SHERPA DHS HS-STEM Summer Internship Summary Paper
This report describes the Standard Unified Modeling and Mapping Integration Toolkit (SUMMIT) and how it can be used to prepare and plan for homeland emergencies.
97 MATHEMATICS AND COMPUTING↗
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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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Tall Tower Wind Energy Monitoring and Numerical Model Validation in Northern Nevada
The main objectives of this project were to conduct a tall-tower and sodar field campaign in complex terrain, investigate wind properties relevant to wind energy assessment, and evaluate high-resolution models with fixed and adaptive grid structures. Two 60-m towers at Virginia Peak ridges near Washoe Valley, Nevada, were instrumented with cup and vane anemometers as well as sonic anemometers, and an acoustic sounder (hereafter sodar) was installed near one of the towers. The towers were located 2,700 m apart with a vertical distance of 140 m elevation between their bases. Each tower had a downhill exposure of rolling complex terrain, with the nearby valley floor 3,200 m to the west and 800 m below the summit. Cup anemometers were installed at both towers at 20, 40, and 60 m, wind vanes at 20 and 60 m, and sonic anemometers at 20 and 60 m. The sodar measurements were nominally provided every 10 m in vertical distance from 40 to 200 m with the quality of the data generally decreasing with height. Surface air temperature, atmospheric pressure, and radiation measurements were conducted at 1.5 m AGL at both of the towers. Although the plan was to conduct a 1-year period of data collection, we extended the period (October 5, 2012 through February 24, 2014) to cover for possible data loss from instrument or communication problems. We also present a preliminary analysis of the towers and sodar data, including a detailed inventory of available and missing data as well as outliers. The analysis additionally includes calculation of the Weibull parameters, turbulence intensity, and initial computation of wind power density at various heights.
17 WIND ENERGY↗
Keeping the Momentum and Nuclear Forensics at Los Alamos National Laboratory
LANL has 70 years of experience in nuclear forensics and supports the community through a wide variety of efforts and leveraged capabilities: Expanding the understanding of nuclear forensics, providing training on nuclear forensics methods, and developing bilateral relationships to expand our understanding of nuclear forensic science. LANL remains highly supportive of several key organizations tasked with carrying forth the Nuclear Security Summit messages: IAEA, GICNT, and INTERPOL. Analytical chemistry measurements on plutonium and uranium matrices are critical to numerous programs including safeguards accountancy verification measurements. Los Alamos National Laboratory operates capable actinide analytical chemistry and material science laboratories suitable for nuclear material and environmental forensic characterization. Los Alamos National Laboratory uses numerous means to validate and independently verify that measurement data quality objectives are met. Numerous LANL nuclear facilities support the nuclear material handling, preparation, and analysis capabilities necessary to evaluate samples containing nearly any mass of an actinide (attogram to kilogram levels).
37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
Impact of Burst Buffer Architectures on Application Portability
The Oak Ridge and Argonne Leadership Computing Facilities are both receiving new systems under the Collaboration of Oak Ridge, Argonne, and Livermore (CORAL) program. Because they are both part of the INCITE program, applications need to be portable between these two facilities. However, the Summit and Aurora systems will be vastly different architectures, including their I/O subsystems. While both systems will have POSIX-compliant parallel file systems, their Burst Buffer technologies will be different. This difference may pose challenges to application portability between facilities. Application developers need to pay attention to specific burst buffer implementations to maximize code portability.
97 MATHEMATICS AND COMPUTING↗
Assistance to State Legislatures on Energy Issues
The project educated and trained state legislators and legislative staff from across the nation on energy technology and policy issues, improving their level of understanding and enabling them to make informed policy decisions on critical issues in their states. Since most policymakers are elected with little or no background on energy issues, NCSL has played a critical ongoing role in supporting them as create policy to deal with the rapidly evolving energy system. The policymakers that attended meetings and trainings indicated improved comprehension and understanding of energy issues in the meeting and session evaluations. These educational trainings included the annual 60-hour training Legislative Energy Horizon Institute, the 2-3 yearly meetings of the Energy Supply Task Force, the annual Energy Summit, energy institutes on energy assurance and critical infrastructure, transmission institutes, a natural gas institute and numerous sessions and issue forums at NCSL annual meetings. The effort also included the production of many written products (all available on the NCSL website), in-person technical assistance and the promotion of information-sharing among policymakers to achieve a higher level of energy understanding among state policymakers and staff.
29 ENERGY PLANNING, POLICY, AND ECONOMY↗
Black Carbon at the Mt. Bachelor Observatory Field Campaign Report
This campaign was initiated to measure refractory black carbon (rBC, as defined in Schwarz et al. (2010)) at the Mt. Bachelor Observatory (MBO) using the U.S. Department of Energy (DOE) Atmospheric Radiation Measurement (ARM) Climate Research Facility single-particle soot photometer (SP2; unit 54). MBO is a high-elevation site located on the summit of Mt. Bachelor in central Oregon, USA (43.979°N, 121.687°W, 2,763 meters ASL). This site is operated by Professor Dan Jaffe’s group at the University of Washington Bothell and has been used continuously as an atmospheric observatory for the past 12 years (Jaffe et al., 2005; Gratz et al., 2014). The location of MBO allows frequent sampling of the free troposphere along with a wide array of plumes from regional and distant sources. MBO is currently supported with funding from the National Science Foundation (NSF) to the Principal Investigator (PI; D. Jaffe) via the project “Influence of Free Tropospheric Ozone and PM on Surface Air Quality in the Western U.S.” (#1447832) covering the period 03/15/2015 to 02/28/2018. The SP2 instrument from Droplet Measurement Technologies provides particle-resolved measurements of rBC mass loading, size and mass distributions, and mixing state. The SP2 was installed at MBO on 6/27/2016 and ran through 9/23/2016. Additional measurements at MBO during this campaign included carbon monoxide (CO), fine particulate matter (PM1), aerosol light scattering coefficients (σscat) at three wavelengths using a TSI nephelometer, aerosol absorption coefficients (σabs) with the Brechtel tricolor absorption photometer (TAP), aerosol number size distributions with a scanning mobility particle sizer spectrometer (SMPS), and black carbon (eBC) with an aethalometer. BC data from this campaign have been submitted to the ARM Data Archive. Black carbon (BC) is the predominant light-absorbing aerosol constituent in the atmosphere, and is estimated to exert a positive radiative forcing second only to CO 2 (Ramanathan and Carmichael, 2008). One of the largest sources of BC globally is biomass burning (BB). (Akagi et al., 2011; Andreae and Merlet, 2001; Bond et al., 2013; Bond et al., 2004; Reid et al., 2005b): a source that is likely to increase in the Western U.S. due to climate change (Dennison et al., 2014; Abatzoglon and Williams, 2016; Westerling et al., 2006). Given the likely increased role of BB aerosol in atmospheric forcing, we need to improve our understanding of the physical and optical properties of aged BB aerosol. During the SP2 deployment period at MBO we observed seven BB events, all of which originated from the Gap Fire in Northern California, which burned 33,867 acres in the Klamath National Forest (https://inciweb.nwcg.gov/incident/4997/). Heavy smoke plumes from this fire were transported to MBO from 8/29/2016 to 8/31/2016. We calculated back-trajectories using the National Oceanic and Atmospheric Administration (NOAA) Hybrid Single-Particle Lagrangian Integrated Trajectory (HYSPLIT) model, version 4 (Draxler, 1999; Draxler and Hess, 1997, 1998; Stein et al., 2015) to confirm transport from the fire locations to MBO. We identified the fire locations using moderate resolution imaging spectroradiometer (MODIS) satellite-derived active fire counts (Justice et al., 2002). Transport time for all of the BB events ranged from 8 to 32 hours.
54 ENVIRONMENTAL SCIENCES↗
Spectral SP: A New Approach to Mapping Reservoir Flow and Permeability
Our objectives for the current project were to develop an innovative inversion and analysis procedure for magnetotelluric field data and time variable self-potentials that will enable us to map not only the subsurface resistivity structure of a geothermal prospect but to also delineate the permeability distribution within the field. Hence, the ultimate objective were to provide better targeting information for exploratory and development drilling of a geothermal prospect. Field data were collected and analyzed from the Kilauea Summit, Kilauea East Rift Zone, and the Humuula Saddle between Mauna Loa and Mauna Kea volcanoes. All of these areas were known or suspected to have geothermal activity of varying intensities. Our results provided evidence for significant long-term coordinated changes in spontaneous potential that could be associated with subsurface flows, significant interferences were encountered that arose from surface environmental changes (rainfall, temperature) that rendered it nearly impossible to unequivocally distinguish between deep fluid flow changes and environmental effects. Further, the analysis of the inferred spontaneous potential changes in the context of depth of the signals, and hence, permeability horizons, were unable to be completed in the time available.
15 GEOTHERMAL ENERGY↗
New Seismic Monitoring Station at Mohawk Ridge, Valles Caldera
Two new broadband digital seismic stations were installed in the Valles Caldera in 2011 and 2012. The first is located on the summit of Cerros del Abrigo (station code CDAB) and the second is located on the flanks of San Antonio Mountain (station code SAMT). Seismic monitoring stations in the caldera serve multiple purposes. These stations augment and expand the current coverage of the Los Alamos Seismic Network (LASN), which is operated to support seismic and volcanic hazards studies for LANL and northern New Mexico (Figure 1). They also provide unique continuous seismic data within the caldera that can be used for scientific studies of the caldera’s substructure and detection of very small seismic signals that may indicate changes in the current and evolving state of remnant magma that is known to exist beneath the caldera. Since the installation of CDAB and SAMT, several very small earthquakes have already been detected near San Antonio Mountain just west of SAMT (Figure 2). These are the first events to be seen in that area. Caldera stations also improve the detection and epicenter determination quality for larger local earthquakes on the Pajarito Fault System east of the Preserve and the Nacimiento Uplift to the west. These larger earthquakes are a concern to LANL Seismic Hazards assessments and seismic monitoring of the Los Alamos region, including the VCNP, is a DOE requirement. Currently the next closest seismic stations to the caldera are on Pipeline Road (PPR) just west of Los Alamos, and Peralta Ridge (PER) south of the caldera. There is no station coverage near the resurgent dome, Redondo Peak, in the center of the caldera. Filling this “hole” is the highest priority for the next new LASN station. We propose to install this station in 2018 on Mohawk Ridge just east of Redondito, in the same area already occupied by other scientific installations, such as the MCON flux tower operated by UNM.
58 GEOSCIENCES↗
Non-Traditional Supercomputing
The High-Performance Computing of today is much different than the supercomputing resources a few decades ago. The supercomputers of the past were huge complexes of hundreds of interconnected computers that had large teams of specialists to keep them running. Today, while supercomputers like Summit (the world's most powerful supercomputer as of June 2018, installed at Oak Ridge National Laboratory) are still in high demand for extremely fast computational power (over 200,000 trillion calculations per second, or 200 petaflops), researchers at Sandia now have access to non-traditional computing resources in the way of very powerful graphics processing units (GPUs). These GPU systems have enabled an entirely new avenue of exploration for Sandia, allowing researchers to further tackle problems in energy, advanced materials, artificial intelligence, and nuclear weapons. Many teams at Sandia utilize these GPU clusters to build models through the use of machine learning. These models are faster representations of their code-driven counterparts and can often be leveraged from the exascale computing resources of traditionally larger systems with huge boosts in performance. We highlight two resources for these smaller systems: the team that builds the hardware, and the team that researches and builds the machine learning algorithms.
97 MATHEMATICS AND COMPUTING↗
Theoretical Investigations of Nano and Bio Structures
The PI was supported by the DOE grant entitled “Theoretical Investigations of Nano and Bio Structures,” 3/1/13-2/28/17, $440,000, and a one-year no cost extension, 3/1/17-2/28/18. Its main emphasis was on nonequilibrium electron transport and novel nanoscale materials and devices, such as graphene nanoribbons, nanotube-based sensors, nanocircuits able to detect DNA replication, and DNA nanowires. We have also made major enhancements to our RMG suite of electronic structure codes, leading to much increased scalability, excellent parallelization of across both CPU and GPU nodes, and cleaner, refactored code base. For example, RMG performs excellently on Summit, DOE’s flagship supercomputer and the fastest supercomputer in the world. It scales to over 100,000 CPU cores and 20,000 GPUs, and can use multiple GPUs per node. It performs 80x faster per node than on DOE’s previous flagship supercomputer, Titan. This is the final report for grant DE-FG02-98ER45685.
36 MATERIALS SCIENCE↗
WBS STPR 04 Milestone 4 Report
This report documents the completion of milestone STPRO4-4 Kokkos back-ends research, collaborations, development, optimization, and documentation. The Kokkos team updated its existing backend to support the software stack and hardware of DOE's Sierra, Summit and Astra machines. They also collaborated with ECP PathForward vendors on developing backends for possible exa-scale architectures. Furthermore, the team ramped up its engagement with the ISO/C++ committee to accelerate the adoption of features important for the HPC community into the C++ standard.
97 MATHEMATICS AND COMPUTING↗
WBS STPR 04 Milestone 4 Report
This report documents the completion of milestone STPRO4-4 Kokkos back-ends research, collaborations, development, optimization, and documentation. The Kokkos team updated its existing backend to support the software stack and hardware of DOE's Sierra, Summit and Astra machines. They also collaborated with ECP PathForward vendors on developing backends for possible exa-scale architectures. Furthermore, the team ramped up its engagement with the ISO/C++ committee to accelerate the adoption of features important for the HPC community into the C++ standard.
97 MATHEMATICS AND COMPUTING↗
Understanding Biomass Burning Aerosol via Integrated Analyses of Aerosol Mass Spectrometry Data from DOE Campaigns and ACRF Long Term Measurements
Biomass burning (BB) is one of the largest sources of aerosol particles in the atmosphere and a significant source of trace gases important to atmospheric chemistry. Organic aerosols from biomass burning sources (BBOA) are an important but poorly characterized component of the earth’s climate system. BBOA composition and life cycle processes are associated with enormous complexities and contribute significantly to model uncertainties. Hence it is important to improve the ability to simulate the concentration and properties (chemical, optical, and hygroscopic) of BBOA and the atmospheric aging processes that affect these properties. Here, we propose to analyze ambient data collected from the DOE Biomass Burning Observation Project (BBOP) field campaign and from a long term measurement site of the Atmospheric Radiation Measurement (ARM) program – the Southern Great Plains (SGP), where transported BB plumes and elevated BBOA episodes were frequently observed. This project is aimed at 1) gaining detailed, quantitative understanding of the chemical and physical properties of BBOA and their chemical changes during atmospheric aging via advanced analysis of aerosol measurement data acquired at the summit of Mt. Bachelor (MBO) during the BBOP campaign and through integration with concurrent measurements of trace gases, particle properties, and meteorological conditions performed at MBO and from the G-1 aircraft; 2) gaining better understanding of BBOA properties and its roles in radiative forcing via analysis of routine data from the ARM long-term measurement sites; and 3) integrating the results from 1) and 2) into a global database of aerosol mass spectrometry and collaborate with modelers on evaluating and improving numerical model performance as part of the ASR program.
54 ENVIRONMENTAL SCIENCES↗
CEED-MS34: Improve performance and capabilities of CEED-enabled ECP applications on Summit/Sierra. Exascale Computing Project Milestone Report
The main goal of this milestone was to help CEED-enabled ECP applications, including ExaSMR, MARBL, ExaWind and ExaAM, to improve their performance and capabilities on GPU systems like Summit and Lassen/Sierra. In addition, the CEED team also worked to: add and improve support for additional hardware and programming models in the CEED software components; release the next version of the CEED software stack, CEED-3.0; and demonstrate performance of libParanumal kernels in libCEED, Nek and MFEM. These additional tasks contributed directly to the main CEED-MS34 goal and will also play an important role in CEED’s future milestones.
97 MATHEMATICS AND COMPUTING↗
Clean Energy Trust Challenge
Over the past three years, Clean Energy Trust (CET) supported student education and early-stage entrepreneurship in the clean energy sector by managing and effectively executing the Cleantech University Prize (Cleantech UP) initiative. CET has a long track record running these competition-style events; CET built on its past successes with the National Clean Energy Business Plan Competition (NCEBPC) and the Clean Energy Trust Challenge (the Challenge) - CET's annual business plan competition and summit event - to excel during this initiative. CET's goals with this Cleantech UP program were to enhance student engagement and participation across colleges and universities in the Midwest region. This broad objective was outlined by increasing the number of applicants, the number and geographic footprint of universities and colleges actively engaged and, most importantly, the trajectory for the student businesses that participate in our programs.
29 ENERGY PLANNING, POLICY, AND ECONOMY↗
Compare linear-system solver and preconditioner stacks with emphasis on GPU performance and propose phase-2 NGP solver development pathway
The goal of the ExaWind project is to enable predictive simulations of wind farms comprised of many megawatt-scale turbines situated in complex terrain. Predictive simulations will require computational fluid dynamics (CFD) simulations for which the mesh resolves the geometry of the turbines and captures the rotation and large deflections of blades. Whereas such simulations for a single turbine are arguably petascale class, multi-turbine wind farm simulations will require exascale-class resources. The primary physics codes in the ExaWind project are Nalu-Wind, which is an unstructured-grid solver for the acoustically incompressible Navier-Stokes equations, and OpenFAST, which is a whole-turbine simulation code. The Nalu-Wind model consists of the mass-continuity Poisson-type equation for pressure and a momentum equation for the velocity. For such modeling approaches, simulation times are dominated by linear-system setup and solution for the continuity and momentum systems. For the ExaWind challenge problem, the moving meshes greatly affect overall solver costs as reinitialization of matrices and recomputation of preconditioners is required at every time step. In this report we evaluated GPU-performance baselines for the linear solvers in the Trilinos and hypre solver stacks using two representative Nalu-Wind simulations: an atmospheric boundary layer precursor simulation on a structured mesh, and a fixed-wing simulation using unstructured overset meshes. Both strong-scaling and weak-scaling experiments were conducted on the OLCF supercomputer Summit and similar proxy clusters. We focused on the performance of multi-threaded Gauss-Seidel and two-stage Gauss-Seidel that are extensions of classical Gauss-Seidel; of one-reduce GMRES, a communication-reducing variant of the Krylov GMRES; and algebraic multigrid methods that incorporate the afore-mentioned methods. The team has established that AMG methods are capable of solving linear systems arising from the fixed-wing overset meshes on CPU, a critical intermediate result for ExaWind FY20 Q3 and Q4 milestones. For the fixed-wing strong-scaling study (model with 3M grid-points), the team identified that Nalu-Wind simulations with the new Trilinos and hypre solvers scale to modest GPU counts, maintaining above 70% efficiency up to 6 GPUs. However, there still remain significant bottlenecks to performance: matrix assembly (hypre), AMG setup (hypre and Trilinos) In the weak-scaling experiments (going from 0.4M to 211M gridpoints), it's shown that the solver apply phases are faster on GPUs, but that Nalu-Wind simulation times grow, primarily due to the multigrid-setup process. Finally, based on the report outcomes, we propose a linear solver path-forward for the remainder of the ExaWind project. Near term, the NREL team will continue their work on GPU-based linear-system assembly. They will also investigate how the use of alternatives to the NVIDIA UVM (unified virtual memory) paradigm affects performance. Longer term, the NREL team will evaluate algorithmic performance on other types of accelerators and merge their improvements back to the main hypre repository branch. Near term, the Trilinos team will address performance bottlenecks identified in this milestone, such as implementing a GPU-based segregated momentum solve and reusing matrix graphs across linear-system assembly phases. Longer term, the Trilinos team will do detailed analysis and optimization of multigrid setup.
17 WIND ENERGY↗
Implementing an aerosol dynamic shape factor for cerium oxide powder
The shape factor (X B ) of bulk powder CeO 2 (cerium oxide) particles is estimated to be X B = 1.34 (dimensionless). This is defined in relation to the measured aerated bulk density (0.91 g cm -3 , Hosokawa Micron, Summit NJ, 2018) of the CeO 2 powder. This information is used to determine the RRF (respirable release factor), and other parameters during drop test experiments of nuclear material storage containers at Los Alamos National Laboratory. The calculation is based on an experimental shape factor (X P = 2.66 dimensionless) for CeO 2 particles of the same (chain aggregate) morphology studied by other researchers. In that work, the shape factor was defined in terms of the maximum possible (compacted) density of CeO 2 material (7.13 g cm -3 ).
61 RADIATION PROTECTION AND DOSIMETRY↗
Nuclear Security Governance in India: Institutions, Instruments, and Culture (2019)
There is an emerging consciousness in India of the importance of nuclear security and safety. Motivated by a combination of rapid growth in its civil nuclear sector, heightened scrutiny of recent nuclear accidents around the world, and the deteriorating regional security environment, India has pushed to adopt measures to strengthen and enhance its nuclear security and safety governance structures. India recognizes that the various recent global nuclear security initiatives are in its own best interest and has been an enthusiastic participant in the Nuclear Security Summit process. Today, India demonstrates a greater willingness to showcase its nuclear security arrangements before the public and has undertaken many institutional, legal, and operational reforms to maintain international regime compliance. This study takes a comprehensive look at India's approach to nuclear security and critically examines the physical security measures the country has put in place. Particular focus is placed on the evolution and strengths, as well as weaknesses, of the country's nuclear security institutions, instruments, practices, and culture. Given that the strengthening of India's nuclear security governance is an ongoing endeavor, the paper also puts forward a number of policy recommendations.
21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗