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Accurate simulation of the non-adiabatic dynamics of molecules in excited electronic states is key to understanding molecular photo-physical processes. Here we present a novel method, based on a semiclassical approximation, that is as…

Chemical Physics · Physics 2016-05-24 Alexander White , Sergei Tretiak , Dmitry Mozyrsky

Computational micromagnetics requires numerical solution of partial differential equations to resolve complex interactions in magnetic nanomaterials. The Virtual Micromagnetics project described here provides virtual machine simulation…

Other Computer Science · Computer Science 2016-11-28 Mark Vousden , Marc-Antonio Bisotti , Maximilian Albert , Hans Fangohr

We present the development of a LabVIEW multimedia module for introductory Quantum Physics courses and our experience in the use of this application as an educational tool in learning methodologies. The program solves the Time Dependent…

We present a user-friendly open-source MATLAB\textsuperscript{\textregistered} package developed by the research group Turbulence, Wind energy and Stochastics (TWiSt) at the Carl von Ossietzky University of Oldenburg. Firstly, this package…

Fluid Dynamics · Physics 2023-01-19 André Fuchs , Swapnil Kharche , Matthias Wächter , Joachim Peinke

Recently a new formulation of quantum mechanics has been suggested which describes systems by means of ensembles of classical particles provided with a sign. This novel approach mainly consists of two steps: the computation of the Wigner…

Computational Engineering, Finance, and Science · Computer Science 2018-02-14 Jean Michel Sellier

We develop a new algorithm for the Brownian dynamics of soft matter systems that evolves time by spatially correlated Monte Carlo moves. The algorithm uses vector wavelets as its basic moves and produces hydrodynamics in the low Reynolds…

Soft Condensed Matter · Physics 2017-04-26 Oliver T Dyer , Robin C Ball

In this paper, we use a straightforward numerical method to solve scattering models in one-dimensional lattices based on a tight-binding band structure. We do this by using the wave packet approach to scattering, which presents a more…

Physics Education · Physics 2022-07-06 M. Staelens , F. Marsiglio

The double slits experiment is a basic phenomenon, which allows to explain principal behaviour of quantum systems. However, textbooks present static pictures of corresponding interference patterns. At the same time, modern computer software…

General Physics · Physics 2013-07-26 Eugene B. Postnikov , Artem A. Loktionov

Modeling open quantum systems -- quantum systems coupled to a bath -- is of value in condensed matter theory, cavity quantum electrodynamics, nanosciences and biophysics. The real-time simulation of open quantum systems was advanced…

Quantum Physics · Physics 2023-07-14 Hanggai Nuomin , David N. Beratan , Peng Zhang

We develop an analog classical simulation algorithm of noiseless quantum dynamics. By formulating the Schr\"{o}dinger equation into a linear system of real-valued ordinary differential equations (ODEs), the probability amplitudes of a…

Quantum Physics · Physics 2025-02-11 Ka-Wa Yip

We develop a wave packet molecular dynamics framework for modeling the structural properties of partially-ionized dense plasmas, based on a chemical model that explicitly includes bound state wavefunctions. Using hydrogen as a…

Classical simulation of quantum systems plays an important role in the study of many-body phenomena and in the benchmarking and verification of quantum technologies. Exact simulation is often limited to small systems because the dimension…

Quantum Physics · Physics 2024-06-04 Dominik S. Wild , Sabina Drăgoi , Corbin McElhanney , Jonathan Wurtz , Sheng-Tao Wang

Neutral-atom quantum simulators offer a promising approach to the exploration of strongly interacting many-body systems, with applications spanning condensed matter, statistical mechanics, and high-energy physics. Through a combination of…

We present a generic treatment of wave-packet revivals for quantum-mechanical systems. This treatment permits a classification of certain ideal revival types. For example, wave packets for a particle in a one-dimensional box are shown to…

Quantum Physics · Physics 2007-05-23 Robert Bluhm , Alan Kostelecky , James Porter , Bogdan Tudose

In the foundation of quantum mechanics, the spatial dimensions of electron wavepacket are understood only in terms of an expectation value - the probability distribution of the particle location. One can still inquire how the quantum…

Quantum Physics · Physics 2018-04-23 Avraham Gover , Yiming Pan

State-of-the-art quantum simulators permit local temporal control of interactions and midcircuit readout. These capabilities open the way towards the exploration of intriguing nonequilibrium phenomena. We illustrate this with a kinetically…

Quantum Physics · Physics 2025-06-12 Marcel Cech , María Cea , Mari Carmen Bañuls , Igor Lesanovsky , Federico Carollo

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

Tkwant is a Python package for the simulation of quantum nanoelectronics devices to which external time-dependent perturbations are applied. Tkwant is an extension of the Kwant package (https://kwant-project.org/) and can handle the same…

Mesoscale and Nanoscale Physics · Physics 2021-02-23 Thomas Kloss , Joseph Weston , Benoit Gaury , Benoit Rossignol , Christoph Groth , Xavier Waintal

While quantum simulation is one of the most promising applications of modern quantum devices, accessible simulation times are fundamentally limited by finite coherence times due to omnipresent noise. Based on the ideas of relational…

Quantum Physics · Physics 2025-09-03 Sebastian Gemsheim , Felix Fritzsch

In this article we present an exact and unified description of wave-packet dynamics in various 2D systems in presence of a transverse magnetic field. We consider an initial minimum-uncertainty Gaussian wave-packet, and find that its long…

Mesoscale and Nanoscale Physics · Physics 2015-03-19 Ashutosh Singh , Tutul Biswas , Tarun Kanti Ghosh , Amit Agarwal
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