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Ionic pseudopotentials are widely used in classical simulations of materials to model the effective potential due to the nucleus and the core electrons. Modeling fewer electrons explicitly results in a reduction in the number of plane waves…

Quantum particle simulations have largely been based on time-independent, split-operator schemes in which kinetic and potential operators are interwoven to provide accurate approximations to system dynamics. These simulations can be very…

Quantum Physics · Physics 2016-01-26 Andrew T. Sornborger , Phillip Stancil , Michael Geller

Efficiently simulating quantum circuits on classical computers is a fundamental challenge in quantum computing. This paper presents a novel theoretical approach that achieves substantial speedups over existing simulators for a wide class of…

Quantum Physics · Physics 2026-02-10 Daksh Shami

Analog quantum simulators can directly emulate time-dependent Hamiltonian dynamics, enabling the exploration of diverse physical phenomena such as phase transitions, quench dynamics, and non-equilibrium processes. Realizing accurate analog…

Quantum Physics · Physics 2025-12-04 Yulong Dong , Christopher Kang , Murphy Yuezhen Niu

Quantum computers have rapidly improved in scale and fidelity, yet access to large systems remains limited for most researchers. This makes accurate and scalable noisy quantum simulation essential. While density matrix simulation provides…

Quantum Physics · Physics 2026-05-19 Siddharth Dangwal , Tina Oberoi , Ajay Sailopal , Dhirpal Shah , Frederic T. Chong

The random walk formalism is used across a wide range of applications, from modelling share prices to predicting population genetics. Likewise quantum walks have shown much potential as a frame- work for developing new quantum algorithms.…

In this work, we present a new algorithm for generating quantum circuits that efficiently implement continuous time quantum walks on arbitrary simple sparse graphs. The algorithm, called matching decomposition, works by decomposing a…

Quantum Physics · Physics 2026-01-19 Mostafa Atallah , Alvin Gonzales , Daniel Dilley , Igor Gaidai , Zain H. Saleem , Rebekah Herrman

We describe portable software to simulate universal quantum computers on massive parallel computers. We illustrate the use of the simulation software by running various quantum algorithms on different computer architectures, such as a IBM…

Quantum Physics · Physics 2009-11-13 K. De Raedt , K. Michielsen , H. De Raedt , B. Trieu , G. Arnold , M. Richter , Th. Lippert , H. Watanabe , N. Ito

Simulating quantum systems using classical computing equipment has been a significant research focus. This work demonstrates that circuits as large and complex as the random circuit sampling (RCS) circuits published as a part of Google's…

Quantum Physics · Physics 2024-11-20 Venkateswaran Kasirajan , Torey Battelle , Bob Wold

Analysis of quantum processes, especially in the context of noise, errors, and decoherence is essential for the improvement of quantum devices. An intuitive representation of those processes modeled by quantum channels are Pauli transfer…

Quantum Physics · Physics 2025-07-25 Lukas Hantzko , Lennart Binkowski , Sabhyata Gupta

Density matrices evolved according the von Neumann equation are commonly used to simulate the dynamics of driven quantum systems. However, computational methods using density matrices are often too slow to explore the large parameter spaces…

Computational Physics · Physics 2022-02-02 Spenser Talkington , HongWen Jiang

Quantum classification faces two key challenges. First, the difficulty of distinguishing between different classes varies: some class pairs are easy to separate, while others are more challenging. Second, practical execution is affected by…

Quantum Physics · Physics 2026-04-21 Yuhang Tu , Shengmei Zhao , Le Wang , Anqi Zhang

Pauli spin blockade (PSB) can be employed as a great resource for spin qubit initialisation and readout even at elevated temperatures but it can be difficult to identify. We present a machine learning algorithm capable of automatically…

In this paper, we design quantum circuits for the exponential of scaled $n$-qubit Pauli strings using single-qubit rotation gates, Hadamard gate, and CNOT gates. A key result we derive is that any two Pauli-string operators composed of…

Quantum Physics · Physics 2024-11-05 Rohit Sarma Sarkar , Sabyasachi Chakraborty , Bibhas Adhikari

We demonstrate that a classical emulation of quantum gate operations, here represented by an actual analog electronic device, can be modeled accurately as a quantum operation in terms of a universal set of Pauli operators. This observation…

Quantum Physics · Physics 2021-04-28 Brian R. La Cour , Corey I. Ostrove , Michael J. Starkey , Granville E. Ott

Population pharmacokinetic/pharmacodynamic (PK/PD) modeling traditionally relies on classical ordinary differential equations to simulate drug dynamics. In this work, we reformulate a compartmental PK/PD model as an open quantum system and…

Machine Learning · Computer Science 2026-05-12 Isshaan Singh , Nandan Patel

High-energy physics simulations traditionally rely on classical Monte Carlo methods to model complex particle interactions, often incurring significant computational costs. In this paper, we introduce a novel quantum-enhanced simulation…

Quantum Physics · Physics 2025-02-28 Euimin Lee , Sangmin Lee , Shiho Kim

Quantum computing is gaining increased attention as a potential way to speed up simulations of physical systems, and it is also of interest to apply it to simulations of classical plasmas. However, quantum information science is…

Plasma Physics · Physics 2024-06-19 I. Y. Dodin , E. A. Startsev

We introduce a distributed classical simulation algorithm for general quantum circuits, and present numerical results for calculating the output probabilities of universal random circuits. We find that we can simulate more qubits to greater…

Quantum Physics · Physics 2018-05-08 Jianxin Chen , Fang Zhang , Cupjin Huang , Michael Newman , Yaoyun Shi

The scalability, error correction and practical problem solving are important challenges for quantum computing (QC) as more emphasized by quantum supremacy (QS) experiments. Quantum path computing (QPC), recently introduced for linear optic…

Quantum Physics · Physics 2020-07-13 Burhan Gulbahar