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At least 433 records · Page 24

SciDAC-3: Searching for Physics Beyond the Standard Model, University of Arizona component, Year 2 progress report

The Arizona component of the SciDAC-3 Lattice Gauge Theory program consisted of partial support for a postdoctoral position. In the original budget this covered three fourths of a postdoc, but the University of Arizona changed its ERE rate for postdoctoral positions from 4.3% to 21%, so the support level was closer to two-thirds of a postdoc. The grant covered the work of postdoc Thomas Primer. Dr. Primer's first task was an urgent one, although it was not forseen in our proposed work. It turned out that on the large lattices used in some of our current computations the gauge fixing code was not working as expected, and this revealed itself in inconsistent results in the correlators needed to compute the semileptonic form factors for K and D decays. Dr. Primer participated in the effort to understand this problem and to modify our codes to deal with the large lattices we are now generating (as large as 144 3 x 288). Corrected code was incorporated in our standard codes, and workarounds that allow us to use the correlators already computed with the unexpected gauge fixing were been implemented.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

XPRESS: eXascale PRogramming Environment and System Software, Final Report

The University of Oregon (UO) was a partner in the XPRESS project together with Sandia National Laboratories (SNL), Indiana University (IU), Lawrence Berkeley National Laboratory (LBL), Louisiana State University (LSU), Oak Ridge National Laboratory (ORNL), University of Houston (UH), and University of North Carolina (RENCI). UO's objective in the project was to develop "APEX (Asynchronous Performance Environment for eXascale)": performance measurement, analysis, feedback and control infrastructure to asynchronous tasking runtimes, specifically HPX (LSU) and HPX-5 (IU). During the project period, our efforts focused on the need to measure complex tasking models where the traditional instrumentation methods would not work due to an absent/meaningless call-path context and runtime control of task pre-emption and resumption, usually on a different operating system thread. In addition to the challenges of performance measurement, we developed a framework to provide information from all levels of the stack (hardware, operating system, runtime, application) to a feedback & control mechanism for controlling concurrency, task granularity, networking parameters, and other aspects of execution in order to improve execution performance, throughput and/or efficiency. UO demonstrated these developments on leading edge HPC machines at large scale, including a 2017 Gordon Bell submission in which APEX was used to optimize key bottlenecks in an astrophysics application. The following final report summarizes our accomplishments during the XPRESS project.

99 GENERAL AND MISCELLANEOUS↗

FY18 ASC CSSE L2 Milestone 6362: Local Failure Local Recovery (LFLR) Resiliency for Asynchronous Many Task (AMT) Programming and Execution Models

The overall goal of this work was to perform an in-depth analysis of resilience schemes adapted to the Asynchronous Many-Task (AMT) programming and execution model with the goal of informing the Sandia Advanced Simulation and Computing (ASC) program's application development strategy for next generation platforms (NGPs).

97 MATHEMATICS AND COMPUTING↗

Williston Basin Core-CM Initiative (Phase 1 Interim Report)

The Energy & Environmental Research Center (EERC) is leading the Williston Basin Coal Ore, Rare Earth Elements, and Critical Minerals (CORE-CM) Initiative, an initiative to drive the expansion and transformation of coal and coal-based resource usage within the Williston Basin to produce rare-earth elements (REEs), critical minerals (CMs), and nonfuel carbon-based products (NFCBPs). This project is the first phase in a long-term program and will set the stage for future work by assessing resource, market, technology, and infrastructure knowledge; identifying knowledge gaps; developing a series of plans to be carried out in future work; and initiating stakeholder engagement. Composed of several tasks, the project seeks to identify, characterize, and assess several necessary aspects vital to make this future work a reality.

01 COAL, LIGNITE, AND PEAT↗

TASK ALLOCATION IN GEO-DISTRIBUTED CYBER-PHYSICAL SYSTEMS

This paper studies the task allocation algorithm for a distributed test facility (DTF), which aims to assemble geo-distributed cyber (software) and physical (hardware in the loop components into a prototype cyber-physical system (CPS). This allows low cost testing on an early conceptual prototype (ECP) of the ultimate CPS (UCPS) to be developed. The DTF provides an instrumentation interface for carrying out reliability experiments remotely such as fault propagation analysis and in-situ testing of hardware and software components in a simulated environment. Unfortunately, the geo-distribution introduces an overhead that is not inherent to the UCPS, i.e. a significant time delay in communication that threatens the stability of the ECP and is not an appropriate representation of the behavior of the UCPS. This can be mitigated by implementing a task allocation algorithm to find a suitable configuration and assign the software components to appropriate computational locations, dynamically. This would allow the ECP to operate more efficiently with less probability of being unstable due to the delays introduced by geo-distribution. The task allocation algorithm proposed in this work uses a Monte Carlo approach along with Dynamic Programming to identify the optimal network configuration to keep the time delays to a minimum.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗

Development of an Interactive Valuation Model for Distributed Energy Resource Value

The Oklahoma Secretary of Commerce & Tourism (OSCT) seeks to address perceived challenges and barriers to the deployment of distributed energy generation resources (DERs), including solar and other technologies, in the state of Oklahoma. The Scope of Work (SOW) outlines follow-on tasks related to the previous CRADA # CRD-18-762. The first task will finalize the Interactive Valuation Model Requirements Document, the final draft of which was provided in June 2018. The second task includes the building, validation, and finalization of the interactive valuation model for expressing distributed energy resource value based on user inputs to be completed by June 30, 2019. Training for how to prepare the data inputs and use the model will also be provided. To address perceived challenges and barriers to the deployment of distributed energy generation resources (DERs), including solar and other technologies, in the state of Oklahoma, the work under this CRADA will: 1) finalize the draft Interactive Valuation Model Requirements Document delivered in June 2018; 2) finish building and validating the interactive valuation model for expressing DER value based on user inputs, and 3) provide training for use of this model.

14 SOLAR ENERGY↗

Investigations in Experimental and Theoretical High Energy Physics

We report on the work done under DOE grant DE-FG02-01ER41155. The experimental tasks have ongoing efforts at CERN (ATLAS), the Whipple observatory (VERITAS) and R&D work on dual readout calorimetry and neutrino-less double beta decay. The theoretical task emphasizes the weak interaction and in particular CP violation and neutrino physics. The detailed descriptions of the final report on each project are given under the appropriate task section of this report.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Intrinsic and Extrinsic Evaluation of Spatiotemporal Text Representations in Twitter Streams

Language in social media is a dynamic system, constantly evolving and adapting, with words and concepts rapidly emerging, disappearing, and changing their meaning. These changes can be estimated using word representations in context, over time and across locations. A number of methods have been proposed to track these spatiotemporal changes but no general method exists to evaluate the quality of these representations. Previous work largely focused on qualitative evaluation, which we improve by proposing a set of visualizations that highlight changes in text representation over both space and time. We demonstrate usefulness of novel spatiotemporal representations to explore and characterize specific aspects of the corpus of tweets collected from European countries over a two-week period centered around the terrorist attacks in Brussels in March 2016. In addition, we quantitatively evaluate spatiotemporal representations by feeding them into a downstream classification task – event type prediction. Thus, our work is the first to provide both intrinsic (qualitative) and extrinsic (quantitative) evaluation of text representations for spatiotemporal trends.

distributional semantics↗

Baseload Nitrate Salt Central Receiver Power Plant Design (Final Report)

The objectives of the work were to demonstrate that a 100 MWe central receiver plant, using nitrate salt as the receiver coolant, thermal storage medium, and heat transport fluid in the steam generator, can 1) operate, at full load, for 6,400 hours each year using only solar energy, and 2) satisfy the DOE levelized energy cost goal of $0.09/kWhe (real 2009 $). To achieve these objectives the work incorporated a large range of tasks relating to many different aspects of a molten salt tower plant. The first Phase of the project focused on developing a baseline design for a Molten Salt Tower and validating areas for improvement. Tasks included a market study, receiver design, heat exchanger design, preliminary heliostat design, solar field optimization, baseline system design including PFDs and P&IDs and detailed cost estimate. The baseline plant met the initial goal of less than $0.14/kWhe, and reinforced the need to reduce costs in several key areas to reach the overall $0.09/kWhe goal. The major improvements identified from Phase I were: 1) higher temperature salt to improve cycle efficiency and reduce storage requirements, 2) an improved receiver coating to increase the efficiency of the receiver, 3) a large receiver design to maximize storage and meet the baseload hours objective, and 4) lower cost heliostat field. The second Phase of the project looked at advancing the baseline tower with the identified improvements and included key prototypes. To validate increasing the standard solar salt temperature to 600 °C a dynamic test was conducted at Sandia. The results ultimately proved the hypothesis incorrect and showed high oxide production and corrosion rates. The results lead to further testing of systems to mitigate the oxide production to be able to increase the salt temperature for a commercial plant. Foster Wheeler worked on the receiver design in both Phase I and Phase II looking at both design and lowering costs utilizing commercial fossil boiler manufacturing. The cost and design goals for the project were met with this task, but the most interesting results had to do with defining the failure modes and looking at a “shakedown analysis” of the combined creep-fatigue failure. A separate task also looked at improving the absorber coatings on the receiver tubes that would improve the efficiency of the receiver. Significant progress was made on developing a novel paint with a high absorptivity that was on par with the current Pyromark, but shows additional potential to be optimized further. Although the coating did not meet the emissivity goals, preliminary testing the new paint shows potential to be much more durable, and potential to improve the receiver efficiency through a higher average absorptivity over the lifetime. Additional coatings were also designed and modeled results meet the project goals, but were not tested. Testing for low cycle fatigue of the full length receiver tubes was designed and constructed, but is still currently undergoing testing. A novel small heliostat was developed through an extensive brainstorming and down select. The concept was then detailed further with inputs from component testing and eventually a full prototype was built and tested. This task met or exceeded the accuracy and structure goals and also beat the cost goal. This provides a significant solar field costs savings for Abengoa that will be developed further to be used in future commercial plants. Ultimately the $0.09/kWhe (real 2009 $) and 6,400 hours goals of the project were met.

14 SOLAR ENERGY↗

Microfluidic Fabrication Techniques for High-Pressure Testing of Microscale Supercritical CO 2 Foam Transport in Fractured Unconventional Reservoirs

Pressure limitations of many microfluidic platforms have been a significant challenge in microfluidic experimental studies of fractured media. As a result, these platforms have not been fully exploited for direct observation of high-pressure transport in fractures. This work introduces microfluidic platforms that enable direct observation of multiphase flow in devices featuring surrogate permeable media and fractured systems. Such platforms provide a pathway to address important and timely questions such as those related to CO 2 capture, utilization and storage. This work provides a detailed description of the fabrication techniques and an experimental setup that may serve to analyze the behavior of supercritical CO 2 (scCO 2 ) foam, its structure and stability. Such studies provide important insights regarding enhanced oil recovery processes and the role of hydraulic fractures in resource recovery from unconventional reservoirs. This work presents a comparative study of microfluidic devices developed using two different techniques: photolithography/wet-etching/ thermal-bonding versus Selective Laser-induced Etching. Both techniques result in devices that are chemically and physically resistant and tolerant of high pressure and temperature conditions that correspond to subsurface systems of interest. Both techniques provide pathways to high-precision etched microchannels and capable lab-on-chip devices. Photolithography/wet-etching, however, enables fabrication of complex channel networks with complex geometries, which would be a challenging task for laser etching techniques. This work summarizes a step-by-step photolithography, wet-etching and glass thermal-bonding protocol and, presents representative observations of foam transport with relevance to oil recovery from unconventional tight and shale formations. In conclusion, this work describes the use of a high resolution monochromatic sensor to observe scCO 2 foam behavior where the entirety of the permeable medium is observed simultaneously while preserving the resolution needed to resolve features as small as 10 μm.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

A Framework to Analyze the Performance of Load Balancing Schemes for Ensembles of Stochastic Simulations

Ensembles of simulations are employed to estimate the statistics of possible future states of a system, and are widely used in important applications such as climate change and biological modeling. Ensembles of runs can naturally be executed in parallel. However, when the CPU times of individual simulations vary considerably, a simple strategy of assigning an equal number of tasks per processor can lead to serious work imbalances and low parallel efficiency. This paper presents a new probabilistic framework to analyze the performance of dynamic load balancing algorithms for ensembles of simulations where many tasks are mapped onto each processor, and where the individual compute times vary considerably among tasks. Four load balancing strategies are discussed: most-dividing, all-redistribution, random-polling, and neighbor-redistribution. Simulation results with a stochastic budding yeast cell cycle model are consistent with the theoretical analysis. It is especially significant that there is a provable global decrease in load imbalance for the local rebalancing algorithms due to scalability concerns for the global rebalancing algorithms. The overall simulation time is reduced by up to 25 %, and the total processor idle time by 85 %.

ALGORITHMS↗

Beryllium Dynamic Strength Measurements (Report on Task 3, Agreement #B590737)

The goal of the work under Agreement #B590737 consisted in the development of the experimentally justified model of beryllium shear strength of American production ( Be S200F ) in the pressure range of ~10÷60 GPa and at strain rates up to $\dot{ε_i}$ ≈10 6 s -1 . The Be shear strength models, which were available in this range of parameters, had no sufficiently reliable experimental justification. The purpose of the third final phase consisted in the performance of tests by using the method of perturbations and with recovery of samples Be S200F and parametric verification of a model of beryllium strength on their basis. In the course of the works of the third phase six experiments were performed with the use of the dynamic method of perturbations with shock-free loading of the Be S200F samples under investigation up to the pressure P m ≈50 GPa. The growth of the specified perturbations was recorded by means of the radiographic technique. In addition, each experiment includes measurements of free surface velocities of a liner by using a laser interferometer of the VISAR type. Two experiments were implemented with loading of beryllium samples up to the pressure P~25÷60 GPa with recovery followed by metallographic investigation. The objective of the metallographic investigation consisted of determination of peculiarities of high-rate deformation of Be . Measurements were carried out in each experiment by using the technique of a manganin-based pressure sensor. Numerical simulation of experiments was implemented with the use of Eulerian technique and Lagrangian technique. In accordance with the results of numerical simulation the authors performed verification of parameters of a relaxation model of beryllium strength.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

DECOVALEX2019 Task C: Results of Step 2 modeling

The work for Step 1 performed at Sandia National Laboratories and reported in Section 7 has been updated to incorporate new data and to conduct new simulations using a new larger base case domain. The new simulations also include statistical analysis for different fracture realizations. A sensitivity analysis was also conducted to the study of the effect of domain size. A much larger mesh was selected to minimize boundary effects. The DFN model was upscaled to the new base case domain and the much larger domain to generate relevant permeability and porosity fields for each case. The calculations updated for Step 2 are described in Section 12.1. New calculations have also been conducted to model the flooding of the CTD and the resulting pressure recovery. The modeling includes matching of pressure and chloride experimental data at the six observation locations in Well 12M133. The modeling was done for the 10 fracture realizations. The Step 2 recovery simulations are described in Section 12.2. The Step 2 work is summarized in Section 12.3.

42 ENGINEERING↗

Development of an Interactive Valuation Model for Distributed Energy Resource Value: Cooperative Research and Development (Final Report)

The Oklahoma Office of the Secretary of Energy and Environment (OSEE) seeks to address perceived challenges and barriers to the deployment of distributed energy generation resources (DERs), including solar and other technologies, in the state of Oklahoma. The Scope of Work (SOW) associated with CRD-18-762 covers two tasks: (1) Interactive Valuation Model Requirements Document and (2) Consumer Protection Assessment. Follow-on work was completed under a separate CRADA (CRD-19-00788).

29 ENERGY PLANNING, POLICY, AND ECONOMY↗

Progress on Long-Term Objectives for the Development of Advanced Reactor Mechanistic Source Term Modeling and Simulation Tools

To assist both the advanced reactor industry and U.S. Nuclear Regulatory Commission (NRC) in the pursuit of reactor design and licensing, the U.S. Department of Energy (DOE) Nuclear Energy Advanced Modeling and Simulation (NEAMS) program has established a mechanistic source term (MST) research project under the auspices of the Multiphysics Applications technical area. MST analysis is central to the reactor licensing process and a focus of the NRC regarding their mission to provide reasonable assurance of adequate protection of public health and safety and environment. The MST research project is a collaboration between Argonne National Laboratory (Argonne) and Sandia National Laboratories (SNL) with a high-level objective to coordinate the development of comprehensive advanced reactor MST mod/sim capabilities to support risk-informed design and licensing decisions. As part of this effort, an MST mod/sim development pathway was developed in FY21, which outlines the high-level objectives and near-term tasks necessary to achieve the project objectives. Since publication of the development pathway, Argonne and SNL have focused initial efforts on addressing the “near-term tasks” outlined in the report, and the current work provides a status update of the progress achieved in FY22. This report is a progress update on 6 tasks supporting molten salt reactor (MSR) and sodium fast reactor (SFR) MST analyses which were initiated in FY22 as recommended high priority near-term tasks. These tasks were continued into FY23 as they also support previously recommended long-term development objectives to advance MST analyses for these advanced reactors.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗

Enhancement of HLW glass property-composition models

Since the WTP compositional space of HLW glasses is extremely large, development of HLW property-composition models is a multi-year task consisting of multiple phases. The primary focus of this work was to enhance the WTP HLW models of interest including PCT releases, spinel crystallization (T1%), viscosity, electrical conductivity, and TCLP-Cd response. Model development to predict nepheline formation upon CCC is the subject of a separate task. In particular, the earlier work has produced property-composition models for glass melt viscosity and glass melt electrical conductivity that showed good performance, while models for PCT releases and spinel crystallization (T1%) required improvement. Therefore, more efforts were directed in the present work to collect data and improve model performance for HLW glass PCT releases and spinel crystallization than for other properties. The present work is a continuation of earlier development phases and is responsive to the applicable Test Plan.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

Work Stealing and Persistence-based Load Balancers for Iterative Overdecomposed Applications

Applications often involve iterative execution of identical or slowly evolving calculations. Such applications require good initial load balance coupled with efficient periodic rebalancing. In this paper, we consider the design and evaluation of two distinct approaches to addressing this challenge: persistence-based load balancing and work stealing. The work to be performed is overdecomposed into tasks, enabling automatic rebalancing by the middleware. We present a hierarchical persistence-based rebalancing algorithm that performs localized incremental rebalancing. We also present an active-message-based retentive work stealing algorithm optimized for iterative applications on distributed memory machines. These are shown to incur low overheads and achieve over 90% efficiency on 76,800 cores.

persistence-based load balancing↗