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Quantum states can be described equivalently by density matrices, Wigner functions or quantum tomograms. We analyze the accuracy and performance of three related semiclassical approaches to quantum dynamics, in particular with respect to…

Quantum Physics · Physics 2009-08-27 G. Schubert , V. S. Filinov , K. Matyash , R. Schneider , H. Fehske

The Chebyshev expansion method is a well-established technique for computing the time evolution of quantum states, particularly in Hermitian systems with a bounded spectrum. Here, we show that the applicability of the Chebyshev expansion…

Mesoscale and Nanoscale Physics · Physics 2025-10-14 Áron Holló , Dániel Varjas , Cosma Fulga , László Oroszlány , Viktor Könye

We present and test a new algorithm for time-evolving quantum many-body systems initially proposed by Holzner et al. [Phys. Rev. B 83, 195115 (2011)]. The approach is based on merging the matrix product state (MPS) formalism with the method…

Strongly Correlated Electrons · Physics 2018-07-23 Jad C. Halimeh , Fabian Kolley , Ian P. McCulloch

We present a method for describing the time evolution of many-body controlled quantum systems using matrix product operators (MPOs). Existing techniques for solving the time-dependent Schr\"odinger equation (TDSE) with an MPO Hamiltonian…

Quantum Physics · Physics 2026-01-05 Llorenç Balada Gaggioli , Jakub Mareček

The numerical integration of the Schr\"odinger equation by discretization of time is explored for the curved manifolds arising from finite representations based on evolving basis states. In particular, the unitarity of the evolution is…

Computational Physics · Physics 2021-11-29 Jessica F. K. Halliday , Emilio Artacho

Simulating time evolution of quantum systems is one of the most promising applications of quantum computing and also appears as a subroutine in many applications such as Green's function methods. In the current era of NISQ machines we…

Quantum Physics · Physics 2021-06-21 Nathan Fitzpatrick , Harriet Apel , David Muñoz Ramo

Perturbation theory is a powerful tool for studying large-scale structure formation in the universe and calculating observables such as the power spectrum or bispectrum. However, beyond linear order, typically this is done by assuming a…

Cosmology and Nongalactic Astrophysics · Physics 2023-08-09 Nicholas Choustikov , Zvonimir Vlah , Anthony Challinor

A set of algorithms is presented for efficient numerical calculation of the time evolution of classical dynamical systems. Starting with a first approximation for solving the differential equations that has a "reversible" character, we show…

Classical Physics · Physics 2017-03-22 Charles Schwartz

Classical molecular dynamics simulation is performed mostly using the established velocity Verlet integrator or other symplectic propagation schemes. In this work, an alternative formulation of numerical propagators for classical molecular…

Chemical Physics · Physics 2024-07-22 Ivan Kondov

We analyse and compare several algorithms to compute numerically periodic solutions of high-dimensional dynamical systems and investigate their Floquet stability without building the monodromy matrix. The solution and its perturbation are…

Fluid Dynamics · Physics 2025-06-17 Artur Gesla , Yohann Duguet , Patrick Le Quéré , Laurent Martin Witkowski

In order to model realistic quantum devices it is necessary to simulate quantum systems strongly coupled to their environment. To date, most understanding of open quantum systems is restricted either to weak system-bath couplings, or to…

Quantum Physics · Physics 2018-09-25 Aidan Strathearn , Peter Kirton , Dainius Kilda , Jonathan Keeling , Brendon W. Lovett

We explore the applicability of a stochastic time-evolution algorithm based on probabilistic angle interpolation. To simplify the pre-processing of the algorithm, we take the continuous-time limit, thereby explicitly eliminating Trotter…

Quantum Physics · Physics 2026-04-06 Tomoya Hayata , Yuta Kikuchi

We present a systematic numerical iteration approach to study the evolution properties of the spin-boson systems, which works well in whole coupling regime. This approach involves the evaluation of a set of coefficients for the formal…

Quantum Physics · Physics 2018-12-11 Xueying Liu , Xuezao Ren , Chen Wang , Gao Xianlong , Kelin Wang

The dynamics of quantum systems can be approximated by the time propagation of Gaussian wave packets. Applying a time dependent variational principle, the time evolution of the parameters of the coupled Gaussian wave packets can be…

Quantum Physics · Physics 2008-02-01 T. Fabcic , J. Main , G. Wunner

The purpose of this work is to test the application of the finite element method to quantum mechanical problems, in particular for solving the Schroedinger equation. We begin with an overview of quantum mechanics, and standard numerical…

High Energy Physics - Lattice · Physics 2009-09-29 Avtar S. Sehra

Imaginary-time evolution is fundamental for analyzing quantum many-body systems, yet classical simulation requires exponentially growing resources in both system size and evolution time. While quantum approaches reduce the system-size…

Quantum Physics · Physics 2025-12-12 Lei Zhang , Jizhe Lai , Xian Wu , Xin Wang

The most widely used approach for simulating the dynamics of time-dependent Hamiltonians via quantum computation depends on the quantum-classical hybrid variational quantum time evolution algorithm, in which ordinary differential equations…

Quantum Physics · Physics 2026-03-19 Minchen Qiao , Zi-Ming Li , Yu-xi Liu

The manuscript presents a new technique for computing the exponential of skew-Hermitian operators. Principal advantages of the proposed method include: stability even for large time-steps, the possibility to parallelize in time over many…

Numerical Analysis · Mathematics 2014-02-24 T. S. Haut , T. Babb , P. G. Martinsson , B. A. Wingate

We propose a numerical method for approximate calculations of the time evolution of point particle systems given only the system's Hamiltonian function and initial conditions. The method both generates and solves the equations of motion…

Computational Physics · Physics 2022-12-27 José M. L. Amoreira , Luís J. M. Amoreira

We present numerical solutions for differential equations by expanding the unknown function in terms of Chebyshev polynomials and solving a system of linear equations directly for the values of the function at the extrema (or zeros) of the…

Computational Physics · Physics 2009-10-31 Bogdan Mihaila , Ioana Mihaila
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