ytopt: Autotuning Scientific Applications for Energy Efficiency at Large Scales

As we enter the exascale computing era, efficiently utilizing power and optimizing the performance of scientific applications under power and energy constraints has become critical and challenging. We propose a low-overhead autotuning framework to autotune performance and energy for various hybrid MPI/OpenMP scientific applications at large scales and to explore the tradeoffs between application runtime and power/energy for energy efficient application execution, then use this framework to autotune four ECP proxy applications -- XSBench, AMG, SWFFT, and SW4lite. Our approach uses Bayesian optimization with a Random Forest surrogate model to effectively search parameter spaces with up to 6 million different configurations on two large-scale production systems, Theta at Argonne National Laboratory and Summit at Oak Ridge National Laboratory. The experimental results show that our autotuning framework at large scales has low overhead and achieves good scalability. Using the proposed autotuning framework to identify the best configurations, we achieve up to 91.59% performance improvement, up to 21.2% energy savings, and up to 37.84% EDP improvement on up to 4,096 nodes

A reference model for integrated energy and power management of HPC systems

Optimizing a computer for highest performance dictates the efficient use of its limited resources. Computers as a whole are rather complex. Therefore, it is not sufficient to consider optimizing hardware and software components independently. Instead, a holistic view to manage the interactions of all components is essential to achieve system-wide efficiency. For High Performance Computing (HPC) systems, today, the major limiting resources are energy and power. The hardware mechanisms to measure and control energy and power are exposed to software. The software systems using these mechanisms range from firmware, operating system, system software to tools and applications. Efforts to improve energy and power efficiency of HPC systems and the infrastructure of HPC centers achieve perpetual advances. In isolation, these efforts are unable to cope with the rising energy and power demands of large scale systems. A systematic way to integrate multiple optimization strategies, which build on complementary, interacting hardware and software systems is missing. This work provides a reference model for integrated energy and power management of HPC systems: the Open Integrated Energy and Power (OIEP) reference model. The goal is to enable the implementation, setup, and maintenance of modular system-wide energy and power management solutions. The proposed model goes beyond current practices, which focus on individual HPC centers or implementations, in that it allows to universally describe any hierarchical energy and power management systems with a multitude of requirements. The model builds solid foundations to be understandable and verifiable, to guarantee stable interaction of hardware and software components, for a known and trusted chain of command. This work identifies the main building blocks of the OIEP reference model, describes their abstract setup, and shows concrete instances thereof. A principal aspect is how the individual components are connected, interface in a hierarchical manner and thus can optimize for the global policy, pursued as a computing center's operating strategy. In addition to the reference model itself, a method for applying the reference model is presented. This method is used to show the practicality of the reference model and its application. For future research in energy and power management of HPC systems, the OIEP reference model forms a cornerstone to realize --- plan, develop and integrate --- innovative energy and power management solutions. For HPC systems themselves, it supports to transparently manage current systems with their inherent complexity, it allows to integrate novel solutions into existing setups, and it enables to design new systems from scratch. In fact, the OIEP reference model represents a basis for holistic efficient optimization.Computer auf höchstmögliche Rechenleistung zu optimieren bedingt Effizienzmaximierung aller limitierenden Ressourcen. Computer sind komplexe Systeme. Deshalb ist es nicht ausreichend, Hardware und Software isoliert zu betrachten. Stattdessen ist eine Gesamtsicht des Systems notwendig, um die Interaktionen aller Einzelkomponenten zu organisieren und systemweite Optimierungen zu ermöglichen. Für Höchstleistungsrechner (HLR) ist die limitierende Ressource heute ihre Leistungsaufnahme und der resultierende Gesamtenergieverbrauch. In aktuellen HLR-Systemen sind Energie- und Leistungsaufnahme programmatisch auslesbar als auch direkt und indirekt steuerbar. Diese Mechanismen werden in diversen Softwarekomponenten von Firmware, Betriebssystem, Systemsoftware bis hin zu Werkzeugen und Anwendungen genutzt und stetig weiterentwickelt. Durch die Komplexität der interagierenden Systeme ist eine systematische Optimierung des Gesamtsystems nur schwer durchführbar, als auch nachvollziehbar. Ein methodisches Vorgehen zur Integration verschiedener Optimierungsansätze, die auf komplementäre, interagierende Hardware- und Softwaresysteme aufbauen, fehlt. Diese Arbeit beschreibt ein Referenzmodell für integriertes Energie- und Leistungsmanagement von HLR-Systemen, das „Open Integrated Energy and Power (OIEP)“ Referenzmodell. Das Ziel ist ein Referenzmodell, dass die Entwicklung von modularen, systemweiten energie- und leistungsoptimierenden Sofware-Verbunden ermöglicht und diese als allgemeines hierarchisches Managementsystem beschreibt. Dies hebt das Modell von bisherigen Ansätzen ab, welche sich auf Einzellösungen, spezifischen Software oder die Bedürfnisse einzelner Rechenzentren beschränken. Dazu beschreibt es Grundlagen für ein planbares und verifizierbares Gesamtsystem und erlaubt nachvollziehbares und sicheres Delegieren von Energie- und Leistungsmanagement an Untersysteme unter Aufrechterhaltung der Befehlskette. Die Arbeit liefert die Grundlagen des Referenzmodells. Hierbei werden die Einzelkomponenten der Software-Verbunde identifiziert, deren abstrakter Aufbau sowie konkrete Instanziierungen gezeigt. Spezielles Augenmerk liegt auf dem hierarchischen Aufbau und der resultierenden Interaktionen der Komponenten. Die allgemeine Beschreibung des Referenzmodells erlaubt den Entwurf von Systemarchitekturen, welche letztendlich die Effizienzmaximierung der Ressource Energie mit den gegebenen Mechanismen ganzheitlich umsetzen können. Hierfür wird ein Verfahren zur methodischen Anwendung des Referenzmodells beschrieben, welches die Modellierung beliebiger Energie- und Leistungsverwaltungssystemen ermöglicht. Für Forschung im Bereich des Energie- und Leistungsmanagement für HLR bildet das OIEP Referenzmodell Eckstein, um Planung, Entwicklung und Integration von innovativen Lösungen umzusetzen. Für die HLR-Systeme selbst unterstützt es nachvollziehbare Verwaltung der komplexen Systeme und bietet die Möglichkeit, neue Beschaffungen und Entwicklungen erfolgreich zu integrieren. Das OIEP Referenzmodell bietet somit ein Fundament für gesamtheitliche effiziente Systemoptimierung

Modern computing: Vision and challenges

Over the past six decades, the computing systems field has experienced significant transformations, profoundly impacting society with transformational developments, such as the Internet and the commodification of computing. Underpinned by technological advancements, computer systems, far from being static, have been continuously evolving and adapting to cover multifaceted societal niches. This has led to new paradigms such as cloud, fog, edge computing, and the Internet of Things (IoT), which offer fresh economic and creative opportunities. Nevertheless, this rapid change poses complex research challenges, especially in maximizing potential and enhancing functionality. As such, to maintain an economical level of performance that meets ever-tighter requirements, one must understand the drivers of new model emergence and expansion, and how contemporary challenges differ from past ones. To that end, this article investigates and assesses the factors influencing the evolution of computing systems, covering established systems and architectures as well as newer developments, such as serverless computing, quantum computing, and on-device AI on edge devices. Trends emerge when one traces technological trajectory, which includes the rapid obsolescence of frameworks due to business and technical constraints, a move towards specialized systems and models, and varying approaches to centralized and decentralized control. This comprehensive review of modern computing systems looks ahead to the future of research in the field, highlighting key challenges and emerging trends, and underscoring their importance in cost-effectively driving technological progress

Advancing research for seamless Earth system prediction

Whether on an urban or planetary scale, covering time scales of a few minutes or a few decades, the societal need for more accurate weather, climate, water, and environmental information has led to a more seamless thinking across disciplines and communities. This challenge, at the intersection of scientific research and society’s need, is among the most important scientific and technological challenges of our time. The “Science Summit on Seamless Research for Weather, Climate, Water, and Environment” organized by the World Meteorological Organization (WMO) in 2017, has brought together researchers from a variety of institutions for a cross-disciplinary exchange of knowledge and ideas relating to seamless Earth system science. The outcomes of the Science Summit, and the interactions it sparked, highlight the benefit of a seamless Earth system science approach. Such an approach has the potential to break down artificial barriers that may exist due to different observing systems, models, time and space scales, and compartments of the Earth system. In this context, the main future challenges for research infrastructures have been identified. A value cycle approach has been proposed to guide innovation in seamless Earth system prediction. The engagement of researchers, users, and stakeholders will be crucial for the successful development of a seamless Earth system science that meets the needs of society

Report on the Third Workshop on Sustainable Software for Science: Practice and Experiences (WSSSPE3)

This report records and discusses the Third Workshop on Sustainable Software for Science: Practice and Experiences (WSSSPE3). The report includes a description of the keynote presentation of the workshop, which served as an overview of sustainable scientific software. It also summarizes a set of lightning talks in which speakers highlighted to-the-point lessons and challenges pertaining to sustaining scientific software. The final and main contribution of the report is a summary of the discussions, future steps, and future organization for a set of self-organized working groups on topics including developing pathways to funding scientific software; constructing useful common metrics for crediting software stakeholders; identifying principles for sustainable software engineering design; reaching out to research software organizations around the world; and building communities for software sustainability. For each group, we include a point of contact and a landing page that can be used by those who want to join that group's future activities. The main challenge left by the workshop is to see if the groups will execute these activities that they have scheduled, and how the WSSSPE community can encourage this to happen

Simulating Stellar Merger using HPX/Kokkos on A64FX on Supercomputer Fugaku

The increasing availability of machines relying on non-GPU architectures, such as ARM A64FX in high-performance computing, provides a set of interesting challenges to application developers. In addition to requiring code portability across different parallelization schemes, programs targeting these architectures have to be highly adaptable in terms of compute kernel sizes to accommodate different execution characteristics for various heterogeneous workloads. In this paper, we demonstrate an approach to code and performance portability that is based entirely on established standards in the industry. In addition to applying Kokkos as an abstraction over the execution of compute kernels on different heterogeneous execution environments, we show that the use of standard C++ constructs as exposed by the HPX runtime system enables superb portability in terms of code and performance based on the real-world Octo-Tiger astrophysics application. We report our experience with porting Octo-Tiger to the ARM A64FX architecture provided by Stony Brook's Ookami and Riken's Supercomputer Fugaku and compare the resulting performance with that achieved on well established GPU-oriented HPC machines such as ORNL's Summit, NERSC's Perlmutter and CSCS's Piz Daint systems. Octo-Tiger scaled well on Supercomputer Fugaku without any major code changes due to the abstraction levels provided by HPX and Kokkos. Adding vectorization support for ARM's SVE to Octo-Tiger was trivial thanks to using standard C+