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Scientists are increasingly exploring and utilizing the massive parallelism of general-purpose accelerators such as GPUs for scientific breakthroughs. As a result, datacenters, hyperscalers, national computing centers, and supercomputers…

Distributed, Parallel, and Cluster Computing · Computer Science 2022-11-10 Prasoon Sinha , Akhil Guliani , Rutwik Jain , Brandon Tran , Matthew D. Sinclair , Shivaram Venkataraman

In simulation of nuclear reactor physics using the Monte Carlo neutron transport method on GPUs, the sorting of particles plays a significant role in performance of calculation. Traditionally, CPUs and GPUs are separated devices connected…

Hardware Architecture · Computer Science 2024-03-19 Changyuan Liu

We review recent advances in the capabilities of the open source ab initio Quantum Monte Carlo (QMC) package QMCPACK and the workflow tool Nexus used for greater efficiency and reproducibility. The auxiliary field QMC (AFQMC) implementation…

With the advent of the Exascale capability allowing supercomputers to perform at least $10^{18}$ IEEE 754 Double Precision (64 bits) operations per second, many concerns have been raised regarding the energy consumption of high-performance…

Distributed, Parallel, and Cluster Computing · Computer Science 2023-05-12 Tobias Fischbach , Emmanuel Kieffer , Pascal Bouvry

GPUs are prevalent in modern computing systems at all scales. They consume a significant fraction of the energy in these systems. However, vendors do not publish the actual cost of the power/energy overhead of their internal…

Distributed, Parallel, and Cluster Computing · Computer Science 2020-06-04 Yehia Arafa , Ammar ElWazir , Abdelrahman ElKanishy , Youssef Aly , Ayatelrahman Elsayed , Abdel-Hameed Badawy , Gopinath Chennupati , Stephan Eidenbenz , Nandakishore Santhi

We present the design and scalable implementation of an exascale climate emulator for addressing the escalating computational and storage requirements of high-resolution Earth System Model simulations. We utilize the spherical harmonic…

Estimates of energy usage in layers of computing from devices to algorithms have been determined and analyzed. Building on the previous analysis [3], energy needed from single devices and systems including three large-scale computing…

Computers and Society · Computer Science 2023-10-12 Sadasivan Shankar

Purpose: Monte Carlo methods are considered the gold standard for dosimetric computations in radiotherapy. Their execution time is however still an obstacle to the routine use of Monte Carlo packages in a clinical setting. To address this…

Medical Physics · Physics 2015-03-17 Sami Hissoiny , Hugo Bouchard , Benoît Ozell , Philippe Després

Quantum computing promises disruptive capabilities, yet its energy footprint has received far less attention than its asymptotic speedups. We present a first-order, full-system energy model for quantum computing in an high performance…

Quantum Physics · Physics 2026-05-13 Siyuan Niu , Di Wu , Ozgur Ozan Kilic , Kwangmin Yu

We present the numerical relativity module within AthenaK, an open source performance-portable astrophysics code designed for exascale computing applications. This module employs the Z4c formulation to solve the Einstein equations. We…

General Relativity and Quantum Cosmology · Physics 2024-09-17 Hengrui Zhu , Jacob Fields , Francesco Zappa , David Radice , James Stone , Alireza Rashti , William Cook , Sebastiano Bernuzzi , Boris Daszuta

We examine the computational energy requirements of different systems driven by the geometrical scaling law, and increasing use of Artificial Intelligence or Machine Learning (AI-ML) over the last decade. With more scientific and technology…

Hardware Architecture · Computer Science 2022-11-30 Sadasivan Shankar , Albert Reuther

Power is increasingly becoming a limiting resource in high-performance, GPU-accelerated computing systems. Understanding the range and sources of power variation is essential in setting realistic bounds on rack and system peak power, and…

Distributed, Parallel, and Cluster Computing · Computer Science 2022-12-20 Sridutt Bhalachandra , Brian Austin , Samuel Williams , Nicholas J. Wright

The Portable Extensible Toolkit for Scientific Computation (PETSc) library provides scalable solvers for nonlinear time-dependent differential and algebraic equations and for numerical optimization via the Toolkit for Advanced Optimization…

Mixed-precision algorithms have been proposed as a way for scientific computing to benefit from some of the gains seen for artificial intelligence (AI) on recent high performance computing (HPC) platforms. A few applications dominated by…

Distributed, Parallel, and Cluster Computing · Computer Science 2025-07-16 Aditya Kashi , Nicholson Koukpaizan , Hao Lu , Michael Matheson , Sarp Oral , Feiyi Wang

With heterogeneous systems, the number of GPUs per chip increases to provide computational capabilities for solving science at a nanoscopic scale. However, low utilization for single GPUs defies the need to invest more money for expensive…

Distributed, Parallel, and Cluster Computing · Computer Science 2025-03-11 Tanzima Z. Islam , Aniruddha Marathe , Holland Schutte , Mohammad Zaeed

We accelerated an ab-initio molecular QMC calculation by using GPGPU. Only the bottle-neck part of the calculation is replaced by CUDA subroutine and performed on GPU. The performance on a (single core CPU + GPU) is compared with that on a…

Computational Physics · Physics 2012-04-06 Yutaka Uejima , Tomoharu Terashima , Ryo Maezono

Matrix multiplication is fundamental in the backpropagation algorithm used to train deep neural network models. Libraries like Intel's MKL or NVIDIA's cuBLAS implemented new and optimized matrix multiplication techniques that increase…

Distributed, Parallel, and Cluster Computing · Computer Science 2024-05-28 L. A. Torres , Carlos J. Barrios H , Yves Denneulin

The aim of this work is to quantitatively evaluate the impact of computation on the energy consumption on ARM MPSoC platforms, exploiting CPUs, embedded GPUs and FPGAs. One of them possibly represents the future of High Performance…

Performance · Computer Science 2019-11-01 D. Goz , G. Ieronymakis , V. Papaefstathiou , N. Dimou , S. Bertocco , A. Ragagnin , L. Tornatore , G. Taffoni , I. Coretti

The Center for Exascale Monte Carlo Neutron Transport is developing Monte Carlo / Dynamic Code (MC/DC) as a portable Monte Carlo neutron transport package for rapid numerical methods exploration on CPU- and GPU-based high-performance…

Computational Physics · Physics 2025-05-30 Joanna Piper Morgan , Braxton Cuneo , Ilham Variansyah , Kyle E. Niemeyer

We explored the possible benefits of integrating quantum simulators in a "hybrid" quantum machine learning (QML) workflow that uses both classical and quantum computations in a high-performance computing (HPC) environment. Here, we used two…

Emerging Technologies · Computer Science 2024-07-11 Samuel T. Bieberich , Michael A. Sandoval