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Effective modeling and numerical spectral-based propagation schemes are proposed for addressing the challenges in time-dependent quantum simulations of systems ranging from atoms, molecules, and nanostructures to emerging nanoelectronic…

Computational Physics · Physics 2015-05-19 Zuojing Chen , Eric Polizzi

An effective operational approach to quantum mechanics is to focus on the evolution of wave-packets, for which the wave-function can be seen in the semi-classical regime as representing a classical motion dressed with extra degrees of…

Quantum Physics · Physics 2023-08-23 Etera R. Livine

A powerful method for calculating the eigenvalues of a Hamiltonian operator consists of converting the energy eigenvalue equation into a matrix equation by means of an appropriate basis set of functions. The convergence of the method can be…

Quantum Physics · Physics 2007-05-23 Paolo Amore , Alfredo Aranda , Francisco Fernandez , Hugh Jones

This paper introduces a novel method for approximating the dynamics of a large autonomous system projected onto a fixed subspace. The core contribution is a novel recursive algorithm to construct an effective time-dependent generator that…

Quantum Physics · Physics 2025-10-24 Tommaso Grigoletto

Time-dependent linear differential equations are a common type of problem that needs to be solved in classical physics. Here we provide a quantum algorithm for solving time-dependent linear differential equations with logarithmic dependence…

Quantum Physics · Physics 2024-06-19 Dominic W. Berry , Pedro C. S. Costa

We examine several numerical techniques for the calculation of the dynamics of quantum systems. In particular, we single out an iterative method which is based on expanding the time evolution operator into a finite series of Chebyshev…

Strongly Correlated Electrons · Physics 2015-05-13 Holger Fehske , Jens Schleede , Gerald Schubert , Gerhard Wellein , Vladimir S. Filinov , Alan R. Bishop

Kohn-Sham spin-density functional theory provides an efficient and accurate model to study electron-electron interaction effects in quantum dots, but its application to large systems is a challenge. An efficient algorithm for the…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 Hong Jiang , Harold U. Baranger , Weitao Yang

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

The time-marching strategy, which propagates the solution from one time step to the next, is a natural strategy for solving time-dependent differential equations on classical computers, as well as for solving the Hamiltonian simulation…

Quantum Physics · Physics 2023-03-22 Di Fang , Lin Lin , Yu Tong

The construction of a better exchange-correlation potential in time-dependent density functional theory (TDDFT) can improve the accuracy of TDDFT calculations and provide more accurate predictions of the properties of many-electron systems.…

Quantum Physics · Physics 2023-08-23 Jun Yang , James D Whitfield

For a class of solutions of the fundamental difference equation of isotropic loop quantum cosmology, the difference equation can be replaced by a differential equation valid for {\em all} values of the triad variable. The differential…

General Relativity and Quantum Cosmology · Physics 2009-11-10 Ghanashyam Date , Golam Mortuza Hossain

Recently, there has been growing interest in simulating time-dependent Hamiltonians using quantum algorithms, driven by diverse applications, such as quantum adiabatic computing. While techniques for simulating time-independent Hamiltonian…

Quantum Physics · Physics 2024-11-06 Yu Cao , Shi Jin , Nana Liu

The time evolution of a closed quantum system is connected to its Hamiltonian through Schroedinger's equation. The ability to estimate the Hamiltonian is critical to our understanding of quantum systems, and allows optimization of control.…

We present a nonperturbative, first-principles numerical approach for time-dependent problems in the framework of quantum field theory. In this approach the time evolution of quantum field systems is treated in real time and at the…

Nuclear Theory · Physics 2013-11-14 Xingbo Zhao , Anton Ilderton , Pieter Maris , James P. Vary

The time-dependent Schr\"odinger equation (TDSE) in real space is fundamental to understanding the dynamics of many-electron quantum systems, with applications ranging from quantum chemistry to condensed matter physics and materials…

Quantum Physics · Physics 2026-03-31 Enze Hou , Yuzhi Liu , Linxuan Zhang , Difa Ye , Lei Wang , Han Wang

We propose a simple quantum algorithm for simulating highly oscillatory quantum dynamics, which does not require complicated quantum control logic for handling time-ordering operators. To our knowledge, this is the first quantum algorithm…

Quantum Physics · Physics 2022-04-20 Dong An , Di Fang , Lin Lin

Semi-discrete Galerkin formulations of transient wave equations, either with conforming or discontinuous Galerkin finite element discretizations, typically lead to large systems of ordinary differential equations. When explicit time…

Numerical Analysis · Mathematics 2012-10-19 Marcus Grote , Teodora Mitkova

We formulate the Kohn-Sham equations for the fractional quantum Hall effect by mapping the original electron problem into an auxiliary problem of composite fermions that experience a density dependent effective magnetic field.…

Strongly Correlated Electrons · Physics 2019-10-30 Yayun Hu , J. K. Jain

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

In this note we address the exact solutions of a time-dependent Hamiltonian composed by an oscillator-like interaction with both a frequency and a mass term that depend on time. The latter is achieved by constructing the appropriate point…

Quantum Physics · Physics 2020-02-26 Kevin Zelaya , Véronique Hussin