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Related papers: Spectral-based Propagation Schemes for Time-Depend…

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Over the past few decades, there has been substantial interest in evolution equations that involving a fractional-order derivative of order $\alpha\in(0,1)$ in time, due to their many successful applications in engineering, physics, biology…

Numerical Analysis · Mathematics 2019-01-30 Bangti Jin , Raytcho Lazarov , Zhi Zhou

We revisit Kohn-Sham time-dependent density-functional theory (TDDFT) equations and show that they derive from a canonical Hamiltonian formalism. We use this geometric description of the TDDFT dynamics to define families of symplectic…

Computational Physics · Physics 2023-11-20 Francois Mauger , Cristel Chandre , Mette B. Gaarde , Kenneth Lopata , Kenneth J. Schafer

Implementing the time evolution under a desired target Hamiltonian is critical for various applications in quantum science. Due to the exponential increase in the number of parameters with system size and experimental imperfections, this…

Quantum Physics · Physics 2025-12-11 Pascal Baßler , Markus Heinrich , Martin Kliesch

Based on our earlier works [Phys. Rev. B 75, 195127 (2007) & J. Chem. Phys. 128, 234703 (2008)], we propose a formally exact and numerically convenient approach to simulate time-dependent quantum transport from first-principles. The…

Chemical Physics · Physics 2015-05-18 Xiao Zheng , GuanHua Chen , Yan Mo , SiuKong Koo , Heng Tian , ChiYung Yam , YiJing Yan

To overcome the fast oscillatory behavior of correlation functions for extracting scattering phase shift in real-time quantum simulations encountered in Ref.\cite{Guo:2026qkx}, we propose and test two solutions in the present work. One is…

Quantum Physics · Physics 2026-04-02 Peng Guo , Paul LeVan , Frank X. Lee , Yong Zhao

Elastic wave propagation is studied in a heterogeneous 2-D medium consisting of an elastic matrix containing randomly distributed circular elastic inclusions. The aim of this study is to determine the effective wavenumbers when the incident…

Classical Physics · Physics 2016-06-29 Mathieu Chekroun , Loïc Le Marrec , Bruno Lombard , Joël Piraux

We provide a general method for efficiently simulating time-dependent Hamiltonian dynamics on a circuit-model based quantum computer. Our approach is based on approximating the truncated Dyson series of the evolution operator, extending the…

Quantum Physics · Physics 2019-04-10 Maria Kieferova , Artur Scherer , Dominic Berry

This report is concerned with the efficiency of numerical methods for simulating quantum spin systems, with the aim to implement an improved method for simulation of a time-dependent Hamiltonian that displays chirped pulses at a high…

Quantum Physics · Physics 2023-12-29 Danny Goodacre

We present an algorithm for constructing numerical solutions to one--dimensional nonlinear, variable coefficient boundary value problems. This scheme is based upon applying the Homotopy Analysis Method (HAM) to decompose a nonlinear…

Numerical Analysis · Mathematics 2019-03-27 Andrew C. Cullen , Simon R. Clarke

Compared with time independent Hamiltonians, the dynamics of generic quantum Hamiltonians $H(t)$ are complicated by the presence of time ordering in the evolution operator. In the context of digital quantum simulation, this difficulty…

Quantum Physics · Physics 2024-04-08 Jacob Watkins , Nathan Wiebe , Alessandro Roggero , Dean Lee

The design of advanced nuclear reactors (Gen IV) involves an array of challenging fluid-flow issues that affect safety and performance. Currently, these problems are addressed in an ad-hoc manner at varying scales which are time-consuming…

Fluid Dynamics · Physics 2022-03-15 Tri Nguyen , Elia Merzari , Haomin Yuan

This research addresses the numerical simulation of the Boltzmann transport equation for semiconductor devices by proposing a multidimensional self-adaptive numerical simulation framework. This framework is applied to two important…

Numerical Analysis · Mathematics 2025-09-22 Zeyu Zhang , Xiaoyu Zhang , Zhigang Song , Qing Fang

We increase the efficiency of a recently proposed time integration scheme for time dependent quantum transport by using the Lanczos method for time evolution. We illustrate our modified scheme in terms of a simple one dimensional model. Our…

Mesoscale and Nanoscale Physics · Physics 2008-08-13 Claudio Verdozzi , Carl-Olof Almbladh

In this paper, we propose a novel numerical scheme for solving time-fractional reaction-diffusion problems with Robin boundary conditions, where the time derivative is in the Caputo sense of order $\alpha\in(0,1)$. The existence and…

Numerical Analysis · Mathematics 2025-09-23 Qian Luo , Aiguo Xiao , Xiaoqiang Yan , Jingmin Xia

A novel scheme to simulate the evolution of a restricted set of observables of a quantum system is proposed. The set comprises the spectrum-generating algebra of the Hamiltonian. The idea is to consider a certain open-system evolution,…

Quantum Physics · Physics 2009-11-13 M. Khasin , R. Kosloff

In this work, we propose an adaptive spectral element algorithm for solving nonlinear optimal control problems. The method employs orthogonal collocation at the shifted Gegenbauer-Gauss points combined with very accurate and stable…

Optimization and Control · Mathematics 2023-03-06 Kareem T. Elgindy

We propose and develop a general method of numerical calculation of the wave function time evolution in a quantum system which is described by Hamiltonian of an arbitrary dimensionality and with arbitrary interactions. For this, we obtain a…

Atomic Physics · Physics 2014-04-25 Ivan Gonoskov , Mattias Marklund

Quantum dynamics simulations (QDSs) are one of the most highly anticipated applications of quantum computing. Quantum circuit depth for implementing Hamiltonian simulation algorithms is commonly time dependent so that long time dynamics…

Quantum Physics · Physics 2024-08-29 Linyun Wan , Jie Liu , Zhenyu Li , Jinlong Yang

Extensive N-body simulations are among the key means for the study of numerous astrophysical and cosmological phenomena, so various schemes are developed for possibly higher accuracy computations. We demonstrate the principal possibility…

Instrumentation and Methods for Astrophysics · Physics 2018-11-05 V. G. Gurzadyan , V. V. Harutyunyan , A. A. Kocharyan

This article introduces a nonparametric approach to spectral analysis of a high-dimensional multivariate nonstationary time series. The procedure is based on a novel frequency-domain factor model that provides a flexible yet parsimonious…

Methodology · Statistics 2019-10-29 Zeda Li , Ori Rosen , Fabio Ferrarelli , Robert T. Krafty