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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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MSFC Skylab ground-based astronomy program

The Skylab Ground-Based Astronomy Program (SGAP) was conducted to enhance the data base of solar physics obtained during the Apollo Telescope Mount (ATM) mission flown in conjunction with the Skylab orbital station. Leading solar physicists from various observatories obtained data from the ground at the same time that orbital data were being acquired by ATM. The acquisition of corollary solar data from the ground simultaneously with the ATM orbital observations helped to provide a broader basis for understanding solar physics by increasing spectral coverage and by the use of additional sophisticated instruments of various types. This report briefly describes the individual tasks and the associated instrumentation selected for this ground-based program and contains as appendices, the final reports from the Principal Investigators.

Duncan, B. J.↗

International Collaboration Activities on Disposal in Argillite R&D: DECOVALEX19 Task C – Geochemical and Reactive Transport Modeling

International collaborations on nuclear waste disposal R&D are an integral part of the Spent Fuel Waste Science and Technology (SFWST) campaign within the DOE Fuel Cycle and Technology (FCT) program. These partnerships with international repository R&D programs provide key opportunities to participate in experiments developing laboratory/field data (underground research laboratories (URL)) of engineered barrier system (EBS) interactions (e.g., near-field) and characterization of transport phenomena in the host rock (e.g., far-field). The results of these experiments are used in the evaluation of coupled processes and their representation via state-of-the-art simulation approaches to evaluate repository performance. During the thermal heating period, increases in temperature from radionuclide decay in the spent fuel (SF) waste canisters will increase temperature in the surrounding EBS driving chemical and transport processes in the near- and far-field domains of the repository. URL heater-tests for extended periods of times (e.g., years) provide key information and data on thermal effects affecting engineered barriers in response to temperature and water saturation levels. Groundwater interactions with cementitious barriers are also important to in-drift chemistry and EBS performance during post-closure. Descriptions of the various URL experiments for various disposal design concepts according to the host country repository program and relevance to the US program is given elsewhere (Birkholzer et al.,2017;Jové Col& et al., 2016). The DECOVALEX-2019 Task C involves collaboration with the GREET (Groundwater REcovery Experiment in Tunnel) at the Mizunami URL, Japan ,which targets the development of monitoring methodologies of groundwater in granitic rock with applications to THMC simulations (Iwatsuki et al., 2005;Iwatsuki et al.,2015,2017). Some of the goals of GREET is to conduct a facility-scale geochemical characterization study of short- and long-term effects of tunnel excavation activities, impacts on groundwater flow and transport, and influences on groundwater chemistry (Iwatsuki et al.,2015). The data obtained from these URL activities is then used in the development and evaluation of THC models to support post-closure safety and performance assessments of the repository environment.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

FY17 Status Report on the Computing Systems for the Yucca Mountain Project TSPA-LA Models.

Sandia National Laboratories (SNL) continued evaluation of total system performance assessment (TSPA) computing systems for the previously considered Yucca Mountain Project (YMP). This was done to maintain the operational readiness of the computing infrastructure (computer hardware and software) and knowledge capability for total system performance assessment (TSPA) type analysis, as directed by the National Nuclear Security Administration (NNSA), DOE 2010. This work is a continuation of the ongoing readiness evaluation reported in Lee and Hadgu (2014), Hadgu et al. (2015) and Hadgu and Appel (2016). The TSPA computing hardware (CL2014) and storage system described in Hadgu et al. (2015) were used for the current analysis. One floating license of GoldSim with Versions 9.60.300, 10.5, 11.1 and 12.0 was installed on the cluster head node, and its distributed processing capability was mapped on the cluster processors. Other supporting software were tested and installed to support the TSPA- type analysis on the server cluster. The current tasks included preliminary upgrade of the TSPA-LA from Version 9.60.300 to the latest version 12.0 and address DLL-related issues observed in the FY16 work. The model upgrade task successfully converted the Nominal Modeling case to GoldSim Versions 11.1/12. Conversions of the rest of the TSPA models were also attempted but program and operational difficulties precluded this. Upgrade of the remaining of the modeling cases and distributed processing tasks is expected to continue. The 2014 server cluster and supporting software systems are fully operational to support TSPA-LA type analysis.

97 MATHEMATICS AND COMPUTING↗

Recent NASA handling qualities research

A comprehensive review of NASA research results documented since the mid-1960's and some recently completed programs on aircraft handling qualities are presented. In addition to handling qualities research pertaining to vehicle stability and control characteristics, investigations related to specialized piloting tasks, cockpit displays, and environmental factors are summarized. The background leading to NASA's handling qualities research activities is discussed, and programs that have received major emphasis are indicated. For general aviation aircraft, the survey includes investigations aimed at improving handling qualities by incorporating increasingly sophisticated stability augmentation and display systems, simplifying the approach and landing task for relatively inexperienced pilots, and establishing the basic effects of turbulence. Research on the specialized piloting problem of steeper instrument approaches for noise abatement and investigations with a representative first generation aircraft are reviewed in the section on subsonic jet transports. Supersonic cruise aircraft programs include a variety of simulation studies related to supersonic transport designs and flight tests with the XB-70 aircraft. Investigations of high angle of attack loss of control problems and a flight study of direct lift control utilization for formation flying and aerial refueling are discussed in the review of tactical military aircraft research.

Wasicko, R. J.↗

TADS: A CFD-based turbomachinery and analysis design system with GUI. Volume 2: User's manual

The primary objective of this study was the development of a computational fluid dynamics (CFD) based turbomachinery airfoil analysis and design system, controlled by a graphical user interface (GUI). The computer codes resulting from this effort are referred to as the Turbomachinery Analysis and Design System (TADS). This document is intended to serve as a user's manual for the computer programs which comprise the TADS system. TADS couples a throughflow solver (ADPAC) with a quasi-3D blade-to-blade solver (RVCQ3D) in an interactive package. Throughflow analysis capability was developed in ADPAC through the addition of blade force and blockage terms to the governing equations. A GUI was developed to simplify user input and automate the many tasks required to perform turbomachinery analysis and design. The coupling of various programs was done in a way that alternative solvers or grid generators could be easily incorporated into the TADS framework.

Myers, R. A.↗

Classifying Cancer Pathology Reports with Hierarchical Self-Attention Networks

We introduce a deep learning architecture, hierarchical self-attention networks (HiSANs), designed for classifying pathology reports and show how its unique architecture leads to a new state-of-the-art in accuracy, faster training, and clear interpretability. We evaluate performance on a corpus of 374,899 pathology reports obtained from the National Cancer Institute's (NCI) Surveillance, Epidemiology, and End Results (SEER) program. Each pathology report is associated with five clinical classification tasks – site, laterality, behavior, histology, and grade. We compare the performance of the HiSAN against other machine learning and deep learning approaches commonly used on medical text data – Naive Bayes, logistic regression, convolutional neural networks, and hierarchical attention networks (the previous state-of-the-art). We show that HiSANs are superior to other machine learning and deep learning text classifiers in both accuracy and macro F-score across all five classification tasks. Compared to the previous state-of-the-art, hierarchical attention networks, HiSANs not only are an order of magnitude faster to train, but also achieve about 1% better relative accuracy and 5% better relative macro F-score.

60 APPLIED LIFE SCIENCES↗

Multinode Multi-GPU Two-Electron Integrals: Code Generation Using the Regent Language

The computation of two-electron repulsion integrals (ERIs) is often the most expensive step of integral-direct self-consistent field methods. Formally it scales as O(N 4 ), where N is the number of Gaussian basis functions used to represent the molecular wave function. In practice, this scaling can be reduced to O(N 2 ) or less by neglecting small integrals with screening methods. The contributions of the ERIs to the Fock matrix are of Coulomb (J) and exchange (K) type and require separate algorithms to compute matrix elements efficiently. We previously implemented highly efficient GPU-accelerated J-matrix and K-matrix algorithms in the electronic structure code TeraChem. Although these implementations supported the use of multiple GPUs on a node, they did not support the use of multiple nodes. This presents a key bottleneck to cutting-edge ab initio simulations of large systems, e.g., excited state dynamics of photoactive proteins. We present our implementation of multinode multi-GPU J- and K-matrix algorithms in TeraChem using the Regent programming language. Regent directly supports distributed computation in a task-based model and can generate code for a variety of architectures, including NVIDIA GPUs. We demonstrate multinode scaling up to 45 GPUs (3 nodes) and benchmark against hand-coded TeraChem integral code. Finally, we also outline our metaprogrammed Regent implementation, which enables flexible code generation for integrals of different angular momenta.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

DARMA-EMPIRE Integration and Performance Assessment – Interim Report

We begin by presenting an overview of the general philosophy that is guiding the novel DARMA developments, followed by a brief reminder about the background of this project. We finally present the FY19 design requirements. As the Exascale era arises, DARMA is uniquely positioned at the forefront of asychronous many-task (AMT) research and development (R&D) to explore emerging programming model paradigms for next-generation HPC applications at Sandia, across NNSA labs, and beyond. The DARMA project explores how to fundamentally shift the expression(PM) and execution(EM)of massively concurrent HPC scientific algorithms to be more asynchronous, resilient to executional aberrations in heterogeneous/unpredictable environments, and data-dependency conscious—thereby enabling an intelligent, dynamic, and self-aware runtime to guide execution.

97 MATHEMATICS AND COMPUTING↗

Report for 2.2.1 Task 5: Develop and Document a State-Based Alarm System for a Nuclear Power Plant Control Room Using Machine Learning. Light Water Reactor Sustainability Program report

In legacy control rooms the operators might have 20 to 30 alarms to deal with on 12 control boards, during a reactor trip. The new digital alarm system in the upgraded control room will display between 150 and 200 alarm points on a single screen. This overload of information prevents the operators from identifying any abnormal alarms quickly without having to scroll through the alarm list looking for the abnormal alarms. One way to tackle this problem could be to attempt to create a state-based alarm system which would identify plant states and would identify which alarms are expected in those states and suppress them from the alarm screen so that any unexpected alarms would be displayed and easily identified to the operators. This can be done today but is very labor intensive in that an operator or training instructor would be required to run scenarios and log the alarms to be suppressed. The hope is that Machine Learning (ML) can provide an alternative solution with less manual effort required.

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗

ATDM Data Management FY2015: Data Warehouse Progress Report

The Advanced Technology Development and Mitigation (ATDM) program at Sandia National Laboratories is a new effort to build next-generation simulation codes that will map well to upcoming exascale computing platforms. Rather than follow traditional single- program, multiple data (SPMD) programming techniques, ATDM is developing applications in an asynchronous many task (AMT) form that describes work as a graph of tasks that have data dependencies. The data management team is focused on developing a data warehouse for ATDM that will enable tasks to store and exchange data objects efficiently. This report summarizes the data management teams efforts during FY15, and documents: (1) an initial API and implementation for the data warehouses key/value store, (2) API requirements for use with ATDMs runtime, (3) initial requirements for storing ATDM-specific data, and (4) the current organization of software components that will be used by the data warehouse.

97 MATHEMATICS AND COMPUTING↗

Purification and Concentration of 99 Mo from a UREX raffinate

The medical isotope 99m Tc ( t ½ = 6.0 h) accounts for over 80% of isotopes used in diagnostic nuclear medicine today and is normally derived from its transient equilibrium parent 99 Mo ( t ½ = 66 h). To reduce U.S. dependence on 99 Mo derived from HEU by foreign suppliers, the NNSA/M3 program—under the American Medical Isotope Production Act—has been tasked with facilitating the work of domestic 99 Mo suppliers that do not utilize HEU. Superconducting electron linear accelerators with high-Z converter targets can generate bremsstrahlung photons and neutron fluxes that can induce photonuclear reactions and LEU fission. After sufficient production intervals, targets can be rotated out and processed while another batch is irradiated. The process flow chemistry is shown in Figure 1. The irradiated U 3 O 8 targets are retrieved and dissolved in HNO 3 ; the volatile fission products are expelled and captured during this step. The HNO 3 liquor bearing the uranyl, fission and activation products is injected into the UREX suite of liquid-liquid extraction banks. The uranyl is partitioned in typical fashion using tri-$\textit{n}$-butyl phosphate (TBP) in a hydrocarbon diluent. The raffinate—comprising mainly 99 Mo and fission products—is then injected into the MoLLE (Molybdenum Liquid-Liquid Extraction) flowsheet, where the Mo is selectively extracted by an organophosphorous acid extractant such as di-(2-ethylhexyl phosphoric acid) (HDEHP). Trace amounts of Nb, Zr, Np, I, and Te are co-extracted. The Mo is stripped using acetohydroxamic acid (AHA) and fed onto an anion exchange column. Following a series of hydroxide, HCl, and oxalic acid wash steps, the Mo can be recovered in NaOH/NaCl. A manuscript describing this process chemistry in more detail was recently published.

07 ISOTOPE AND RADIATION SOURCES↗

The Ohio State University Geometric and Orbital (adjustment) Program (OSUGOP) for satellite observations

A computer program, OSUGOP, developed for adjusting ground station coordinates from observations made to satellites by stations observing from the ground is outlined. The observations can be optical or ranges, and the adjustments can be performed in either the geometric or orbital mode. The program was developed in such a way that certain specific tasks can be performed without resorting to a complete solution.

Reilly, J. R.↗

Substructure coupling: A different approach

The substructure analysis of the Lockheed L-1011 Dash 500 long range derivative without use of the NASTRAN level 16 multistage substructuring capability is described. It is presented as an example of how a large structural analysis can be organized into manageable independent tasks and how preprocessors, model definition conventions, and data management programs can be used to simplify the data management and model documentation. A procedure is described to analyze a single substructure by modifying the static solution to solve the interface compatibility equations simultaneously with the substructure solution.

Lahey, R. S.↗

Military needs for orbital power

Results of the DoD/ERDA (now Department of Energy) Space Power Study completed in October 1977 are presented. The major new thrust of Air Force Advanced Technology Plans center on the development of military solar power systems which will extend capabilities to the 10 - 50 KW sub e power range for new classes of missions while maintaining technology applicability to the 0.5 - 10 KW sub e present mission class. The status of FY78 efforts for Project 682J (Air Force Space Power Advanced Development Program) are reported. Project 682J is divided into the following tasks: (1) high efficiency solar panel; (2) nickel-hydrogen battery; (3) gallium arsenide solar concentrator hardness study; and (4) new-start nuclear dynamic power system applications/integration study.

Massie, L. D.↗

Effects of expiration of the Federal energy tax credit on the National Photovoltaics Program

Projected 1986 sales are significantly reduced as a direct result of system price increases following from expiration of the Federal energy tax credits. There would be greatly reduced emphasis on domestic electric utility applications. Indirect effects arising from unrealized economies of scale and reduced private investment in PV research and development (R&D) and in production facilities could have a very large cumulative adverse impact on the U.S. PV industry. The industry forecasts as much as fourfold reduction in 1990 sales if tax credits expire, compared with what sales would be with the credits. Because the National Photovoltaics Program is explicitly structured as a government partnership, large changes in the motivation or funding of either partner can affect Program success profoundly. Reduced industry participation implies that such industry tasks as industrialization and new product development would slow or halt. Those research areas receiving heavy R&D support from private PV manufacturers would be adversely affected.

Smith, J. L.↗

Methods for design and evaluation of integrated hardware-software systems for concurrent computation

Research activities and publications are briefly summarized. The major tasks reviewed are: (1) VAX implementation of the PISCES parallel programming environment; (2) Apollo workstation network implementation of the PISCES environment; (3) FLEX implementation of the PISCES environment; (4) sparse matrix iterative solver in PSICES Fortran; (5) image processing application of PISCES; and (6) a formal model of concurrent computation being developed.

Pratt, T. W.↗

Development of selected advanced aerodynamics and active control concepts for commercial transport aircraft

Work done under the Energy Efficient Transport project in the field of advanced aerodynamics and active controls is summarized. The project task selections focused on the following: the investigation of long-duct nacelle shape variation on interference drag; the investigation of the adequacy of a simple control law for the elastic modes of a wing; the development of the aerodynamic technology at cruise and low speed of high-aspect-ratio supercritical wings of high performance; and the development of winglets for a second-generation jet transport. All the tasks involved analysis and substantial wind tunnel testing. The winglet program also included flight evaluation. It is considered that the technology base has been built for the application of high-aspect-ratio supercritical wings and for the use of winglets on second-generation transports.

Taylor, A. B.↗

Cockpit data management

This study is a continuation of an FAA effort to alleviate the growing problems of assimilating and managing the flow of data and flight related information in the air transport flight deck. The nature and extent of known pilot interface problems arising from new NAS data management programs were determined by a comparative timeline analysis of crew tasking requirements. A baseline of crew tasking requirements was established for conventional and advanced flight decks operating in the current NAS environment and then compared to the requirements for operation in a future NAS environment emphasizing Mode-S data link and TCAS. Results showed that a CDU-based pilot interface for Mode-S data link substantially increased crew visual activity as compared to the baseline. It was concluded that alternative means of crew interface should be available during high visual workload phases of flight. Results for TCAS implementation showed substantial visual and motor tasking increases, and that there was little available time between crew tasks during a TCAS encounter. It was concluded that additional research should be undertaken to address issues of ATC coordination and the relative benefit of high workload TCAS features.

Groce, J. L.↗