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A Tool Kit for Generating Simulated Radiation Measurements for Advanced Reactor Safeguards and Security

A tool kit was developed to simulate and analyze passive radiation measurements of molten salt reactor (MSR) operations to support development of nuclear safeguards approaches for this emerging reactor technology. A Transient Simulation Framework of Reconfigurable Modules (TRANSFORM) multiphysics simulation of an MSR produces time-dependent isotopic inventories at user-selected locations within the model. The tool kit implements the Gamma Detector Response and Analysis Software (GADRAS) application programming interface to inject the TRANSFORM isotopic inventories extracted/processed by a Python pipeline into GADRAS models of user-defined geometries. The TRANSFORM inventories are the source terms used to obtain synthetic measurements from GADRAS-defined detectors. The speed of TRANSFORM and GADRAS simulations enables surveying the large design space of MSRs (e.g., fuel type, fuel salt composition, number of loops) and the plethora of measurements (e.g., location, detector type, and collimation) within the reactor. This has enabled timely assessment of the various measurement locations and detectors to identify the most effective and efficient safeguards approach for a specific MSR design. Lastly, the tool kit also simulates extracted samples that can be aged to a desired dose, enabling stakeholders to optimize a measurement plan to use sample analysis as an element within a broader material accountancy plan.

Westphal, Greg↗

Ames National Laboratory Annual Site Environmental Report for CY2021

The primary purpose of this report is to summarize the performance of Ames National Laboratory’s environmental programs, present highlights of significant environmental activities, and confirm compliance with environmental regulations and requirements for calendar year 2021. This report is a working requirement of Department of Energy Order 231.1B, Environment, Safety and Health Reporting. It includes descriptions of the Laboratory’s site, mission, the status of its compliance with applicable environmental regulations, its planning and activities to maintain compliance, and a comprehensive review of its environmental protection, surveillance and monitoring activities. Ames National Laboratory is located on the campus of Iowa State University (ISU) and occupies 13 buildings owned by the Department of Energy (DOE). See the Laboratory’s Web page for location and Laboratory overview. The Laboratory also leases space in ISU owned buildings. In 2021, the Laboratory accumulated and disposed of hazardous waste under a U.S. Environmental Protection Agency (EPA) issued generator number. All waste was handled according to applicable EPA, State, and local regulations and DOE Orders. The Laboratory operates as a Small Quantity Generator (SQG) of hazardous waste. There were no radiological air emissions or exposures to the general public due to Laboratory activities in 2021 (See U.S. Department of Energy Air Emissions Annual Report in Appendix A.) The Laboratory has an established Environmental Radiological Protection Program (Plan 10200.041) per DOE Order 458.1 requirements. Plans, policies, and procedures are in place to protect the public and the environment against undue risk from radiation associated with DOE radiological activities. As indicated in prior Site Environmental Reports, formal pollution prevention awareness, waste minimization and recycling programs have been in practice since 1990, with improvements implemented most recently in 2017 with Iowa State University’s shift toward single-stream recycling. Included in recycling efforts are items such as batteries, monitors, corrugated cardboard, lamps, miscellaneous electronic office equipment, mixed paper, newsprint, food/beverage containers, and laboratory glassware. Ames National Laboratory also recycles/reuses salvageable metal, used oil, and foamed polystyrene peanuts, and encourages chemical redistribution and sharing among research groups. Ames National Laboratory reported its contractual performance to DOE-Ames Site Office (AMSO) through the Laboratory’s Performance Evaluation Measurement Plan (PEMP), and a performance level of “B+” was achieved in 2021 for Sustain Excellence and Enhance Effectiveness of Integrated Safety, Health, and Environmental Protection As reported in Site Environmental Reports for prior years, the Laboratory’s Environmental Management System (EMS) has been integrated into the Laboratory’s Integrated Safety Management System (ISMS) since 2005. The integration of EMS into Laboratory business practices allows the Laboratory to systematically review, address and respond to environmental impacts. In addition to DOE-identified objectives and targets, the EMS Steering Committee recommends annual environmental goals for the Laboratory. Due to the COVID-19 pandemic and limited onsite work staff, goals of reducing water usage and travel/commuting to promote the reduction of scope 3 greenhouse gases were achieved. All contract deliverables and environmental compliance activities were still met during this time.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

The bright end of the z ∼ 9 and z ∼ 10 UV luminosity functions using all five candels fields

The deep, wide-area (∼800–900 arcmin{sup 2}) near-infrared/WFC3/IR + Spitzer/IRAC observations over the CANDELS fields have been a remarkable resource for constraining the bright end of high-redshift UV luminosity functions. However, the lack of Hubble Space Telescope (HST) 1.05 μm observations over the CANDELS fields has made it difficult to identify z ∼ 9–10 sources robustly, since such data are needed to confirm the presence of an abrupt Lyman break at 1.2 μm. Here, we report on the successful identification of many such z ∼ 9–10 sources from a new HST program (z9-CANDELS) that targets the highest-probability z ∼ 9–10 galaxy candidates with observations at 1.05 μm, to search for a robust Lyman-break at 1.2 μm. The potential z ∼ 9–10 candidates were preselected from the full HST, Spitzer/IRAC S-CANDELS observations, and the deepest-available ground-based optical+near-infrared observations (CFHTLS-DEEP+HUGS+UltraVISTA+ZFOURGE). We identified 15 credible z ∼ 9–10 galaxies over the CANDELS fields. Nine of these galaxies lie at z ∼ 9 and five are new identifications. Our targeted follow-up strategy has proven to be very efficient in making use of scarce HST time to secure a reliable sample of z ∼ 9–10 galaxies. Through extensive simulations, we replicate the selection process for our sample (both the preselection and follow-up) and use it to improve current estimates for the volume density of bright z ∼ 9 and z ∼ 10 galaxies. The volume densities we find are 5{sub −2}{sup +3}× and 8{sub −3}{sup +9}× lower, respectively, than those found at z ∼ 8. When compared with the best-fit evolution (i.e., d log{sub 10} ρ{sub UV}/dz=−0.29±0.02) in the UV luminosity densities from z ∼ 8 to z ∼ 4 integrated to 0.3L{sub z=3}{sup ∗} (−20 mag), these luminosity densities are 2.6{sub −0.9}{sup +1.5}× and 2.2{sub −1.1}{sup +2.0}× lower, respectively, than the extrapolated trends. Our new results are broadly consistent with the “accelerated evolution” scenario at z > 8, consistent with that seen in many models.

79 ASTRONOMY AND ASTROPHYSICS↗

Parallax beyond a kiloparsec from spatially scanning the wide field Camera 3 on the Hubble space telescope

We use a newly developed observing mode on the Hubble Space Telescope (HST) and Wide Field Camera 3, spatial scanning, to increase source sampling a thousand-fold and measure changes in source positions to a precision of 20-40 μas, more than an order of magnitude better than attainable in pointed observations. This observing mode can usefully measure the parallaxes of bright stars at distances of up to 5 kpc, a factor of 10 farther than achieved thus far with HST. The technique should also provide a unique crosscheck of future parallax measurements from Gaia. Long-period classical Cepheid variable stars in the Milky Way, nearly all of which reside beyond 1 kpc, are especially compelling targets for parallax measurements from scanning, as they may be used to anchor a determination of the Hubble constant to ∼1%. We illustrate the method by measuring to high precision the parallax of a classical Cepheid, SY Aurigae, at a distance of more than 2 kpc, using five epochs of spatial-scan data obtained at intervals of six months. Rapid spatial scans also enable photometric measurements of bright Milky Way Cepheids—which would otherwise saturate even in the shortest possible pointed observations—on the same flux scale as extragalactic Cepheids, which is a necessity for reducing a leading source of systematic error in the Hubble constant. We demonstrate this capability with photometric measurements of SY Aur on the same system used for Cepheids in Type Ia supernova host galaxies. While the technique and results presented here are preliminary, an ongoing program with HST is collecting such parallax measurements for another 18 Cepheids to produce a better anchor for the distance scale.

79 ASTRONOMY AND ASTROPHYSICS↗

THE YOUNG SOLAR ANALOGS PROJECT. I. SPECTROSCOPIC AND PHOTOMETRIC METHODS AND MULTI-YEAR TIMESCALE SPECTROSCOPIC RESULTS

This is the first in a series of papers presenting methods and results from the Young Solar Analogs Project, which began in 2007. This project monitors both spectroscopically and photometrically a set of 31 young (300–1500 Myr) solar-type stars with the goal of gaining insight into the space environment of the Earth during the period when life first appeared. From our spectroscopic observations we derive the Mount Wilson S chromospheric activity index (S{sub MW}), and describe the method we use to transform our instrumental indices to S{sub MW} without the need for a color term. We introduce three photospheric indices based on strong absorption features in the blue-violet spectrum—the G-band, the Ca i resonance line, and the Hydrogen-γ line—with the expectation that these indices might prove to be useful in detecting variations in the surface temperatures of active solar-type stars. We also describe our photometric program, and in particular our “Superstar technique” for differential photometry which, instead of relying on a handful of comparison stars, uses the photon flux in the entire star field in the CCD image to derive the program star magnitude. This enables photometric errors on the order of 0.005–0.007 magnitude. We present time series plots of our spectroscopic data for all four indices, and carry out extensive statistical tests on those time series demonstrating the reality of variations on timescales of years in all four indices. We also statistically test for and discover correlations and anti-correlations between the four indices. We discuss the physical basis of those correlations. As it turns out, the “photospheric” indices appear to be most strongly affected by emission in the Paschen continuum. We thus anticipate that these indices may prove to be useful proxies for monitoring emission in the ultraviolet Balmer continuum. Future papers in this series will discuss variability of the program stars on medium (days–months) and short (minutes to hours) timescales.

79 ASTRONOMY AND ASTROPHYSICS↗

Evaluating cosmological biases using photometric redshifts for Type Ia Supernova cosmology with the Dark Energy Survey Supernova Program

Cosmological analyses with Type Ia Supernovae (SNe Ia) have traditionally been reliant on spectroscopy for both classifying the type of supernova and obtaining reliable redshifts to measure the distance–redshift relation. While obtaining a host-galaxy spectroscopic redshift for most SNe is feasible for small-area transient surveys, it will be too resource intensive for upcoming large-area surveys such as the Vera Rubin Observatory Legacy Survey of Space and Time, which will observe on the order of millions of SNe. Here, we use data from the Dark Energy Survey (DES) to address this problem with photometric redshifts (photo-z) inferred directly from the SN light curve in combination with Gaussian and full p(z) priors from host-galaxy photo-z estimates. Using the DES 5-yr photometrically classified SN sample, we consider several photo-z algorithms as host-galaxy photo-z priors, including the Self-Organizing Map redshifts (SOMPZ), Bayesian Photometric Redshifts (BPZ), and Directional-Neighbourhood Fitting (DNF) redshift estimates employed in the DES 3 × 2 point analyses. With detailed catalogue-level simulations of the DES 5-yr sample, we find that the simulated w can be recovered within ±0.02 when using SN+SOMPZ or DNF prior photo-z, smaller than the average statistical uncertainty for these samples of 0.03. With data, we obtain biases in w consistent with simulations within ~1σ for three of the five photo-z variants. We further evaluate how photo-z systematics interplay with photometric classification and find classification introduces a subdominant systematic component. This work lays the foundation for next-generation fully photometric SNe Ia cosmological analyses.

(cosmology:) dark energy↗

Assessment of Small Modular Reactor Suitability for Use On or Near Air Force Space Command Installations

This is the final report of the Small Modular Reactor (SMR) Suitability study by Sandia National Laboratories and the Scitor Team (Scitor Corporation and Landrey & Company). SMRs are being considered by the U.S. government as a clean energy option that can meet the economic, environmental and energy security goals of the country. This report was sponsored by the US Department of Energy (DOE) under the SMR Licensing Technical Support program, of which one of the goals is to advance the commercial viability of domestic SMR designs. The study reflects the intent of the memorandum of understanding between the DOE and the Department of Defense (DoD) to enhance national energy security and demonstrate leadership in transitioning the United States (US) to a low carbon economy. This report assesses the suitability of using US-developed light water SMR technology to provide energy for Schriever Air Force Base, CO and Clear Air Force Station, AK, and for broader SMR applications to meet DoD and Federal energy needs. This report also outlines deployment scenarios to optimize the use of an SMR's capacity to meet aggregated DoD and Federal energy needs within selected regions of the US. Finally, the report includes recommendations for follow-on actions by DoD and DOE to further the development of US SMR technology and effectively address viable solutions for national energy security and clean energy goals.

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗

The Fermilab Holometer: A program to measure Planck scale indeterminacy

We propose an experiment at Fermilab to study a conjectured effect called "holographic noise" that may arise from new Planck scale physics: the measured positions of bodies may wander randomly from ideal geodesics of classical relativity, in measurement-dependent directions, by about a Planck length per Planck time. The experiment will search for this holographic jitter in the relation of mass-energy and space-time by looking for correlated phase noise between two neighboring 40 meter interferometers. The goal of the experiment is to provide convincing evidence for or against the hypothesis that relative transverse positions of bodies display this particular new kind of quantum noise, whose power spectrum is independent of frequency and has a spectral density determined only by the Planck time. A positive result of the experiment would be a major step forward in understanding the emergence of space time and mass-energy from a unified theory of spacetime and quantum mechanics. A negative result will impact the macroscopic interpretation of unified theories.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

Simulating non-native cubic interactions on noisy quantum machines

As a milestone for general-purpose computing machines, we demonstrate that quantum processors can be programed to efficiently simulate dynamics that are not native to the hardware. Moreover, on noisy devices without error correction, we show that simulation results are significantly improved when the quantum program is compiled using modular gates instead of a restricted set of standard gates. We demonstrate the general methodology by solving a cubic interaction problem, which appears in nonlinear optics, gauge theories, as well as plasma and fluid dynamics. To encode the non-native Hamiltonian evolution, we decompose the Hilbert space into a direct sum of invariant subspaces in which the nonlinear problem is mapped to a finite-dimensional Hamiltonian simulation problem. Furthermore, in a three-states example, the resultant unitary evolution is realized by a product of approximately 20 standard gates, using which approximately ten simulation steps can be carried out on state-of-the-art quantum hardware before results are corrupted by decoherence. In comparison, the simulation depth is improved by more than an order of magnitude when the unitary evolution is realized as a single cubic gate, which is compiled directly using optimal control. Alternatively, parametric gates may also be compiled by interpolating control pulses. Modular gates thus obtained provide high-fidelity building blocks for quantum Hamiltonian simulations.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

A Low Loss, Fast Ramp HTS Solenoid Prototype for Compact Spherical Tokamaks

To explore AC loss characteristics of commercial Bi-2212 conductors made in the USA, a small ohmic heating (OH) prototype coil is being developed for compact tokamaks using high performance Bi-2212 wires newly manufactured by Bruker EST. Here, the goal is to build and test Bi-2212 prototype coils for fast ramp central solenoid (CS) operation of spherical tokamaks (ST). For a ST pilot plant, one of the key challenges is the tight space available for CS in a center column where in-board legs of the toroidal field (TF) and OH coils are assembled into a cryostat with a few millimeters clearance. A high current density Rutherford cable consisting of 17 legacy Bi-2212 wires, a contribution of the US Magnet Development Program (MDP), was fabricated at the Lawrence Berkeley National Laboratory (LBNL) for the development of fast ramp CS magnets in the ST Advanced Reactor (STAR) designed by PPPL. Characterization of the new and legacy HTS wires is presented, along with the coil design wound directly with new wire, and a Rutherford cable-wound solenoid using the legacy wire. A comparison of AC losses is made based on expected performance for a fast ramp ST operation. The HTS cable and cabled coil fabrication issues such as the heat treatment, coil mandrel design, assembly and 2212 quench characteristics are discussed, along with a test plan for CS design validation.

Zhai, Yuhu [Princeton Plasma Physics Laboratory (P↗

ThermoLift – A Natural Gas Fired Air Conditioner and Heat Pump

ThermoLift is developing TC-Cycle™, a natural-gas driven air conditioner and cold-climate heat pump that can provide space heating, water heating, and air conditioning in a single device. Unlike traditional heat-pump system, the TC-Cycle system uses helium as working fluid in place of high global warming potential HFC refrigerant. The system has broad application as a combined HVAC solution and technology development throughout this program has advanced the Technology Readiness Level (TRL) from TRL-1 to TRL-5 achieved in the Gen 3.0 prototype. In August of 2013, the US Department of Energy (DOE) provided Research and Development funding through the Building Technologies Innovations Program Funding Opportunity Announcement DE-FOA-0000823. The statement of work (SOW) outlined a deliverable of testing at ORNL and a final test report prepared to include various heating cooling temperature ranges and performance analysis. Furthermore, a milestone of this effort was to analyze all test data to establish further efficiency improvements and consider optimum manufacturing methodologies to facilitate the next level improvements. ThermoLift’s Gen 3.0 gas-fired heat pump was shipped and installed into ORNL’s test facility with most of the data reported herein obtained on August 6, 2018. Uninterrupted operation demonstrated cycle Coefficient of Performance (COP) well exceeding DOE targets for cold-climate heat pumps. Furthermore, there was no degradation in capacity as inlet (ambient) temperature decreased.

03 NATURAL GAS↗

Kilopower - Powering the Future of Space Exploration [Poster]

The Kilopower Project was initiated by NASA’s Space Technology Mission Directorate to demonstrate subsystem-level technology readiness of small space fission power in a relevant environment (TRL 5) for space science and human exploration power needs. The Kilopower Project centerpiece is the Kilowatt Reactor Using Stirling Technology (KRUSTY) test, which consists of the development and testing of a ground technology demonstrator of a 1 kWe class fission power system. The technologies to be developed and validated by KRUSTY are extensible to space fission power systems from 1 to 10 kWe, which can enable modular surface fission power systems for human exploration, as well as higher power future potential deep space science missions.

42 ENGINEERING↗

TOWARD PRECISION BLACK HOLE MASSES WITH ALMA: NGC 1332 AS A CASE STUDY IN MOLECULAR DISK DYNAMICS

We present first results from a program of Atacama Large Millimeter/submillimeter Array (ALMA) CO(2–1) observations of circumnuclear gas disks in early-type galaxies. The program was designed with the goal of detecting gas within the gravitational sphere of influence of the central black holes (BHs). In NGC 1332, the 0.″3-resolution ALMA data reveal CO emission from the highly inclined (i≈83{sup ∘}) circumnuclear disk, spatially coincident with the dust disk seen in Hubble Space Telescope images. The disk exhibits a central upturn in maximum line-of-sight velocity, reaching ±500 km s{sup −1} relative to the systemic velocity, consistent with the expected signature of rapid rotation around a supermassive BH. Rotational broadening and beam smearing produce complex and asymmetric line profiles near the disk center. We constructed dynamical models for the rotating disk and fitted the modeled CO line profiles directly to the ALMA data cube. Degeneracy between rotation and turbulent velocity dispersion in the inner disk precludes the derivation of strong constraints on the BH mass, but model fits allowing for a plausible range in the magnitude of the turbulent dispersion imply a central mass in the range of ∼(4–8) × 10{sup 8} M{sub ⊙}. We argue that gas-kinematic observations resolving the BH’s projected radius of influence along the disk’s minor axis will have the capability to yield BH mass measurements that are largely insensitive to systematic uncertainties in turbulence or in the stellar mass profile. For highly inclined disks, this is a much more stringent requirement than the usual sphere-of-influence criterion.

79 ASTRONOMY AND ASTROPHYSICS↗

Arctic Observing Experiment (AOX) Field Campaign Report

Our ability to understand and predict weather and climate requires an accurate observing network. One of the pillars of this network is the observation of the fundamental meteorological parameters: temperature, air pressure, and wind. We plan to assess our ability to measure these parameters for the polar regions during the Arctic Observing Experiment (AOX, Figure 1) to support the International Arctic Buoy Programme (IABP), Arctic Observing Network (AON), International Program for Antarctic Buoys (IPAB), and Southern Ocean Observing System (SOOS). Accurate temperature measurements are also necessary to validate and improve satellite measurements of surface temperature across the Arctic. Support for research associated with the campaign is provided by the National Science Foundation, and by other US agencies contributing to the US Interagency Arctic Buoy Program. In addition to the support provided by the U.S Department of Energy (DOE) Atmospheric Radiation Measurement (ARM) Climate Research Facility’s North Slope of Alaska (NSA) site at Barrow and the National Science Foundation (NSF), the U.S. IABP is supported by the U.S. Coast Guard (USCG), the National Aeronautics and Space Administration (NASA), the National Ice Center (NIC), the National Oceanic and Atmospheric Administration (NOAA), and the Office of Naval Research (ONR).

54 ENVIRONMENTAL SCIENCES↗

Integrated Traction Drive Thermal Management: Keystone Project 3

The presentation was developed for the U.S. Department of Energy (DOE) Vehicle Technologies Program 2020 Annual Merit Review and Peer Evaluation Meeting. It reports on progress and accomplishments of DOE funded Integrated Traction Drive Thermal Management project. Highlighted are NREL's research accomplishments during FY 2020. Challenges associated with thermal management of integrated traction drives for electric vehicles arise due to the limited packaging space, coolant distribution, electrical connections, and ambient temperatures. For this project at NREL, research focuses on enabling thermal management technologies to support a modular, compact, self-contained integrated electric drive unit with motor and power electronics. Integration approaches, based on packaging location and coolant options for power electronics integrated with candidate motor technologies to reduce cables and connectors, are reviewed and compared using finite element analysis (FEA) tools. Automatic transmission fluid (ATF) jet impingement cooling characterization is carried out experimentally (measuring heat transfer coefficients) and using computational fluid dynamics (CFD) modeling.

47 OTHER INSTRUMENTATION↗

Isotropic at the break? 3D kinematics of Milky Way halo stars in the foreground of M31

We present the line-of-sight (LOS) velocities for 13 distant main sequence Milky Way halo stars with published proper motions (PMs). The PMs were measured using long baseline (5–7 years) multi-epoch Hubble Space Telescope/Advanced Camera for Surveys photometry, and the LOS velocities were extracted from deep (5–6 hr integrations) Keck II/DEIMOS spectra. We estimate the parameters of the velocity ellipsoid of the stellar halo using a Markov chain Monte Carlo ensembler sampler method. The velocity second moments in the directions of the Galactic (l, b, LOS) coordinate system are 〈v{sub l}{sup 2}〉{sup 1/2}=138{sub −26}{sup +43} km s{sup −1}, 〈v{sub b}{sup 2}〉{sup 1/2}=88{sub −17}{sup +28} km s{sup −1}, and 〈v{sub LOS}{sup 2}〉{sup 1/2}=91{sub −14}{sup +27} km s{sup −1}. We use these ellipsoid parameters to constrain the velocity anisotropy of the stellar halo. Ours is the first measurement of the anisotropy parameter β using 3D kinematics outside of the solar neighborhood. We find β=−0.3{sub −0.9}{sup +0.4}, consistent with isotropy and lower than solar neighborhood β measurements by 2σ (β{sub SN} ∼ 0.5–0.7). We identify two stars in our sample that are likely members of the known TriAnd substructure, and excluding these objects from our sample increases our estimate of the anisotropy to β=0.1{sub −1.0}{sup +0.4}, which is still lower than solar neighborhood measurements by 1σ. The potential decrease in β with Galactocentric radius is inconsistent with theoretical predictions, though consistent with recent observational studies, and may indicate the presence of large, shell-type structure (or structures) at r ∼ 25 kpc. The methods described in this paper will be applied to a much larger sample of stars with 3D kinematics observed through the ongoing HALO7D program.

79 ASTRONOMY AND ASTROPHYSICS↗

Cluster Dynamics Simulations of Intra-Granular Fission Gas Bubble Size and Pressure Evolution in UO 2

Fission gases such as xenon (Xe) play a critical role in determining the behavior and response of nuclear fuel. Given that Xe has little solubility in UO 2 , it accumulates and forms bubbles, which significantly impact fuel performance. Intra- and inter-granular bubble nucleation and growth can lead to fuel swelling, and once bubbles interconnect at grain boundaries, fission gas can be released into the plenum. At low temperatures, limited uranium vacancy mobility can restrict swelling, therefore causing the bubbles to become highly pressurized. Consequently, this can induce micro-cracking, promote fission gas release (increasing the likelihood of cladding failure), and even lead to fuel pulverization under accident conditions such as a loss of coolant accident. As bubble evolution is strongly influenced by local temperature and fission rate, markedly different behavior occurs across the radial profile of the fuel pellet. Capturing the mechanisms that underpin bubble evolution is therefore important to predict these behaviors in the fuel. Previous models describing important mechanisms informed by lower length scale simulations have been developed under the NEAMS program. These can describe the evolution of a single bubble type (i.e., single value for radius and pressure) at each position in the pellet, for instance using the Centipede cluster dynamic code. However, in reality, a full distribution in bubble sizes and pressures exists within the microstructure at a given position in the pellet. To address this the cluster dynamics code Xolotl, which can predict Xe and vacancy phase space (i.e., bubble distributions) for intra-granular bubbles, has been used before. Prior work benchmarked the Xolotl code against the Centipede cluster dynamics code to ensure compatibility and to verify that mobile defect properties are adequately transferred between the two codes, along with some physics improvements. In this work, we go further by introducing a physics-based set of improvements that will allow us to accurately predict bubble size distributions and internal bubble pressures under representative UO 2 irradiation conditions. The improvements include (i) coupling bubble-defect reaction energies to a virial equation of state (EOS), (ii) including a bubble surface tension contribution, (iii) incorporating radiation-induced re-solution of Xe and vacancies, (iv) enabling pressure-driven dislocation loop punching through an effective emission of interstitial clusters informed by interstitial loop energetics, (v) accounting for radiation induced athermal diffusion of Xe, and (vi) implementing a Booth-type grain boundary sink representation for all mobile defects and defect clusters. After these modifications, we observe good agreement of Xolotl fission gas bubble size and concentration predictions with legacy experimental measurements. Additionally, it allows the distribution of Xe bubble pressures and radius to also be predicted and compared to data produced through the Advanced Fuels Campaign (AFC) program. Here, we have done this by running simulations under conditions similar to the AFC post-irradiation examination (PIE) samples irradiated at North Anna 2 light water reactor (LWR). Our results shows excellent agreement with these experimental measurements.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

Traleika Glacier: A hardware-software co-designed approach to exascale computing

The move from current petascale machines to future exascale machines will need both hardware improvements and software changes. Hardware will need to evolve to focus primarily on features that lower energy consumption: near-threshold voltage operation, fine-grained power and clock management and heterogeneity. Software will also need to evolve and be able to express more parallelism, become more dynamic and adaptable in order to be able to operate on a much more variable hardware. Here, we present Traleika Glacier, an effort that seeks to evaluate radical design changes to meet the constraints, both in terms of power and cost, of exascale computing. The salient features of the hardware design presented in the work include a) a use of heterogeneous cores, b) a redesign of the memory system that centers around hierarchical scratchpads and a global address space, c) the hardware acceleration of certain memory and network operations through specialized engines and, d) very fine-grained control and monitoring capabilities. On the software side, we describe a task-based runtime system, the Open Community Runtime (OCR) which aims to express a wide range of higher-level programming models with a very limited set of core concepts: event-driven tasks for computation, events for synchronization and relocatable data-blocks for data management.

97 MATHEMATICS AND COMPUTING↗