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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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All sourcesNASA NTRSDOE OSTI
NASA NTRS1993

Measurement-based performance evaluation technique for high-performance computers

A measurement-based performance evaluation technique has been used to characterize the OS performance of Cedar, a hierarchical shared-memory multiprocessor system. Thirteen OS performance meters were used to capture the operating system activities for compute-bound workloads. Three representative applications from the Perfect Benchmark Suite were used to measure the OS performance in a dedicated system and in multiprogrammed workloads. It was found that 13-23 percent of the total execution time on a dedicated system was spent in executing OS-related activities. Under multiprogramming, 12-14 percent of the total execution time was used by the OS. The impact of multiprogramming on the operating system performance meters was also measured.

Sharma, S.↗
DOE OSTI2018

A High Performance Computational Framework for Dynamic Security Assessment under Uncertainty

Dynamic security assessment (DSA) is a critical function to evaluate power grids’ capability to survive the transition caused by a set of disturbances to an acceptable steady-state condition. Its computational burden is heavy. With the challenges brought by renewable energy and new smart grid technologies, DSA under uncertainty has to be considered to study the impact of forecast errors on DSA simulation, which further increases the computational burden. To address this challenge, this paper presents a high performance computational framework to support DSA simulation user uncertainty. The computational framework aims to provide a seamless workflow that links data from high performance computing, statistical analysis, to visualization so that a problem can be easily expressed in a way compatible with different functions. It also enables software compatibility such that application development can be more efficient. Case study results of the ESCA60 system and a western U.S. size system show the advantages and efficiency of the computational framework.

dynamic security assessment, high performance comp↗
NASA NTRSDate not supplied

Use NASA Earthdata in the Cloud

With the impending arrival of new, high-data-volume Earth observation missions, NASA’s ability to effectively ingest, process, and archive large amounts of data requires the most cost-effective, flexible, and scalable data-management architectures and technologies. To meet these demands, NASA's Earth Science Data Systems (ESDS) Program is implementing a strategic vision to develop and operate multiple components of NASA's Earth Observing System Data and Information System (EOSDIS) in a commercial cloud environment. As more earth observing data is moved into the cloud, NASA EOSDIS wants to share our reasoning for moving data into the commercial cloud, as well as demonstrate how end-users can take advantage of both data in the cloud and cloud-deployed services. This presentation explains the enterprise reasons for moving data into the cloud, specifically the scalability of cloud systems, the flexibility to pivot to the most optimal language/system/architecture, and the reduced redundancy of a common architecture. Then we primarily focus on the user-driven reasons for moving to the cloud. Equal access to high performance computing helps all parties, especially users that don't have access to their own on-premise computing infrastructure. Rapid deployment allows users to spin up their own systems without needing the extensive platform previously required for large scale development. Cost effectiveness allows users a wide breadth of computing options, from super computer ability to small scale development, which can help underserved communities. Finally we link to internal resources that users can utilize to begin their cloud based development journey without having to be an expert in the field.

Nicholas Doty↗
DOE OSTI2020

AI-Science for Performance Optimization and Diagnosis of Science Instrument Federations

Next generation of science workflows are expected to be executed over complex federations composed of supercomputers, science instruments, storage systems and networks, with new additions of the edge and cloud systems and services. The sheer complexity of these multi-domain federations makes it hard to manage them and optimize their performance, as small impedance mismatches (that can dynamically develop between systems) could drastically degrade the entire federation performance. Recent proliferation of Software Defined Everything (SDX) technologies combined with containerization frameworks provide custom instruments that can monitor and collect critical measurements at various levels to support diagnoses and performance optimization; but their data too enormous for human operators and analysts to process and generate decisions. Machine Learning (ML) methods that extract critical parameters, relationships and trends from the data offer general solutions. Artificial Intelligence (AI) and ML methods must be custom-developed for these problems based on solid, rigorous foundations, since black-box approaches are often ineffective and unsound.We propose to develop comprehensive AI-Science for the performance of science federations to (i) monitor and control storage, networks, experiments, and computing systems across multiple domains via softwarization layers, at speeds and scales orders of magnitude superior to current practice, (ii) optimally realize and orchestrate complex workflows with high performance by using dynamic state and performance estimation methods, and (iii) aggregate measurements across sites and time to develop infrastructure-level profiles, optimizations and diagnoses using AI-Science based on foundational principles from ML, game theory, and information fusion areas.

Rao, Nageswara↗
DOE OSTI2017

MarFS, a Near-POSIX Interface to Cloud Objects

The engineering forces driving development of “cloud” storage have produced resilient, cost-effective storage systems that can scale to 100s of petabytes, with good parallel access and bandwidth. These features would make a good match for the vast storage needs of High-Performance Computing datacenters, but cloud storage gains some of its capability from its use of HTTP-style Representational State Transfer (REST) semantics, whereas most large datacenters have legacy applications that rely on POSIX file-system semantics. MarFS is an open-source project at Los Alamos National Laboratory that allows us to present cloud-style object-storage as a scalable near-POSIX file system. We have also developed a new storage architecture to improve bandwidth and scalability beyond what’s available in commodity object stores, while retaining their resilience and economy. Additionally, we present a scheme for scaling the POSIX interface to allow billions of files in a single directory and trillions of files in total.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2025

Optimizing Management of Persistent Data Structures in High-Performance Analytics

Large-scale data analytics workflows ingest massive input data into various data structures, including graphs and key-value datastores. These data structures undergo multiple transformations and computations and are typically reused in incremental and iterative analytics workflows. Persisting in-memory views of these data structures enables reusing them beyond the scope of a single program run while avoiding repetitive raw data ingestion overheads. Memory-mapped I/O enables persisting in-memory data structures without data serialization and deserialization overheads. However, memory-mapped I/O lacks the key feature of persisting consistent snapshots of these data structures for incremental ingestion and processing. The obstacles to efficient virtual memory snapshots using memory-mapped I/O include background writebacks outside the application’s control, and the significantly high storage footprint of such snapshots. To address these limitations, we present Privateer, a memory and storage management tool that enables storage-efficient virtual memory snapshotting while also optimizing snapshot I/O performance. Here, we integrated Privateer into Metall, a state-of-the-art persistent memory allocator for C++, and the Lightning Memory-Mapped Database (LMDB), a widely-used key-value datastore in data analytics and machine learning. Privateer optimized application performance by 1.22× when storing data structure snapshots to node-local storage, and up to 16.7× when storing snapshots to a parallel file system. Privateer also optimizes storage efficiency of incremental data structure snapshots by up to 11× using data deduplication and compression.

Computer science↗
DOE OSTI2020

US Department of Energy, Office of Science High Performance Computing Facility Operational Assessment 2019 Oak Ridge Leadership Computing Facility

Oak Ridge National Laboratory's (ORNL's) Leadership Computing Facility (OLCF) continues to surpass its operational target goals: supporting users; delivering fast, reliable computational ecosystems; creating innovative solutions for high performance computing (HPC) needs; and managing risks, safety, and security associated with operating some of the most powerful computers in the world. The results can be seen in the cutting-edge science conducted by users and the praise from the research community. Calendar year (CY) 2019 was a big year as OLCF staff ran five world-class resources (the leadershipclass computers Titan and Summit, the large analysis cluster called Eos, and the massive parallel filesystems called Atlas and Alpine)) and also began power and cooling upgrades for a 2021 exascale system called Frontier. While continuing exceptional operation of Titan, Eos, and Rhea, the OLCF released the Summit supercomputer for production on January 1, 2019. Summit debuted as the most capable and efficient system in its class and has been recognized as the most powerful system in the world for its performance on both the high performance linpack (HPL) and conjugate gradient (HPCG) benchmark applications since June 2018 according to TOP500. Summit represents the culmination of a multiyear effort between the OLCF, IBM, NVIDIA, and Mellanox to deliver a system that is unmatched for modeling, simulation, data analysis, and learning. To hit the ground running with science-ready applications on day one, application teams worked closely with the OLCF through the Center for Accelerated Application Readiness (CAAR) program for years in advance of the Summit deployment. CY 2019 was filled with outstanding results and accomplishments: a very high rating from users on overall satisfaction for the sixth year in a row; a tremendous amount of core-hours delivered to researchers from two leadership-class systems; and success in delivering on the allocation split of roughly 60%, 30%, and 10% of core-hours offered for the Innovative and Novel Computational Impact on Theory and Experiment (INCITE), Advanced Scientific Computing Research Leadership Computing Challenge (ALCC), and Director's Discretionary (DD) programs, respectively (see Operational Performance section). These accomplishments, coupled with the high utilization rates (overall and capability usage), represent the fulfillment of the promise of both leadership-class machines: efficient facilitation of leadership-class computational applications. Table ES.1 presents a summary of the 2019 OLCF metric targets and the associated results. More information can be found in the Operational Performance section for each OLCF resource. The scientific accomplishments of OLCF users are a strong indication of long-term operational success, with publications this year in such notable journals and publications as Nature, Nature Physics, Nature Plants, Physical Review X, Journal of the American Physical Society, Cell, Nano Letters, and Trends in Biotechnology. Crucial domain-specific discoveries facilitated by resources at the OLCF are described in the High Performance Computing Facility Operational Assessment 2019 Oak Ridge Leadership Computing Facility (OAR) Strategic Results section. For example, researchers used Summit to pinpoint and understand the production of proteins from genetic information, including mutations and the functional expression of disease (Section 8.2).

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2023

Computational framework for modeling of physical process

Techniques, systems, and devices are described for providing a computational frame for estimating high-dimensional stochastic behaviors. In one exemplary aspect, a method for performing numerical estimation includes receiving a set of measurements of a stochastic behavior. The set of correlated measurements follows a non-standard probability distribution and is non-linearly correlated. Also, a non-linear relationship exists between a set of system variables that describes the stochastic behavior and a corresponding set of measurements. The method includes determining, based on the set of measurements, a numerical model of the stochastic behavior. The numerical model comprises a feature space comprising non-correlated features corresponding to the stochastic behavior. The non-correlated features have a dimensionality of M and the set of measurements has a dimensionality of N, M being smaller than N. The method includes generating a set of approximated system variables corresponding to the set of measurements based on the numerical model.

Chen, Xiao↗
DOE OSTI2024

Computational framework for modeling of physical process

Techniques, systems, and devices are described for providing a computational frame for estimating high-dimensional stochastic behaviors. In one exemplary aspect, a method for performing numerical estimation includes receiving a set of measurements of a stochastic behavior. The set of correlated measurements follows a non-standard probability distribution and is non-linearly correlated. Also, a non-linear relationship exists between a set of system variables that describes the stochastic behavior and a corresponding set of measurements. The method includes determining, based on the set of measurements, a numerical model of the stochastic behavior. The numerical model comprises a feature space comprising non-correlated features corresponding to the stochastic behavior. The non-correlated features have a dimensionality of M and the set of measurements has a dimensionality of N, M being smaller than N. The method includes generating a set of approximated system variables corresponding to the set of measurements based on the numerical model.

Chen, Xiao↗
NASA NTRS1975

The effects of selected modern technological concepts on the performance and handling characteristics of LTA vehicles

The results of an airship design sensitivity study are presented. A wide variety of airship design concepts, including the classical and high aero-lift augmented-hybrids are examined with regard to specific technological improvements, and consequent gains in performance, stability and control and flying qualities. Variations in size, payload, power required and airspeed are quantitatively analyzed for airships representing aero-to-buoyant lift ratios of zero to 3.0 over a range of technology improvements implying reduced drag, reduced structural weight fractions and lighter, more efficient propulsion systems. Qualitatively, future airships are discussed in terms of stability, control and flying qualities requirements dictated by projected demands for vastly improved operational effectiveness and ease of handling. Such topics include stability augmentation systems, load-alleviation systems and total computer state-sensing and controls management systems. It was shown that, for the most part, highly refined conventional designs offer attractive gains in both performance and ease of handling. Hybrid airships represent a good potential for missions requiring the transport of heavy payloads at higher airspeeds over shorter ranges without the capability for sustained hover and vertical flight.

Mazza, C. J.↗
NASA NTRS1990

Cost-effective use of liquid nitrogen in cryogenic wind tunnels, phase 2

Cryogenic seal tests were performed and Rulon A was selected for the subject nutating positive displacement expander. A four-chamber expander was designed and fabricated. A nitrogen reliquefier flow system was also designed and constructed for testing the cold expander. Initial tests were unsatisfactory because of high internal friction attributed to nutating Rulon inlet and outlet valve plates. Replacement of the nutating valves with cam-actuated poppet valves improved performance. However, no net nitrogen reliquefaction was achieved due to high internal friction. Computer software was developed for accurate calculation of nitrogen reliquefaction from a system such as that proposed. These calculations indicated that practical reliquefaction rates of 15 to 19 percent could be obtained. Due to mechanical problems, the nutating expander did not demonstrate its feasibility nor that of the system. It was concluded that redesign and testing of a smaller nutating expander was required to prove concept feasibility.

Mcintosh, Glen E.↗
NASA NTRS1996

High-Performance Computing for the Electromagnetic Modeling and Simulation of Interconnects

The electromagnetic modeling of packages and interconnects plays a very important role in the design of high-speed digital circuits, and is most efficiently performed by using computer-aided design algorithms. In recent years, packaging has become a critical area in the design of high-speed communication systems and fast computers, and the importance of the software support for their development has increased accordingly. Throughout this project, our efforts have focused on the development of modeling and simulation techniques and algorithms that permit the fast computation of the electrical parameters of interconnects and the efficient simulation of their electrical performance.

Schutt-Aine, Jose E.↗
DOE OSTI2021

Linear and Nonlinear Solvers for Simulating Multiphase Flow within Large-Scale Engineered Subsurface Systems

Simulation of multiphase flow in the subsurface is well-known to be computationally challenging. While there have been many studies that have explored approaches to overcoming these challenges, they often utilize relatively simple case studies. In this paper, we focus on the unique numerical challenges posed by modeling large-scale engineered subsurface systems, characterized by discrete features embedded in a heterogeneous natural subsurface setting. The man-made features such as shafts, tunnels, and barriers often cause multiple challenges in modeling the domain for multiphase porous media flow. This flow scenario can have a wide range of applications such as nuclear waste repositories, enhanced recovery of a petroleum reservoir, geothermal engineering, and carbon sequestration. An example of these severe numerical challenges is the case of performance assessment (PA) for Waste Isolation Pilot Plant (WIPP), the only operating deep geological repository in the US, which simulates extreme material properties of bedded salt rock formation and extreme contrast due to open excavation next to the formation. The models have extremes not only of permeability and porosity but also of the constitutive models needed for multiphase flow; additionally, they have process models like salt creep closure reducing porosity over time, fracturing in clay and anhydrite interbeds of the bedded salt, gas generation from the waste materials, and unintentional human borehole intrusions in some scenarios. Numerical simulations require the solution of coupled systems of nonlinear PDEs; in our work, we use the open-source simulator PFLOTRAN which is based on Finite Volume discretization. The solution of the nonlinear equations requires use of the Newton-Raphson iteration at each time step, which entails the solution of the linearized Jacobian system at each iteration. The effects of all the processes (i.e., large number of unknowns, highly nonlinear constitutive relations, large contrasts in material properties in short distances) lead to an ill-conditioned Jacobian matrix that severely challenges traditional linear solver, i.e., stabilized biconjugate gradient with block Jacobi incomplete LU preconditioner (BCGS-ILU) leading to non-convergence for traditional Newton-Raphson nonlinear solver causing unacceptably long computation time for each model. This paper presents linear solvers such as constrained pressure residual (CPR) two-stage preconditioner with alternate-block-factorization (ABF) and quasi- implicit pressure and explicit saturation (QIMPES) decouplers and flexible generalized residual solver (FGMRES). The new general-purpose nonlinear solver, Newton trust-region dogleg Cauchy (NTRDC), is also introduced to resolve extreme nonlinearities in the models. We demonstrate the effectiveness of each method relative to the default BCGS-Newton solver. The two best cases had nearly 50 times speed-up and achieved completion of a simulation in 14 hours that never completed due to non-convergence with the default solver. We also investigate the strong scalability of each method and discuss some of the deficiencies found for Block Jacobi preconditioner using parallel domain decomposition, and node packing effects of modern processor architecture.

Preconditioner, Nonlinear, Porous media, Multiphas↗
DOE OSTI2020

Evidence of Skewness and Sub-Gaussian Character in Temperature-Dependent Distributions of One Million Electronic Excitation Energies in PbS Quantum Dots

Obtaining statistical distributions by sampling a large number of conformations is vital for an accurate description of temperature-dependent properties of chemical systems. However, constructing distributions with 105??106 samples is computationally challenging because of the prohibitively high computational cost of performing rst-principles quantum-mechanical calculations. In this work, we present a new technique called the Eective Stochastic Potential Conguration Interaction Singles (ESP-CIS) method to obtain excitation energies. The ESP-CIS method uses random matrix theory for the construction of an eective stochastic representation of the Fock operator and combines it with linear-response theory. Here, we perform excitation calculations on PbS quantum dots (0.75-1.75 nm) at temperatures of 200-400 K. Results from a total of 15 million excitation energy calculations (1 million samples for each of the three dots at ve dierent temperatures) revealed the distributions to be sub-Gaussian in nature with negative skewness. The distributions progressively became red-shifted with increasing temperature. The study shows that random distortions in structure from the minimum-energy geometry of these quantum dots are more likely to lower the excitation energies.

Scher, Jeremy A.↗
DOE OSTI2023

5G Energy FRAME: The Design and Implementation of Data, Model, and Use Case (Year 2 Report)

This report summarizes the Year 2 work of Pacific Northwest National Laboratory’s (PNNL’s) 5G Fabricated Resource and Asset Management Encompassment for energy infrastructure (Energy FRAME) project funded by the Department of Energy Office of Science’s Advanced Scientific Computing Research (ASCR) Program. In this report, newest 5G equipment testing results are presented, along with two 5G-enabled AI/ML examples for grid applications; in addition, the work flow of grid edge, cloud, and High Performance Computing (HPC) platform is introduced, to support and interface the cross-domain simulation for power system transmission, distribution, and communication networks. Last but not least, the outlook for Year 3 work and the overarching impact of 5G Energy FRAME work to a multitude of stakeholders are provided. Additional 5G performance data now is shared through the publicly available weblink, https://www.pnnl.gov/projects/5g-energy-frame/publications

24 POWER TRANSMISSION AND DISTRIBUTION↗
NASA NTRS1979

Optimal local control of flexible structures

The steady state solution of the linear quadratic optimal control problem with the constraint that only partial state information is available for feedback is derived. This development results in a systematic and computationally efficient approach for reducing the complexity of the control law for high order systems. Numerical examples and performance evaluation of (1) a simple fourth order system, and (2) a free-free flexible beam, are included.

Schaechter, D. B.↗
NASA NTRS1999

In Search of the Physics: NASA's Approach to Airframe Noise

An extensive numerical and experimental study of airframe noise mechanisms associated with a subsonic high-lift system has been performed at NASA Langley Research Center (LaRC). Investigations involving both steady and unsteady computations and experiments on small-scale models with part-span flaps and full-span flaps are presented. Both surface (steady and unsteady pressure measurements, hot films, oil flows, pressure sensitive paint) and off-surface (5 holeprobe, particle-imaged velocimetry, laser velocimetry, laser light sheet measurements) were taken in the LaRC Quiet Flow Facility (QFF) and several hard-wall tunnels. Experiments in the Low Turbulence Pressure Tunnel (LTPT) included Reynolds number variations up to flight conditions. Successful microphone array measurements were also taken providing both acoustic source maps on the model, and quantitative spectra. Critical directivity measurements were obtained in the QFF. NASA Langley unstructured and structured Reynolds-Averaged Navier-Stokes codes modeled the steady aspects of the flows. Excellent comparisons with surface and off-surface experimental data were obtained. Subsequently, these meanflow calculations were utilized in both linear stability and direct numerical simulations of the flow fields to calculate unsteady surface pressures and farfield acoustic spectra. Accurate calculations were critical in obtaining not only noise source characteristics, but shear layer correction data as well. Techniques utilized in these investigations as well as brief overviews of the results are given.

Macaraeg, Michele G.↗