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Quantum computational chemistry (QCC) is the use of quantum computers to solve problems in computational quantum chemistry. We develop a high performance variational quantum eigensolver (VQE) simulator for simulating quantum computational…

Compression for machines is an emerging field, where inputs are encoded while optimizing the performance of downstream automated analysis. In scalable coding for humans and machines, the compressed representation used for machines is…

Image and Video Processing · Electrical Eng. & Systems 2023-05-19 Alon Harell , Yalda Foroutan , Ivan V. Bajic

In this proceedings we discuss the motivation, implementation details, and performance of a new physics code base called Grid. It is intended to be more performant, more general, but similar in spirit to QDP++\cite{QDP}. Our approach is to…

High Energy Physics - Lattice · Physics 2015-12-14 Peter Boyle , Azusa Yamaguchi , Guido Cossu , Antonin Portelli

The ever increasing demands placed upon machine performance have resulted in the need for more comprehensive particle accelerator modeling. Computer simulations are key to the success of particle accelerators. Many aspects of particle…

Graphics Processing Units (GPUs) are having a transformational effect on numerical lattice quantum chromodynamics (LQCD) calculations of importance in nuclear and particle physics. The QUDA library provides a package of mixed precision…

High Energy Physics - Lattice · Physics 2010-12-06 Ronald Babich , Michael A. Clark , Bálint Joó

This report discusses the implementation of two parallel algorithms on a distributed memory system for studying vortex dynamics in type-II superconductors. These algorithms are the same as that implemented for classical molecular dynamics…

Superconductivity · Physics 2007-05-23 Mahesh Chandran

iPIC3D is a widely used massively parallel Particle-in-Cell code for the simulation of space plasmas. However, its current implementation does not support execution on multiple GPUs. In this paper, we describe the porting of iPIC3D particle…

Distributed, Parallel, and Cluster Computing · Computer Science 2019-06-27 Chaitanya Prasad Sishtla , Steven W. D. Chien , Vyacheslav Olshevsky , Erwin Laure , Stefano Markidis

Many-core architectures of the future are likely to have distributed memory organizations and need fine grained concurrency management to be used effectively. The Self-adaptive Virtual Processor (SVP) is an abstract concurrent programming…

Distributed, Parallel, and Cluster Computing · Computer Science 2011-04-21 Michiel W. van Tol , Juha Koivisto

The last ten years have witnessed fast spreading of massively parallel computing clusters, from leading supercomputing facilities down to the average university computing center. Many companies in the private sector have undergone a similar…

Computational Engineering, Finance, and Science · Computer Science 2021-07-28 Xiao Zhang , Sebastian Achilles , Jan Winkelmann , Roland Haas , André Schleife , Edoardo Di Napoli

We present a novel multi-scale embedding scheme that links conventional QM/MM embedding and bootstrap embedding (BE) to allow simulations of large chemical systems on limited quantum devices. We also propose a mixed-basis BE scheme that…

Application-based benchmarks are increasingly used to quantify and compare quantum computers' performance. However, because contemporary quantum computers cannot run utility-scale computations, these benchmarks currently test this…

Particle-in-Cell (PIC) simulation codes have wide applicability to first-principles modeling of multidimensional nonlinear plasma phenomena, including wake-field accelerators. This review addresses both finite difference and pseudo-spectral…

Plasma Physics · Physics 2014-08-07 Brendan B. Godfrey

Static code analysis tools are designed to aid software developers to build better quality software in less time, by detecting defects early in the software development life cycle. Even the most experienced developer regularly introduces…

Distributed, Parallel, and Cluster Computing · Computer Science 2021-02-05 Manuel Arenaz , Xavier Martorell

We describe an asynchronous parallel stochastic proximal coordinate descent algorithm for minimizing a composite objective function, which consists of a smooth convex function plus a separable convex function. In contrast to previous…

Optimization and Control · Mathematics 2015-12-14 Ji Liu , Stephen J. Wright

High order methods have shown great potential to overcome performance issues of simulations of partial differential equations (PDEs) on modern hardware, still many users stick to low-order, matrix-based simulations, in particular in porous…

Numerical Analysis · Mathematics 2026-01-06 Christian Engwer , Alexander Schell , Nils-Arne Dreier

Modern processors are increasingly featuring multiple cores, as well as support for hardware virtualization. While these processors are common in desktop and server-class computing, they are less prevalent in embedded and real-time systems.…

Operating Systems · Computer Science 2013-10-25 Richard West , Ye Li , Eric Missimer

The processor accelerators are effective because they are working not (completely) on principles of stored program computers. They use some kind of parallelism, and it is rather hard to program them effectively: a parallel architecture by…

Distributed, Parallel, and Cluster Computing · Computer Science 2016-08-26 János Végh

Applications that require substantial computational resources today cannot avoid the use of heavily parallel machines. Embracing the opportunities of parallel computing and especially the possibilities provided by a new generation of…

Computational Physics · Physics 2017-09-14 Martin Weigel

Design of next generation computer systems should be supported by simulation infrastructure that must achieve a few contradictory goals such as fast execution time, high accuracy, and enough flexibility to allow comparison between large…

Distributed, Parallel, and Cluster Computing · Computer Science 2018-04-02 Ori Chalak , Cai Weiguang , Li Wei , Fang Lei , Zheng Libing , Wang Jintang , Wu Zuguang , Gu Xiongli , Wang Haibin , Avi Mendelson

Real-time systems, particularly those used in domains like automated driving, are increasingly adopting neural networks. From this trend arises the need for high-performance hardware exhibiting predictable timing behavior. While…

Hardware Architecture · Computer Science 2026-02-26 Maximilian Kirschner , Konstantin Dudzik , Ben Krusekamp , Jürgen Becker