CFD Vision 2030 Study: A Path to Revolutionary Computational Aerosciences

This report documents the results of a study to address the long range, strategic planning required by NASA's Revolutionary Computational Aerosciences (RCA) program in the area of computational fluid dynamics (CFD), including future software and hardware requirements for High Performance Computing (HPC). Specifically, the "Vision 2030" CFD study is to provide a knowledge-based forecast of the future computational capabilities required for turbulent, transitional, and reacting flow simulations across a broad Mach number regime, and to lay the foundation for the development of a future framework and/or environment where physics-based, accurate predictions of complex turbulent flows, including flow separation, can be accomplished routinely and efficiently in cooperation with other physics-based simulations to enable multi-physics analysis and design. Specific technical requirements from the aerospace industrial and scientific communities were obtained to determine critical capability gaps, anticipated technical challenges, and impediments to achieving the target CFD capability in 2030. A preliminary development plan and roadmap were created to help focus investments in technology development to help achieve the CFD vision in 2030

A survey and taxonomy of self-aware and self-adaptive cloud autoscaling systems

Autoscaling system can reconfigure cloud-based services and applications, through various configurations of cloud sofware and provisions of hardware resources, to adapt to the changing environment at runtime. Such a behavior offers the foundation for achieving elasticity in modern cloud computing paradigm. Given the dynamic and uncertain nature of the shared cloud infrastructure, cloud autoscaling system has been engineered as one of the most complex, sophisticated and intelligent artifacts created by human, aiming to achieve self-aware, self-adaptive and dependable runtime scaling. Yet, existing Self-aware and Self-adaptive Cloud Autoscaling System (SSCAS) is not mature to a state that it can be reliably exploited in the cloud. In this article, we survey the state-of-the-art research studies on SSCAS and provide a comprehensive taxonomy for this feld. We present detailed analysis of the results and provide insights on open challenges, as well as the promising directions that are worth investigated in the future work of this area of research. Our survey and taxonomy contribute to the fundamentals of engineering more intelligent autoscaling systems in the cloud

Performance Observability and Monitoring of High Performance Computing with Microservices

Traditionally, High Performance Computing (HPC) softwarehas been built and deployed as bulk-synchronous, parallel executables based on the message-passing interface (MPI) programming model. The rise of data-oriented computing paradigms and an explosion in the variety of applications that need to be supported on HPC platforms have forced a re-think of the appropriate programming and execution models to integrate this new functionality. In situ workflows demarcate a paradigm shift in HPC software development methodologies enabling a range of new applications --- from user-level data services to machine learning (ML) workflows that run alongside traditional scientific simulations. By tracing the evolution of HPC software developmentover the past 30 years, this dissertation identifies the key elements and trends responsible for the emergence of coupled, distributed, in situ workflows. This dissertation's focus is on coupled in situ workflows involving composable, high-performance microservices. After outlining the motivation to enable performance observability of these services and why existing HPC performance tools and techniques can not be applied in this context, this dissertation proposes a solution wherein a set of techniques gathers, analyzes, and orients performance data from different sources to generate observability. By leveraging microservice components initially designed to build high performance data services, this dissertation demonstrates their broader applicability for building and deploying performance monitoring and visualization as services within an in situ workflow. The results from this dissertation suggest that: (1) integration of performance data from different sources is vital to understanding the performance of service components, (2) the in situ (online) analysis of this performance data is needed to enable the adaptivity of distributed components and manage monitoring data volume, (3) statistical modeling combined with performance observations can help generate better service configurations, and (4) services are a promising architecture choice for deploying in situ performance monitoring and visualization functionality. This dissertation includes previously published and co-authored material and unpublished co-authored material

SERGHEI (SERGHEI-SWE) v1.0: a performance-portable high-performance parallel-computing shallow-water solver for hydrology and environmental hydraulics

The Simulation EnviRonment for Geomorphology, Hydrodynamics, and Ecohydrology in Integrated form (SERGHEI) is a multi-dimensional, multi-domain, and multi-physics model framework for environmental and landscape simulation, designed with an outlook towards Earth system modelling. At the core of SERGHEI's innovation is its performance-portable high-performance parallel-computing (HPC) implementation, built from scratch on the Kokkos portability layer, allowing SERGHEI to be deployed, in a performance-portable fashion, in graphics processing unit (GPU)-based heterogeneous systems. In this work, we explore combinations of MPI and Kokkos using OpenMP and CUDA backends. In this contribution, we introduce the SERGHEI model framework and present with detail its first operational module for solving shallow-water equations (SERGHEI-SWE) and its HPC implementation. This module is designed to be applicable to hydrological and environmental problems including flooding and runoff generation, with an outlook towards Earth system modelling. Its applicability is demonstrated by testing several well-known benchmarks and large-scale problems, for which SERGHEI-SWE achieves excellent results for the different types of shallow-water problems. Finally, SERGHEI-SWE scalability and performance portability is demonstrated and evaluated on several TOP500 HPC systems, with very good scaling in the range of over 20 000 CPUs and up to 256 state-of-the art GPUs

State-of-the-Art Review and Synthesis: A Requirement-based Roadmap for Standardized Predictive Maintenance Automation Using Digital Twin Technologies

Recent digital advances have popularized predictive maintenance (PMx), offering enhanced efficiency, automation, accuracy, cost savings, and independence in maintenance. Yet, it continues to face numerous limitations such as poor explainability, sample inefficiency of data-driven methods, complexity of physics-based methods, and limited generalizability and scalability of knowledge-based methods. This paper proposes leveraging Digital Twins (DTs) to address these challenges and enable automated PMx adoption at larger scales. While we argue that DTs have this transformative potential, they have not yet reached the level of maturity needed to bridge these gaps in a standardized way. Without a standard definition for such evolution, this transformation lacks a solid foundation upon which to base its development. This paper provides a requirement-based roadmap supporting standardized PMx automation using DT technologies. A systematic approach comprising two primary stages is presented. First, we methodically identify the Informational Requirements (IRs) and Functional Requirements (FRs) for PMx, which serve as a foundation from which any unified framework must emerge. Our approach to defining and using IRs and FRs to form the backbone of any PMx DT is supported by the track record of IRs and FRs being successfully used as blueprints in other areas, such as for product development within the software industry. Second, we conduct a thorough literature review spanning fields to determine the ways in which these IRs and FRs are currently being used within DTs, enabling us to point to the specific areas where further research is warranted to support the progress and maturation of requirement-based PMx DTs.Comment: (1)This work has been submitted to the IEEE for possible publication. Copyright may be transferred without notice, after which this version may no longer be accessibl

A survey on elasticity management in PaaS systems

[EN] Elasticity is a goal of cloud computing. An elastic system should manage in an autonomic way its resources, being adaptive to dynamic workloads, allocating additional resources when workload is increased and deallocating resources when workload decreases. PaaS providers should manage resources of customer applications with the aim of converting those applications into elastic services. This survey identifies the requirements that such management imposes on a PaaS provider: autonomy, scalability, adaptivity, SLA awareness, composability and upgradeability. This document delves into the variety of mechanisms that have been proposed to deal with all those requirements. Although there are multiple approaches to address those concerns, providers main goal is maximisation of profits. This compels providers to look for balancing two opposed goals: maximising quality of service and minimising costs. 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Agent-Based Modeling: The Right Mathematics for the Social Sciences?

This study provides a basic introduction to agent-based modeling (ABM) as a powerful blend of classical and constructive mathematics, with a primary focus on its applicability for social science research.� The typical goals of ABM social science researchers are discussed along with the culture-dish nature of their computer experiments. The applicability of ABM for science more generally is also considered, with special attention to physics. Finally, two distinct types of ABM applications are summarized in order to illustrate concretely the duality of ABM: Real-world systems can not only be simulated with verisimilitude using ABM; they can also be efficiently and robustly designed and constructed on the basis of ABM principles. �

Communication-Avoiding Algorithms for a High-Performance Hyperbolic PDE Engine

The study of waves has always been an important subject of research. Earthquakes, for example, have a direct impact on the daily lives of millions of people while gravitational waves reveal insight into the composition and history of the Universe. These physical phenomena, despite being tackled traditionally by different fields of physics, have in common that they are modelled the same way mathematically: as a system of hyperbolic partial differential equations (PDEs). The ExaHyPE project (“An Exascale Hyperbolic PDE Engine") translates this similarity into a software engine that can be quickly adapted to simulate a wide range of hyperbolic partial differential equations. ExaHyPE’s key idea is that the user only specifies the physics while the engine takes care of the parallelisation and the interplay of the underlying numerical methods. Consequently, a first simulation code for a new hyperbolic PDE can often be realised within a few hours. This is a task that traditionally can take weeks, months, even years for researchers starting from scratch. My main contribution to ExaHyPE is the development of the core infrastructure. This comprises the development and implementation of ExaHyPE’s solvers and adaptive mesh refinement procedures, it’s MPI+X parallelisation as well as high-level aspects of ExaHyPE’s application-tailored code generation, which allows to adapt ExaHyPE to model many different hyperbolic PDE systems. Like any high-performance computing code, ExaHyPE has to tackle the challenges of the coming exascale computing era, notably network communication latencies and the growing memory wall. In this thesis, I propose memory-efficient realisations of ExaHyPE’s solvers that avoid data movement together with a novel task-based MPI+X parallelisation concept that allows to hide network communication behind computation in dynamically adaptive simulations

Architecture and Advanced Electronics Pathways Toward Highly Adaptive Energy- Efficient Computing

With the explosion of the number of compute nodes, the bottleneck of future computing systems lies in the network architecture connecting the nodes. Addressing the bottleneck requires replacing current backplane-based network topologies. We propose to revolutionize computing electronics by realizing embedded optical waveguides for onboard networking and wireless chip-to-chip links at 200-GHz carrier frequency connecting neighboring boards in a rack. The control of novel rate-adaptive optical and mm-wave transceivers needs tight interlinking with the system software for runtime resource management