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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…

计算物理 · 物理学 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…

量子物理 · 物理学 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…

量子物理 · 物理学 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…

量子物理 · 物理学 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…

量子物理 · 物理学 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…

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…

介观与纳米尺度物理 · 物理学 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…

量子物理 · 物理学 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…

量子物理 · 物理学 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.…

量子物理 · 物理学 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…

广义相对论与量子宇宙学 · 物理学 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…

量子物理 · 物理学 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…

核理论 · 物理学 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…

量子物理 · 物理学 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…

量子物理 · 物理学 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…

数值分析 · 数学 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.…

强关联电子 · 物理学 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…

量子物理 · 物理学 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…

量子物理 · 物理学 2020-02-26 Kevin Zelaya , Véronique Hussin