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At least 397 records · Page 22

LaserNetUS at the Extreme Light Laboratory. Final report

This is the final report for LaserNetUS, Grant # DE-SC0019419. This project covered the first two annual cycles (2018-2020) of LaserNetUS experiments conducted at the Extreme Light Laboratory, University of Nebraska-Lincoln. The project provided students and scientists from four institutions (BYU, Stanford, UNR, and ARFL) with access to a world-class high-intensity laser facility. Experimental results were obtained on the topics of Nonlinear Thomson scattering, Relativistic vacuum acceleration, and electron beams in relativistic high-energy-density plasma to study x-ray line emission and radio frequencies of ultrashort relativistic electron beam interactions. Another benefit was the training of 10 students (undergraduate or graduate) and 6 young scientists (postdoc or associate/research professors) in critical areas to the future development of high energy density science and high-power laser technology.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Forward Physics Facility

High-energy collisions at the High-Luminosity Large Hadron Collider will produce a large number of particles along the beam collision axis, outside of the acceptance of existing LHC experiments. The proposed Forward Physics Facility (FPF), to be located 617--682 meters from the ATLAS interaction point along the beam collision axis and shielded by concrete and rock, will host a suite of experiments to probe Standard Model processes and search for physics beyond the Standard Model. The FPF is supported by a rapidly growing user community of 400 physicists, and four pathfinder detectors that are currently operating at the LHC have already yielded promising results, including the first direct detection of collider neutrinos. Here we provide an Executive Summary, and then briefly summarize the status of the FPF, including its rich science case, the facility itself, the proposed FPF experiments and their technical readiness, the preliminary schedule and budget profile, and plans for international participation. Submitted to the DOE/NSF HEPAP Particle Physics Projects Prioritization Panel~(P5)

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

FRIB Transition to User Operations, Power Ramp Up, and Upgrade Perspectives

After project completion on scope, on cost, and ahead of schedule, the Facility for Rare Isotope Beams began operations for scientific users in May of 2022. During the first 12 months of user operations, the FRIB accelerator complex delivered 5250 beam hours, including 1528 hours to nine science experiments conducted with primary beams of 36Ar, 48Ca, 70Zn, 82Se, 124Xe, and 198Pt at beam energies >200 MeV/u; 2724 hours for beam developments, studies, and tuning; and 998 hours to industrial users and non-scientific programs using the FRIB Single Event Effect (FSEE) beam line. The ramp-up to a beam power of 400 kW is planned over a six-year period; 1 kW was delivered for initial user runs from in 2022, and 5 kW was delivered as of February 2023. Upgrade plans include doubling the primary-beam energy to 400 MeV/nucleon for enhanced discovery potential (¿FRIB 400¿). This talk reports on FRIB status and progress since SRF2021, emphasizing lessons learned during the transition from beam commissioning to machine operations, challenges and resolutions for the power ramp-up, progress with accelerator improvements, and R&D for the energy upgrade.

43 PARTICLE ACCELERATORS↗

EOSDIS - Its role in the EOS program and its importance to the scientific community

In order to manage the global data sets required to understand the earth as a system, the EOS Data and Information System (EOSDIS) will collect and store satellite, aircraft, and in situ measurements and their resultant data products, and will distribute the data conveniently. EOSDIS will also provide product generation and science computing facilities to support the development, processing, and validation of standard EOS science data products. The overall architecture of EOSDIS, and how the Distributed Active Archive Centers fit into that structure, are shown. EOSDIS will enable users to query data bases nationally, make use of keywords and other mnemonic identifiers, and see graphic images of subsets of available data prior to ordering full (or selected pieces of) data sets for use in their 'home' environment.

Price, Robert D.↗

Boundary-Layer Gradients in New Particle Formation Field Campaign Report

Atmospheric new particle formation (NPF) followed by growth of the particles to ~50-150 nm is estimated to account for over 50% of the particles that can activate cloud droplets. As such, NPF and the subsequent growth plays a critical role in our ability to understand how aerosols affect cloud life cycle, properties, and processes and more generally the Earth’s radiative balance. NPF and growth is known to occur throughout the troposphere including in both the boundary layer and the free troposphere. The majority of NPF and growth observations, however, come from surface-based measurements within the boundary layer. Measurements of the vertical distribution of NPF and growth are sparse and thus insufficient to test many of the hypotheses that attempt to explain connections between NPF and boundary-layer transport and meteorology. The purpose of this campaign was to investigate the vertical distribution of NPF and growth at the U.S. Department of Energy Atmospheric Radiation Measurement (ARM) user facility’s Southern Great Plains (SGP) observatory.

54 ENVIRONMENTAL SCIENCES↗

Case Study of an Object-Oriented System: EOSDIS

Mission to Planet Earth (MTPE) is a long-term NASA research mission to study the processes leading to global climate change. The Earth Observing System (EOS) is a NASA campaign of satellite observatories that are a major component of MTPE. The EOS Data and Information System (EOSDIS) is another component of MTPE that will provide the Earth science community with easy, affordable, and reliable access to Earth science data. EOSDIS is a distributed system, with major facilities at six Distributed Active Archive Centers (DAACS) located throughout the United States. The EOSDIS software architecture is being designed to receive, process, and archive several terabytes of science data on a daily basis. Thousands of science users and perhaps several hundred thousands of non-science users are expected to access the system. While there are many segments in EOSDIS (e.g., flight operations, network) this case study discusses the development of the science data processing segment (SDPS). We briefly review the architecture of the system, the goals of the SDPS, and the development progress to date. This study highlights key software development challenges, experiences integrating COTS, and the difficulties of managing a complex system development effort.

Behnke, Jeanne↗

EOSDIS: Archive and Distribution Systems in the Year 2000

Earth Science Enterprise (ESE) is a long-term NASA research mission to study the processes leading to global climate change. The Earth Observing System (EOS) is a NASA campaign of satellite observatories that are a major component of ESE. The EOS Data and Information System (EOSDIS) is another component of ESE that will provide the Earth science community with easy, affordable, and reliable access to Earth science data. EOSDIS is a distributed system, with major facilities at seven Distributed Active Archive Centers (DAACs) located throughout the United States. The EOSDIS software architecture is being designed to receive, process, and archive several terabytes of science data on a daily basis. Thousands of science users and perhaps several hundred thousands of non-science users are expected to access the system. The first major set of data to be archived in the EOSDIS is from Landsat-7. Another EOS satellite, Terra, was launched on December 18, 1999. With the Terra launch, the EOSDIS will be required to support approximately one terabyte of data into and out of the archives per day. Since EOS is a multi-mission program, including the launch of more satellites and many other missions, the role of the archive systems becomes larger and more critical. In 1995, at the fourth convening of NASA Mass Storage Systems and Technologies Conference, the development plans for the EOSDIS information system and archive were described. Five years later, many changes have occurred in the effort to field an operational system. It is interesting to reflect on some of the changes driving the archive technology and system development for EOSDIS. This paper principally describes the Data Server subsystem including how the other subsystems access the archive, the nature of the data repository, and the mass-storage I/O management. The paper reviews the system architecture (both hardware and software) of the basic components of the archive. It discusses the operations concept, code development, and testing phase of the system. Finally, it describes the future plans for the archive.

Behnke, Jeanne↗

ESI-MS Identification of the Cationic Phosphine-Ligated Gold Clusters Au1-Au22: Insight into the Gold-Ligand Ratio and Abundance of Larger Clusters

Triphenylphosphine (PPh3)-ligated gold clusters offer promising potential applications due to their relative ease of synthesis and usefulness in forming advanced cluster architectures. While previous studies reported cationic PPh3-ligated gold clusters with core sizes of Au1 - Au4, Au6 - Au11, and Au¬13 - Au14, there has not been definitive identification by mass spectrometry of larger clusters in the Au12 - Au25¬ range. Herein, we survey a polydisperse solution of cationic PPh3-ligated gold clusters using high mass-resolution (M/?M = 60,000) electrospray ionization mass spectrometry (ESI-MS). To improve the sensitivity and mass resolution of larger clusters for unambiguous identification, we increased the number of scan averages and reduced the range of mass collection windows to 200 m/z, thereby mitigating potential mass and ion abundance bias resulting from smaller “building block” gold clusters and other solution components present in higher abundance. In addition to the previously reported clusters, we identified several new species including Au5(PPh3)5+, Au12(PPh3)9HCl2+, Au15(PPh3)9Cl2+, Au16(PPh3)10Cl22+, Au17(PPh3)113+, Au18(PPh3)102+, Au19(PPh3)10Cl2+, Au20(PPh3)12H33+, Au21(PPh3)10Cl2+, and Au22(PPh3)10Cl22+, indicating that a full range of clusters between Au1 - Au22 may be observed in a single polydisperse solution. Considering all of the observed clusters, our findings provide evidence that the “magic number” icosahedral Au13 may be the transition point in cluster growth between smaller clusters, exhibiting a 1:1 gold-to-ligand ratio, and larger clusters, wherein subsequent gold atoms are added to the core without an equal number of accompanying ligands. Our method demonstrates that reducing the range of m/z collection windows and increasing the number of scan averages can improve instrument sensitivity for cationic gold clusters and enable a more complete survey of polydisperse solutions, thereby providing new insights to guide and validate the results of other characterization methods and theoretical calculations. This work was supported by the US Department of Energy (DOE), Office of Science, Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences, and Biosciences. MH acknowledges support from the DOE Science Undergraduate Laboratory Internship (SULI) program. HH acknowledges support from the DOE Office of Workforce Development for Teachers and Scientist (WDTS) under the Visiting Faculty Program (VFP). This work was performed using EMSL, a national scientific user facility sponsored by the DOE's Office of Biological and Environmental Research and located at Pacific Northwest National Laboratory (PNNL). PNNL is a multiprogram national laboratory operated for DOE by Battelle.

Hewitt, Michael↗

Metal Particles at EPCAPE Field Campaign Report

This project aimed to evaluate the performance of Toxic-metal Aerosol Real-Time Analyzer (TARTA) in quantifying toxic metal particle concentrations in real time during the U.S.. Department of Energy (DOE) Eastern Pacific Cloud Aerosol Precipitation Experiment (EPCAPE). This field campaign was conducted from October 20 to November 30, 2023, at Mount Soledad in San Diego, California. The campaign was part of the DOE Atmospheric Radiation Measurement (ARM) user facility, specifically designed to improve understanding of marine stratocumulus clouds and their interactions with atmospheric aerosols.

54 ENVIRONMENTAL SCIENCES↗

Designing FAIR Workflows at OLCF: Building Scalable and Reusable Ecosystems for HPC Science

High Performance Computing (HPC) centers, such as the Oak Ridge Leadership Computing Facility (OLCF), provide advanced infrastructure that enables scientific research at extreme scale. These centers operate with unique hardware configurations, specialized software environments, and elevated security re quirements that differ substantially from what most users encounter on their local systems. As a result, users often develop customized digital artifacts that are tightly coupled to the specific configuration of a given HPC center. Although necessary, this practice can lead to significant duplication of effort as multiple users independently create similar solutions to common problems.

97 MATHEMATICS AND COMPUTING↗

Optical Test Bench (SYSM 5620 Final Report)

The National Ignition Facility (NIF) is a research facility that focuses on High Energy Density Science and Inertial Confinement Fusion. In the NIF, 192 laser beams are directed into a miniscule Target Capsule to generate an implosion – this is called a NIF Shot. Many NIF Users conduct experiments using different Targets and laser inputs to generate reactions that are of interest to the scientific community. Those reactions are monitored using various Target Diagnostic instruments, including Shot Time Photography – which provides crucial images of the Target as the implosion occurs. A subset of these NIF Users is less interested in the reaction itself and more interested in subjecting materials or devices to the intense environment that these reactions can create. Using the Target as a source of x-rays, neutrons, or blast loading for particular materials has been significant to the shock physics community and to those who work in extreme design spaces. However, the Material and Radiation Effects team – that performs these experiments on behalf of the NIF Users – has not been able to make good use of the existing Shot Time Photography Diagnostics. The STP cameras are focused on the Targets rather than the MRE Customers’ materials, the current system is not oriented to have a good view of the MRE Customers’ materials, and the cameras are limited in their capabilities (black and white, poor resolution, etc.). As MRE experiments increase in quantity and importance to the scientific community, the desire for visual monitoring of the experiments to substantiate models and inform other data is also rising.

42 ENGINEERING↗

Superfluid Helium Tanker (SFHT) study

Replenishment of superfluid helium (SFHe) offers the potential of extending the on-orbit life of observatories, satellite instruments, sensors and laboratories which operate in the 2 K temperature regime. A reference set of resupply customers was identified as representing realistic helium servicing requirements and interfaces for the first 10 years of superfluid helium tanker (SFHT) operations. These included the Space Infrared Telescope Facility (SIRTF), the Advanced X-ray Astrophysics Facility (AXAF), the Particle Astrophysics Magnet Facility (Astromag), and the Microgravity and Materials Processing Sciences Facility (MMPS)/Critical Point Phenomena Facility (CPPF). A mixed-fleet approach to SFHT utilization was considered. The tanker permits servicing from the Shuttle cargo bay, in situ when attached to the OMV and carried to the user spacecraft, and as a depot at the Space Station. A SFHT Dewar ground servicing concept was developed which uses a dedicated ground cooling heat exchanger to convert all the liquid, after initial fill as normal fluid, to superfluid for launch. This concept permits the tanker to be filled to a near full condition, and then cooled without any loss of fluid. The final load condition can be saturated superfluid with any desired ullage volume, or the tank can be totally filed and pressurized. The SFHT Dewar and helium plumbing system design has sufficient component redundancy to meet fail-operational, fail-safe requirements, and is designed structurally to meet a 50 mission life usage requirement. Technology development recommendations were made for the selected SFHT concept, and a Program Plan and cost estimate prepared for a phase C/D program spanning 72 months from initiation through first launch in 1997.

Eberhardt, Ralph N.↗

OLCF’s Advanced Computing Ecosystem (ACE): FY25 Update for Ongoing Efforts

The advent of widespread use of artificial intelligence (AI) and machine learning (ML) models in science, coupled with fast data production rates of scientific instruments strain the traditional batch-oriented high-performance computing (HPC) environment. As scientific exploration continues to require more data and faster processing and analysis, new emerging technologies and capabilities to enable cross-facility and time-sensitive workflows are required for seamless integration of HPC and experimental facilities. The Advanced Computing Ecosystem (ACE) is a strategic initiative within the Oak Ridge Leadership Computing Facility (OLCF) established in 2024 to support the development of cutting-edge technologies to advance computational research and infrastructure at OLCF and across the Department of Energy (DOE). Several DOE initiatives are spearheading the evolution of the scientific landscape by blurring facility boundaries and connecting the user facilities to advance scientific capabilities and ensure energy dominance. The DOE Integrated Research Infrastructure (IRI) program is one example that is laying a foundation to support complex cross-facility workflows. The IRI program aims to integrate diverse computational resources, data infrastructures, and scientific instruments to facilitate collaboration and accelerate scientific discovery. The Interconnected Science Ecosystem (INTERSECT) initiative at Oak Ridge National Laboratory (ORNL) is another example that aims to revolutionize scientific research through AI-driven, interconnected autonomous laboratories and research facilities. Finally, the American Science Cloud (AmSC), recently announced in the “One Big Beautiful Bill”, aims to leverage prior infrastructure efforts of the IRI and automation and AI efforts of INTERSECT (and others) to build a federated, AI-augmented AmSC platform to unify the DOE’s computing, experimental, and data resources to catalyze scientific innovation.

97 MATHEMATICS AND COMPUTING↗

LANSCE Accelerator Modernization Project Conceptual Design Report

The accelerator complex now known as the Los Alamos Neutron Science Center (LANSCE) began operation in 1972 as LAMPF, the Los Alamos Meson Production Facility. In the intervening 53 years, the complex has been expanded in capability several times, both in terms of its accelerator performance and the user facilities it supports.

43 PARTICLE ACCELERATORS↗

Validity of Machine Learning in the Quantitative Analysis of Complex Scanning Near-Field Optical Microscopy Signals Using Simulated Data

Scattering-type scanning near-field optical microscope (s-SNOM) is a modern technique for subdiffractional optical imaging and spectroscopy. Over the past two decades, tremendous efforts have been devoted to modeling complex tip-sample interactions in s-SNOM, aimed at understanding the electrodynamics of materials at the nanoscale. However, due to complexities in analytical methods and the limited computation power for fully numerical simulations, compromises must be made to facilitate the modeling of tip-sample interaction, such as using quasistatic approximation or unrealistic tip geometries. Here, we apply a variety of widely utilized machine-learning methods, including k nearest neighbor and feedforward neural network etc. to study the phase-resolved spectroscopic near-field response. With only a small set of training data, which is simulated using the finite-dipole model, we demonstrate that the relation between the experimental near-field signal and sample optical constant can be one to one mapped without the need for tip modeling: for a given material with a moderate dielectric function, its complex near-field spectrum can be accurately determined within the mid-IR spectral range, and vice versa. Our preliminary study sets the stage for future exploration using real experimental data. Our method is beneficial for processing the increasing amount of data accumulated across many research groups and especially useful for user facilities such as synchrotron-based national laboratories where a large amount of data is generated on a daily basis.

36 MATERIALS SCIENCE↗

TRACER NASA Goddard Space Flight Center TOLNet Field Campaign Report

In September 2021, the National Aeronautics and Space Administration (NASA) deployed assets to the Houston, Texas region to measure air-quality-relevant constituents at high spatial and temporal resolutions. This effort was conducted in partnership with the Texas Commission on Environmental Quality, the U.S. Department of Energy (DOE) Atmospheric Radiation Measurement (ARM) user facility-led Tracking Aerosol Convection interactions ExpeRiment (TRACER) field campaign, and several academic collaborators.

54 ENVIRONMENTAL SCIENCES↗

Development of the Materials Science Research Facility (MSRF) and Experiment Apparatus for the International Space Station (ISS)

The Materials Science Research Facility (MSRF) is a modular facility designed to accommodate the current and evolving cadre of peer-reviewed materials science investigations selected to conduct research in the microgravity environment of the International Space Station (ISS). The MSRF concept consists of three Materials Science Research Racks (MSRR-1, MSRR-2, and MSRR-3) which will be developed for phased deployment into the United States Laboratory Module beginning on the third Utilization Flight (UF-3). The facility will house the materials processing apparatus and common subsystems required for operating each device, and will use the ISS Active Rack Isolation System (ARIS). Each MSRR is an autonomous rack and will be comprised of on-orbit replaceable Experiment Modules, Module Inserts, investigation unique apparatus, and/or multi-user generic processing apparatus. The MSRF will be the primary apparatus for satisfying near-term and long-range materials science discipline goals and objectives with each MSRR supporting a wide range of materials science themes in the NASA research program.

Schaefer, D. A.↗

Performance Analysis of PIConGPU: Particle-in-Cell on GPUs using NVIDIA’s NSight Systems and NSight Compute

PIConGPU, Particle In Cell on GPUs, is an open source simulations framework for plasma and laser-plasma physics used to develop advanced particle accelerators for radiation therapy of cancer, high energy physics and photon science. While PIConGPU has been optimized for at least 5 years to run well on NVIDIA GPU-based clusters, there has been limited exploration by the development team of potential scalability bottlenecks using recently updated and new tools including NVIDIA’s NVProf tool and the brand-new NVIDIA NSight Suite (Systems and Compute) tools. PIConGPU is a highly optimized application that runs production jobs at scale on a system Oak Ridge Leadership Facility’s (OLCF) Summit supercomputer (using the full machine at 4600 nodes; at 98% of GPU utilization on all ~28000 NVIDIA Volta GPUs). PIConGPU has been selected as one of the the eight applications for OLCF’s coveted Center for Accelerated Application Readiness (CAAR) program aimed at the facility’s Frontier supercomputer (OLCF’s first exascale system to launch in 2021), to partner with our vendors (primary vendors: AMD and Cray/HPE) ensuring that Frontier will be able to perform large-scale science when it opens to users in 2022. To this effect, performance engineers on the PIConGPU team wanted to dive deep into the application to understand at the finest granularity, which portions of the code could be further optimized to exploit the hardware on Summit at it’s maximum potential and also to elucidate which key kernels should be tracked and optimized for the CAAR effort to port this code to Frontier. Any bottlenecks that are observed via performance profiling on Summit are likely to also impact scalability on the Frontier-dev system and the Frontier Early Access (EA) system. Additionally, the engineers wanted to take a closer look at the newest NVIDIA profiling tools which allows us to identify the most useful features on these tools and will provide an opportunity to compare it to new AMD and Cray’s performance analysis tool releases and provide feedback to our vendor partners on what features are most important and mission critical for CAAR efforts. The primary goal of this report is to focus on the evaluation of PIConGPU’s most time-intensive kernels using NVProf and NSight Suite. Three kernels, Current Deposition (also known as Compute Current), Particle Push (Move and Mark), and Shift Particles are known to be some of the most time-consuming kernels in PIConGPU. The Current xi Deposition kernel and Particle Push kernel both set up the particle attributes for running any physics simulation with PIConGPU, so it is crucial to improve the performance of these two kernels. In this report, we measure single GPU metrics for the three kernels, offer high level takeaways from the conducted analysis, and compare the profiling data from NSight Compute to that of NVProf. This analysis was performed using a grid size of 240 x 272 x 224, and 10 time steps with the Mid-November Figure of Merit (FOM) run setup. The Traveling Wave Electron Acceleration (TWEAC) science case used in this run is a representative science case for PIConGPU. This execution can also be used for baseline analysis on AMD MI50/ MI60 systems. As of the time of writing, the PIConGPU application has limited use for features of NSight Systems, so this report will mainly focus on insights garnered from NSight Compute. For this analysis, we run the “full” metric set available in NSight Compute version 2020.1.2 and use NSight Systems version 2020.3.1 to generate the application timeline.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗