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Recent advances in both theory and computational power have created opportunities to simulate biomolecular processes more efficiently using adaptive ensemble simulations. Ensemble simulations are now widely used to compute a number of…

Quantitative Methods · Quantitative Biology 2018-09-27 Peter M. Kasson , Shantenu Jha

The past few years have witnessed the concrete and fast spreading of quantum technologies for practical computation and simulation. In particular, quantum computing platforms based on either trapped ions or superconducting qubits have…

Quantum Physics · Physics 2020-04-21 Francesco Tacchino , Alessandro Chiesa , Stefano Carretta , Dario Gerace

By using quantum mechanical effects, quantum computers promise significant speedups in solving problems intractable for conventional computers. However, despite recent progress they remain limited in scaling and availability-making quantum…

Quantum Physics · Physics 2020-12-11 Thomas Grurl , Jürgen Fuß , Robert Wille

After the emergence of quantum mechanics and realising its need for an accurate understanding of physical systems, numerical methods were being used to undergo quantum mechanical treatment. With increasing system correlations and size,…

Particle accelerators represent some of the most sophisticated engineering achievements of our time. Their construction requires a unique combination of physics insight and mechanical engineering expertise. The aim of this paper is to…

Accelerator Physics · Physics 2026-01-19 Marc Timmins

A computer simulation has to be fast to be helpful, if it is employed to study the behavior of a multicomponent dynamic system. This paper discusses modeling concepts and algorithmic techniques useful for creating such fast simulations.…

Data Structures and Algorithms · Computer Science 2007-05-23 Boris D. Lubachevsky

Standardization of data formats in a scientific discipline brings a range of benefits to researchers, as it enables the sharing of workflows and solutions to common problems, provides the foundation for generically useful tools that can be…

Accelerator Physics · Physics 2026-04-22 A. D. Brynes , J. K. Jones , M. King , M. A. Johnson , N. Ziyan

Fundamental questions on the nature of matter and energy have found answers thanks to the use of particle accelerators. Societal applications, such as cancer treatment or cancer imaging, illustrate the impact of accelerators in our current…

Accelerator Physics · Physics 2017-05-31 V. Malka

Machine learning (ML) is a subfield of artificial intelligence. The term applies broadly to a collection of computational algorithms and techniques that train systems from raw data rather than a priori models. ML techniques are now…

The ubiquitous presence of computer simulations in all kinds of research areas evidence their role as the new driving force for the advancement of science and engineering research. Nothing seems to escape the image of success that computer…

Other Computer Science · Computer Science 2019-04-03 Juan M. Durán

The next generation of accelerators for MegaWatt proton, electron and heavy-ion beams puts unprecedented requirements on the accuracy of particle production predictions, the capability and reliability of the codes used in planning new…

Accelerator Physics · Physics 2012-02-09 N. V. Mokhov

Classical molecular dynamics (MD) simulations are important tools in life and material sciences since they allow studying chemical and biological processes in detail. However, the inherent scalability problem of particle-particle…

Distributed, Parallel, and Cluster Computing · Computer Science 2018-08-14 Michael Schaffner , Luca Benini

Simulations with high accuracy are an essential part of scientific research to accelerate the innovation process. They are especially useful for finding novel approaches or optimizing existing methods. Today, powerful software tools are…

Medical Physics · Physics 2022-08-31 Patrick Vogel , Martin A. Rückert , Thomas Kampf , Volker C. Behr

Classical simulations of time-dependent quantum systems are widely used in quantum control research. In particular, these simulations are commonly used to host iterative optimal control algorithms. This is convenient for algorithms that are…

Quantum Physics · Physics 2021-11-23 Tyler Jones , Kaiah Steven , Xavier Poncini , Matthew Rose , Arkady Fedorov

Recent years have seen spectacular progress in the development of innovative acceleration methods that are not based on traditional RF accelerating structures. These novel developments are at the interface of laser, plasma and accelerator…

Accelerator Physics · Physics 2021-03-22 M. Ferrario , R. Assmann

Computer aided engineering of multi-time-scale plasma systems which exhibit a quasi-steady state solution are challenging due to the large number of time steps required to reach convergence. Machine learning techniques combined with…

Plasma Physics · Physics 2025-10-03 Andrew T. Powis , Domenica Corona Rivera , Alexander Khrabry , Igor D. Kaganovich

The nonlinear space-charge effects in a high intensity or high brightness accelerator can have a significant impact on the beam properties through the accelerator. These effects are included in the accelerator design via self-consistent…

Accelerator Physics · Physics 2023-02-22 Ji Qiang

Real-life control tasks involve matters of various substances---rigid or soft bodies, liquid, gas---each with distinct physical behaviors. This poses challenges to traditional rigid-body physics engines. Particle-based simulators have been…

Machine Learning · Computer Science 2019-04-19 Yunzhu Li , Jiajun Wu , Russ Tedrake , Joshua B. Tenenbaum , Antonio Torralba

The use of computational simulation is by now so pervasive in society that it is no exaggeration to say that continued U.S. and international prosperity, security, and health depend in part on continued improvements in simulation…

Computers and Society · Computer Science 2020-12-14 Ian Foster , David Parkes , Stephan Zheng

In this dissertation, a fully object-oriented, fully relativistic, multi-dimensional Particle-In-Cell code was developed and applied to answer key questions in plasma-based accelerator research. The simulations increase the understanding of…

Computational Physics · Physics 2015-03-03 Roy G. Hemker