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At least 811 records · Page 45

MPI Sessions: Second Demonstration and Evaluation of MPI Sessions Prototype

MPI Sessions presents a new paradigm for applications to use MPI functionality within an application. This paradigm offers the promise of more flexible ways for applications to express the capabilities they require from MPI at a fine grain level. This report presents a second evaluation of a prototype implementation of the MPI Sessions proposal, including additional development work on the prototype and investigations using Sessions in the DASK data analytics framework.

97 MATHEMATICS AND COMPUTING↗

An Investigational Platform of the Human Brain for Understanding Complex Neural Function

In this project we focused on developing an experimental model of the human central nervous system that more accurately mirrors the function and physiology of the human brain. This in vitro brain-on-a-chip can provide critical insight into human brain function in response to chemical exposure and disease. To develop a more accurate experimental model, we evaluated and optimized key elements designed to more accurately recapitulate neuron function. We demonstrated that neuronal function was more robust when neurons were cultured with other neuronal cells as well as complex extracellular matrix molecules. We also designed a novel threedimensional multi-electrode array (3DMEA) that provides an unprecedented ability to noninvasively monitor and record neuronal function in 3D in a reproducible manner. We also optimized an experimental model of the blood-brain barrier, providing an important tool for understanding how this interface regulates the exchange of molecules from the blood to the brain. Underpinning all of these experimental efforts were novel data analytics and modeling approaches. The successful completion of this project has positioned LLNL to use our novel tools and expertise to understand human brain function in the context of the Lab’s national security mission.

59 BASIC BIOLOGICAL SCIENCES↗

Underground Test Area Annual Sampling Report Nevada National Security Site, Nevada (Revision 1, Calendar Year 2018)

The Sampling Plans (Rev. 0 and Rev. 1) ensure routine sampling that is critical to understanding contaminant transport near and downgradient of the underground nuclear testing areas, and is designed to ensure compliance with the UGTA Activity Quality Assurance Plan and the Federal Facility Agreement and Consent Order. This report presents the analytical data for the 2018 calendar year (CY) (January 1 through December 31, 2018) to ensure that the Sampling Plans’ objectives are achieved. Appendix D presents data from samples collected in 2016 and 2017. These results were not reported in previous reports because they were not available from the specialized laboratories at the time of the publication of the reports.

54 ENVIRONMENTAL SCIENCES↗

Low-Income Energy Affordability: Conclusions From A Literature Review

This paper examines the persistent problem of high energy burdens among low-income households, based on a review of more than 180 publications that pointed to several promising opportunities to address energy affordability including inclusive solar programs, leveraged health care benefits, and behavioral economics. using an equity and affordability lens. Even after decades of weatherization and bill-payment programs, low-income households, on average, continue to spend a higher share of their income on electricity and natural gas bills than any other income group. Energy burden for low-income households is not declining, and it remains persistently high, particularly in the South, in rural America, among minority households, and those with children and elderly residents. On a per household basis, utility companies spend less on energy-efficiency programs for low-income households than for other income groups. In addition, government and utility programs that promote rooftop solar power, electric vehicles, and home energy storage are largely inaccessible to low-income households. Our review identifies promising opportunities to address energy affordability including inclusive solar programs, leveraged health care benefits, behavioral economics, data analytics, advanced information and communication technologies, and grid resiliency. Scalable approaches require linking implementing agencies, programs and policies to tackle the complex web of causes and impacts on low-income households with high energy burdens.

29 ENERGY PLANNING, POLICY, AND ECONOMY↗

Collection of High Pedigree AM Data for Data Analysis and Correlation. CRADA Final Report

ORNL worked with Senvol to develop and evaluate a standard operating procedure for collection of pedigree data for Additive Manufacturing using the Concept Laser XLine 1000r using an Al-Si-Mg alloy. ORNL independently evaluated and provided feedback to Senvol regarding the standard operating procedure document. Those edits were incorporated in the document that was then used to fabricate builds on the Concept Laser XLine 1000r to evaluate the efficacy of the document in collecting pedigreed data. The builds were done with varying build parameters, and the samples were subjected to tensile testing. The tensile data was used as an input for an artificial intelligence-based data analytics framework to determine the correlation between the build parameters and resulting tensile strength.

36 MATERIALS SCIENCE↗

Sequim Campus Master Plan

Based in Richland, Washington, Pacific Northwest National Laboratory (PNNL) is one of ten U.S. Department of Energy (DOE) Office of Science (SC) national laboratories. PNNL is DOE’s premier chemistry, earth sciences, and data analytics laboratory, delivering vital mission impacts in energy resiliency and national security. PNNL has 19 core capabilities, each a powerful combination of world-class staff, state-of-the- art equipment, and mission-ready facilities. These capabilities represent a collective set of skills and a body of world-leading scientific and engineering work that provides exceptional value and mission delivery to DOE, the National Nuclear Security Administration (NNSA), the U.S. Department of Homeland Security (DHS), and other federal agencies and industry through strategic partnership projects on a not-to-interfere basis. Currently operated by Battelle Memorial Institute, PNNL occupies more than 2.3 million gross square feet (GSF) of buildings and employs approximately 4,700 staff members. PNNL has implemented a rolling 10-year campus strategy, initiated in fiscal year 2013, designed to deliver the foundation for the multidisciplinary science and engineering expertise, equipment, instrumentation, facilities, and infrastructure required to continue providing exceptional value and mission delivery. This strategy is incorporated into PNNL’s annual Laboratory Plan, which serves as DOE-SC’s equivalent of the Five- Year Site Plan required by DOE Order 430.1C Chg. 1, Real Property Asset Management. The PNNL Sequim Campus is located in Clallam County, just outside of Sequim, Washington. PNNL Sequim builds upon a rich history of research related to marine and coastal resources, environmental chemistry, water resources modeling, ecotoxicology, biotechnology, and national security. Facilities at the PNNL Sequim Campus were designed to take advantage of two unique locational assets: the pristine coastal ocean water in Sequim Bay and the region’s exceptionally clean air. Research facilities on the waterfront are supplied with up to 200 gallons per minute (gpm) of seawater and/or groundwater that enables research on aquatic systems ranging from fully seawater to fresh water, with an onsite water treatment system that removes all biological and hazardous chemical residues prior to discharge. Multiple large seawater tanks outside the waterfront laboratories, along with a boat ramp, pier, and floating dock, enable lab-to-field research. The uplands facility takes advantage of the amazing air quality and is built and operated to enable ultratrace chemical/radiological analytical chemistry. This combination of capabilities is not available at any other marine laboratory in the nation.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Quantitative Determination of Total Cesium in Savannah River Site (SRS) Tank Waste by Inductively Coupled Plasma Emission Spectroscropy

Utilization of the significant and unique wavelength dynamic range (165 to 1100 nm) available on the Leeman Prodigy Inductively Coupled Plasma Emission Spectroscopy (ICP-ES) allows for quantification of cesium using the emission line 894.347 nm without the potential of Barium interference in nuclear waste samples. Samples are added to a Sodium Peroxide Fusion and Lithium Carbonate buffer in 2% nitric acid solution to increase sensitivity of the easily ionizable (<6 eV) cesium for quantitation to 5 pbb. Through direct comparison of analytical data results, the method is proven to be complementary to the Inductively Coupled Plasma Mass Spectrometry (ICP-MS) analysis (LOQ 100 ppt) in support of the Department of Energy’s (DOE) Nuclear Waste Mission.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

Technology-Enabled Risk-Informed Maintenance Strategy to Minimize Operation and Maintenance Costs

The domestic fleet of nuclear power plants (NPPs) is facing a unique economic sustainability challenge in today’s energy market due to high total operating costs. One of the major contributors to the total operating cost of an NPP is the operations and maintenance (O&M) budget, which includes labor-intense preventive maintenance (PM) programs. PM programs involve manually performing inspection, calibration, testing, and maintenance of plant assets at periodic frequencies, as well as time-based replacement of assets, irrespective of individual asset condition. This approach, combined with the push to achieve high capacity factors, has resulted in a labor-centric business model. It is time to transition from this labor-centric business model to a technology-centric business model that will enable an optimal maintenance strategy by eliminating unnecessary costs associated with time-based PM activities. To enable this transition, the commercial nuclear industries are utilizing and developing reliable methodologies, based on available state of the art technologies, which facilitate assessing equipment condition and the dynamic risk of failure. The U.S. Department of Energy’s Idaho National Laboratory (INL) under the Light Water Reactor Sustainability (LWRS) Program is partnering with PKMJ Technical Services and Public Service Enterprise Group (PSEG) Nuclear, LLC to develop and demonstrate a deployable risk-informed predictive maintenance strategy to eliminate unnecessary O&M costs for an identified plant system, laying the foundation for scale-up to the entire plant. Recently developed technologies such as advanced wireless and wired sensors, data analytics, and risk assessment methodologies will support this transition. The technology-centric O&M model will result in significant automation and lay the foundation for real-time condition assessment of plant assets, thus enabling condition-based maintenance and enhancing plant safety, reliability, and economics of operation.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

Predicting Future Disease Burden in a Rapidly Changing Climate

The interplay of a rapidly changing climate and infectious disease occurrence is emerging as a critical topic, requiring investigation of possible direct, as well as indirect, connections between disease processes and climate-related variation and phenomena. First, we introduce and overview three infectious disease exemplars (dengue, influenza, valley fever) representing different transmission classes (insect-vectored, human-to-human, environmentally-transmitted) to illuminate the complex and significant interplay between climate disease processes, as well as to motivate discussion of how Sandia can transform the field, and change our understanding of climate-driven infectious disease spread. We also review state-of-the-art epidemiological and climate modeling approaches, together with data analytics and machine learning methods, potentially relevant to climate and infectious disease studies. We synthesize the modeling and disease exemplars information, suggesting initial avenues for research and development (R&D) in this area, and propose potential sponsors for this work. Whether directly or indirectly, it is certain that a rapidly changing climate will alter global disease burden. The trajectory of climate change is an important control on this burden, from local, to regional and global scales. The efforts proposed herein respond to the National Research Councils call for the creation of a multidisciplinary institute that would address critical aspects of these interlocking, cascading crises.

54 ENVIRONMENTAL SCIENCES↗

Cooperative Research and Development Agreement With Georgetown University Report: National Institutes of Health, National Center for Advancing Translational Sciences Clinical and Translational Science Award

Oak Ridge National Laboratory (ORNL) is participating with Georgetown University (GU) as a subrecipient in response to the National Institutes of Health (NIH), National Center for Advancing Translational Sciences (NCATS) Clinical and Translational Science Award (CTSA) (U54 Clinical Trial Optional) funding opportunity announcement. This Cooperative Research and Development Agreement is put in to place to facilitate the development and implementation of clinical interventions that demonstrably improve human health is currently a complex, recursive, and inefficient process that leads to delays of years or decades before discoveries in biomedical research result in health benefits for patients and communities. NCATS conducts and supports research in the science of translation, to discover the mechanistic and operational principles of the intervention development and dissemination process, thereby providing the scientific foundation for improvements in translational efficiency that will accelerate the realization of interventions that improve human health. Under NCATS’ leadership, the CTSA Program supports a national network of medical research institutions called hubs. GU is the lead institution in one of the NIH hubs that was created as a result of a previous NIH CTSA. The missions of the GU have historically included the advancement of health through research in the clinical and biomedical sciences, the education of future leaders in medical and nursing practice and academia, and the provision of compassionate and scientifically competent patient care and service to the Washington, DC community and the nation. GU is the lead institution for the Georgetown-Howard Universities Center for Clinical and Translational Science (GHUCCTS), a multi-institutional partnership of medical research institutions forged from a desire to promote clinical research and translational science. Through multiple collaborations among these institutions, GHUCCTS is transforming clinical research and translational science in order to bring new scientific advances to health care. Oak Ridge National Laboratory is the Department of Energy's (DOE) largest science and energy laboratory. Managed since April 2000 by a partnership of the University of Tennessee and Battelle, ORNL was established in 1943 as a part of the secret Manhattan Project to pioneer a method for producing and separating plutonium. During the 1950s and 1960s, ORNL became an international center for the study of nuclear energy and related research in the physical and life sciences. With the creation of DOE in the 1970s, ORNL's mission broadened to include a variety of energy technologies and strategies. Today the laboratory supports the nation with a peacetime science and technology mission that is just as important as, but very different from, its role during the Manhattan Project. ORNL is home to the world's premier center for high performance supercomputing to enable scientific discovery. ORNL has extensive expertise in various areas of computer science that are uniquely situated to support GU. Additionally, ORNL’s leading computational user facilities present a unique opportunity to leverage the largest scale machines for open science in support of the stated mission of the NCATS CTSA. ORNL's partnership with GU will offer unparalleled opportunity in data analytics, deep-learning, artificial intelligence, and urban dynamics.

59 BASIC BIOLOGICAL SCIENCES↗

Uncertainty Quantification for Machine Learning

In this paper, we assert the importance of uncertainty quantification for machine learning and sketch an initial research agenda. We define uncertainty in the context of machine learning, identify its sources, and motivate the importance and impact of its quantification. We then illustrate these issues with an image analysis example. The paper concludes by identifying several specific research issues and by discussing the potential long-term implications of uncertainty quantification for data analytics in general.

97 MATHEMATICS AND COMPUTING↗

Energy Storage Financing: Performance Impacts on Project Financing

Understanding performance is the key to risk management in energy storage project financing. Technical performance underlies both capital and operating costs, directly impacting the system's economic performance Since project development is an exercise in risk management, financing costs are the clearest view into how lenders' perceive a project's riskiness. Addressing this perception is the challenge facing the energy storage industry today. Growth in the early solar market was hindered until OEMs and project developers used verifiable performance to allay lenders' apprehension about the long-term viability of those projects. The energy storage industry is similarly laying the groundwork for sustained growth through better technical Standards and best practices. However, the storage industry remains far more complex than other markets, leading lenders to need better data, analytical tools, and performance metrics to invest not only to maximize returns, but also safely--through incorporating more precise performance metrics into the project's documents.

25 ENERGY STORAGE↗

PNNL 2017 Richland Campus Master Plan

Based in Richland, Washington, Pacific Northwest National Laboratory (PNNL) is one of 10 United States (U.S.) Department of Energy (DOE) Office of Science (SC) national laboratories. PNNL is DOE’s premier chemistry, earth sciences and data analytics Laboratory, delivering vital mission impacts in energy resiliency and national security. PNNL has 19 core capabilities, each a powerful combination of world-class staff, state-of-the-art equipment, and mission ready facilities. These capabilities represent a collective set of skills and a body of world-leading scientific and engineering work that provides exceptional value and mission delivery to DOE, the National Nuclear Security Administration (NNSA), the U.S. Department of Homeland Security (DHS), and the missions of other federal agencies and industry through strategic partnership projects. Operated by Battelle Memorial Institute (Battelle), PNNL has more than: 2.3 million gross square feet and 4,400 staff members. PNNL is implementing a rolling 10-year campus strategy (initiated in FY 2013) designed to deliver the foundation for the multidisciplinary science and engineering expertise, equipment, instrumentation, facilities, and infrastructure required to continue providing exceptional value and mission delivery. PNNL’s annual ten-year plan is published with SC’s Ten-Year Plans for the Science National Laboratories. The most recent publication is available at: https://science.energy.gov/lp/laboratory-planning-process/. This edition of the PNNL Richland Campus Master Plan (CMP) is an update to the 2012 CMP.

99 GENERAL AND MISCELLANEOUS↗

AI to Automate ModEx for Optimal Predictive Improvement and Scientific Discovery

Focal Areas: Data acquisition and assimilation enabled by machine learning, AI, advanced experimental optimization, unsupervised learning, and hardware-related AI efforts; Predictive modeling through AI techniques and AI-derived model components; Using AI to design a hierarchical model prediction system consisting and model selection; and, Interrogating complex data (observed and simulated) using AI, big data analytics, and other advanced methods such as explainable AI and physics- or knowledge-guided AI.

54 ENVIRONMENTAL SCIENCES↗

AI-Constrained Bottom-Up Ecohydrology and Improved Prediction of Seasonal, Interannual, and Decadal Flood and Drought Risks

Focal Areas: (2) Predictive modeling through the use of AI techniques and AI-derived model components; the use of AI and other tools to design a prediction system composed of a hierarchy of models (3)Insight gleaned from complex data (both observed & simulated) using AI, big data analytics, and other advanced methods, including explainable AI and physics- or knowledge-guided AI

54 ENVIRONMENTAL SCIENCES↗