Integrating quantum computing resources into scientific HPC ecosystems

T Beck, A Baroni, R Bennink, G Buchs… - Future Generation …, 2024 - Elsevier
Quantum Computing (QC) offers significant potential to enhance scientific discovery in fields
such as quantum chemistry, optimization, and artificial intelligence. Yet QC faces challenges …

A survey on checkpointing strategies: Should we always checkpoint à la Young/Daly?

L Bautista-Gomez, A Benoit, S Di, T Herault… - Future Generation …, 2024 - Elsevier
Abstract The Young/Daly formula provides an approximation of the optimal checkpointing
period for a parallel application executing on a supercomputing platform. It was originally …

A digital twin framework for liquid-cooled supercomputers as demonstrated at exascale

W Brewer, M Maiterth, V Kumar… - … Conference for High …, 2024 - ieeexplore.ieee.org
We present ExaDigiT, an open-source framework for developing comprehensive digital
twins of liquid-cooled supercomputers. It integrates three main modules:(1) a resource …

Thermalization and criticality on an analog-digital quantum simulator

TI Andersen, N Astrakhantsev, AH Karamlou… - arXiv preprint arXiv …, 2024 - arxiv.org
Understanding how interacting particles approach thermal equilibrium is a major challenge
of quantum simulators. Unlocking the full potential of such systems toward this goal requires …

[HTML][HTML] GPU-enabled extreme-scale turbulence simulations: Fourier pseudo-spectral algorithms at the exascale using OpenMP offloading

PK Yeung, K Ravikumar, S Nichols… - Computer Physics …, 2025 - Elsevier
Fourier pseudo-spectral methods for nonlinear partial differential equations are of wide
interest in many areas of advanced computational science, including direct numerical …

Distributed computing for physics-based data-driven reduced modeling at scale: Application to a rotating detonation rocket engine

IG Farcas, RP Gundevia, R Munipalli… - arXiv preprint arXiv …, 2024 - arxiv.org
High-performance computing (HPC) has revolutionized our ability to perform detailed
simulations of complex real-world processes. A prominent contemporary example is from …

Computational electron–phonon superconductivity: from theoretical physics to material science

S Chen, F Zheng, Z Zhang, S Wu, KM Ho… - Journal of Physics …, 2024 - iopscience.iop.org
The search for room-temperature superconductors is a major challenge in modern physics.
The discovery of copper-oxide superconductors in 1986 brought hope but also revealed …

[HTML][HTML] Whispering gallery mode sensing through the lens of quantum optics, artificial intelligence, and nanoscale catalysis

E Zossimova, C Jones, KMK Perera… - Applied Physics …, 2024 - pubs.aip.org
Ultra-sensitive sensors based on the resonant properties of whispering gallery modes
(WGMs) can detect fractional changes in nanoscale environments down to the length and …

Exploring gpu-to-gpu communication: Insights into supercomputer interconnects

D De Sensi, L Pichetti, F Vella… - … Conference for High …, 2024 - ieeexplore.ieee.org
Multi-GPU nodes are increasingly common in the rapidly evolving landscape of exascale
supercomputers. On these systems, GPUs on the same node are connected through …

Very-Large-Scale GPU-Accelerated Nuclear Gradient of Time-Dependent Density Functional Theory with Tamm–Dancoff Approximation and Range-Separated Hybrid …

I Kim, D Jeong, LP Weisburn, A Alexiu… - Journal of Chemical …, 2024 - ACS Publications
Modern graphics processing units (GPUs) provide an unprecedented level of computing
power. In this study, we present a high-performance, multi-GPU implementation of the …