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Andrew Siegel

Publications and source records attributed to Andrew Siegel.

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Report of the 2026 Workshop on Next-Generation Ecosystems for Scientific Computing: Harnessing Community, Software, and AI for Cross-Disciplinary Team Science

Scientific computing is undergoing rapid transformation as advances in artificial intelligence, heterogeneous computing, automation, and data-intensive research reshape not only computational tools but also the institutions, workforce models, and collaborative practices that support scientific discovery. This report synthesizes insights from the 2026 Workshop on Next-Generation Ecosystems for Scientific Computing, the second in a three-year series focused on strengthening scientific computing ecosystems through socio-technical co-design. Workshop discussions identified four interdependent strategic themes: software ecosystems for AI-enabled scientific discovery; trust, validation, and traceability; human-AI teaming and paradigm shifts; and workforce, pedagogy, and governance. The report translates these themes into eight priorities for community action spanning shared research infrastructure, trust and traceability, user experience, human-AI teaming, workforce development, cross-sector coordination, stewardship and sustainability, and evaluation of scientific value. Together, these priorities outline directions for building scientific computing ecosystems that remain trustworthy, sustainable, innovative, and resilient as AI assumes a growing role in scientific work.

cs.CE

Performance Portable Monte Carlo Particle Transport on Intel, NVIDIA, and AMD GPUs

OpenMC is an open source Monte Carlo neutral particle transport application that has recently been ported to GPU using the OpenMP target offloading model. We examine the performance of OpenMC at scale on the Frontier, Polaris, and Aurora supercomputers, demonstrating that performance portability has been achieved by OpenMC across all three major GPU vendors (AMD, NVIDIA, and Intel). OpenMC's GPU performance is compared to both the traditional CPU-based version of OpenMC as well as several other state-of-the-art CPU-based Monte Carlo particle transport applications. We also provide historical context by analyzing OpenMC's performance on several legacy GPU and CPU architectures. This work includes some of the first published results for a scientific simulation application at scale on a supercomputer featuring Intel's Max series "Ponte Vecchio" GPUs. It is also one of the first demonstrations of a large scientific production application using the OpenMP target offloading model to achieve high performance on all three major GPU platforms.

cs.DC

Efficient Algorithms for Monte Carlo Particle Transport on AI Accelerator Hardware

The recent trend toward deep learning has led to the development of a variety of highly innovative AI accelerator architectures. One such architecture, the Cerebras Wafer-Scale Engine 2 (WSE-2), features 40 GB of on-chip SRAM, making it a potentially attractive platform for latency- or bandwidth-bound HPC simulation workloads. In this study, we examine the feasibility of performing continuous energy Monte Carlo (MC) particle transport on the WSE-2 by porting a key kernel from the MC transport algorithm to Cerebras's CSL programming model. New algorithms for minimizing communication costs and for handling load balancing are developed and tested. The WSE-2 is found to run 130 times faster than a highly optimized CUDA version of the kernel run on an NVIDIA A100 GPU -- significantly outpacing the expected performance increase given the difference in transistor counts between the architectures.

cs.DC

Improving the scalabiliy of neutron cross-section lookup codes on multicore NUMA system

We use the XSBench proxy application, a memory-intensive OpenMP program, to explore the source of on-node scalability degradation of a popular Monte Carlo (MC) reactor physics benchmark on non-uniform memory access (NUMA) systems. As background, we present the details of XSBench, a performance abstraction "proxy app" for the full MC simulation, as well as the internal design of the Linux kernel. We explain how the physical memory allocation inside the kernel affects the multicore scalability of XSBench. On a sixteen-core, two-socket NUMA testbed, the scaling efficiency is improved from a nonoptimized 70% to an optimized 95%, and the optimized version consumes 25% less energy than does the nonoptimized version. In addition to the NUMA optimization we evaluate a page-size optimization to XSBench and observe a 1.5x performance improvement, compared with a nonoptimized one.

cs.DC