. Our method involves expanding the interaction-picture Hamiltonian as a sum of generalized permutations, which leads to an integral-free Dyson series…

Quantum Physics · Physics 2021-09-15 Yi-Hsiang Chen , Amir Kalev , Itay Hen

The Lie-Trotter formula, together with its higher-order generalizations, provides a direct approach to decomposing the exponential of a sum of operators. Despite significant effort, the error scaling of such product formulas remains poorly…

Quantum Physics · Physics 2021-02-05 Andrew M. Childs , Yuan Su , Minh C. Tran , Nathan Wiebe , Shuchen Zhu

Existing approaches to analogue quantum simulations of time-dependent quantum systems rely on perturbative corrections to quantum simulations of time-independent quantum systems. We overcome this restriction to perturbative treatments with…

Quantum Physics · Physics 2024-02-13 Boyuan Shi , Florian Mintert

Achieving an accurate description of fermionic systems typically requires considerably many more orbitals than fermions. Previous resource analyses of quantum chemistry simulation often failed to exploit this low fermionic number…

Quantum Physics · Physics 2022-05-24 Sam McArdle , Earl Campbell , Yuan Su

We present a comparative study of the permutation matrix representation (PMR) method for Hamiltonian simulation alongside other leading quantum algorithms. Our analysis focuses on resource costs for simulating both time-independent and…

Quantum Physics · Physics 2026-05-29 Hriday Sabharwal , Itay Hen

Understanding the dynamics of quantum systems is crucial in many areas of physics, but simulating many-body systems presents significant challenges due to the large Hilbert space to navigate and the exponential growth of computational…

Quantum Physics · Physics 2025-03-14 Sangjin Lee , Youngseok Kim , Seung-Woo Lee

Hamiltonian simulation is believed to be one of the first tasks where quantum computers can yield a quantum advantage. One of the most popular methods of Hamiltonian simulation is Trotterization, which makes use of the approximation…

Quantum Physics · Physics 2023-11-09 Lea M. Trenkwalder , Eleanor Scerri , Thomas E. O'Brien , Vedran Dunjko

Simulation of quantum chemistry is expected to be a principal application of quantum computing. In quantum simulation, a complicated Hamiltonian describing the dynamics of a quantum system is decomposed into its constituent terms, where the…

Quantum Physics · Physics 2020-03-04 Yingkai Ouyang , David R. White , Earl T. Campbell

Recent work has deployed linear combinations of unitaries techniques to reduce the cost of fault-tolerant quantum simulations of correlated electron models. Here, we show that one can sometimes improve upon those results with optimized…

Simulating quantum dynamics beyond the reach of classical computers is one of the main envisioned applications of quantum computers. The most promising quantum algorithms to this end in the near-term are the simplest, which use the Trotter…

Quantum Physics · Physics 2022-05-25 David Layden

When simulating the dynamics of open quantum systems with quantum computers, it is essential to accurately approximate the system's behaviour while preserving the physicality of its evolution. Traditionally, for Markovian open quantum…

Quantum Physics · Physics 2025-12-18 I. J. David , I. Sinayskiy , F. Petruccione

Electronic structure simulation is an anticipated application for quantum computers. Due to high-dimensional quantum entanglement in strongly correlated systems, the quantum resources required to perform such simulations are far beyond the…

Quantum Physics · Physics 2022-01-25 Jie Liu , Zhenyu Li , Jinlong Yang

Solving the electronic structure problem via unitary evolution of the electronic Hamiltonian is one of the promising applications of digital quantum computers. One of the practical strategies to implement the unitary evolution is via…

Quantum Physics · Physics 2023-08-23 Luis A. Martínez-Martínez , Tzu-Ching Yen , Artur F. Izmaylov

We developed a Hamiltonian inspired by ASQTAD and highly improved staggered quark (HISQ) actions and show how these Hamiltonians can be used for quantum simulations. Gate costs for the time evolution of these improved Hamiltonians are…

High Energy Physics - Lattice · Physics 2024-02-08 Erik Gustafson , Ruth Van de Water

The Fermi-Hubbard model is a fundamental model in condensed matter physics that describes strongly correlated electrons. On the other hand, quantum computers are emerging as powerful tools for exploring the complex dynamics of these quantum…

Quantum Physics · Physics 2026-05-27 Talal Ahmed Chowdhury , Vladimir Korepin , Vincent R. Pascuzzi , Kwangmin Yu

The accuracy of quantum dynamics simulation is usually measured by the error of the unitary evolution operator in the operator norm, which in turn depends on certain norm of the Hamiltonian. For unbounded operators, after suitable…

Quantum Physics · Physics 2021-05-26 Dong An , Di Fang , Lin Lin

Solving partial differential equations for extremely large-scale systems within a feasible computation time serves in accelerating engineering developments. Quantum computing algorithms, particularly the Hamiltonian simulations, present a…

Quantum Physics · Physics 2024-09-10 Yuki Sato , Ruho Kondo , Ikko Hamamura , Tamiya Onodera , Naoki Yamamoto
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