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At least 1,189 records · Page 66

Assessment of SFR Wire Wrap Simulation Uncertainties

Predictive modeling and simulation of nuclear reactor performance and fuel are challenging due to the large number of coupled physical phenomena that must be addressed. Models that will be used for design or operational decisions must be analyzed for uncertainty to ascertain impacts to safety or performance. Rigorous, structured uncertainty analyses are performed by characterizing the model’s input uncertainties and then propagating the uncertainties through the model to estimate output uncertainty. This project is part of the ongoing effort to assess modeling uncertainty in Nek5000 simulations of flow configurations relevant to the advanced reactor applications of the Nuclear Energy Advanced Modeling and Simulation (NEAMS) program. Three geometries are under investigation in these preliminary assessments: a 3-D pipe, a 3-D 7-pin bundle, and a single pin from the Thermal-Hydraulic Out-of-Reactor Safety (THORS) facility. Initial efforts have focused on gaining an understanding of Nek5000 modeling options and integrating Nek5000 with Dakota. These tasks are being accomplished by demonstrating the use of Dakota to assess parametric uncertainties in a simple pipe flow problem. This problem is used to optimize performance of the uncertainty quantification strategy and to estimate computational requirements for assessments of complex geometries. A sensitivity analysis to three turbulent models was conducted for a turbulent flow in a single wire wrapped pin (THOR) geometry. Section 2 briefly describes the software tools used in this study and provides appropriate references. Section 3 presents the coupling interface between Dakota and a computational fluid dynamic (CFD) code (Nek5000 or STARCCM+), with details on the workflow, the scripts used for setting up the run, and the scripts used for post-processing the output files. In Section 4, the meshing methods used to generate the THORS and 7-pin bundle meshes are explained. Sections 5, 6 and 7 present numerical results for the 3-D pipe, the single pin THORS mesh, and the 7-pin bundle mesh, respectively.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗

ALE3D: An Arbitrary Lagrangian-Eulerian Multi-Physics Code

ALE3D is a multi-physics numerical simulation software tool utilizing arbitrary-Lagrangian- Eulerian (ALE) techniques. The code is written to address both two-dimensional (2D plane and axisymmetric) and three-dimensional (3D) physics and engineering problems using a hybrid finite element and finite volume formulation to model fluid and elastic-plastic response of materials on an unstructured grid. As shown in Figure 1, ALE3D is a single code that integrates many physical phenomena.

42 ENGINEERING↗

Code Verification Capabilities and Assessments in Support of ASC V&V Level 2 Milestone #6035

This document provides a summary of the code verification activities supporting the FY17 Level 2 V&V milestone entitled “Deliver a Capability for V&V Assessments of Code Implementations of Physics Models and Numerical Algorithms in Support of Future Predictive Capability Framework Pegposts.” The physics validation activities supporting this milestone are documented separately. The objectives of this portion of the milestone are: 1) Develop software tools to support code verification analysis; 2) Document standard definitions of code verification test problems; and 3) Perform code verification assessments (focusing on error behavior of algorithms). This report and a set of additional standalone documents serve as the compilation of results demonstrating accomplishment of these objectives.

97 MATHEMATICS AND COMPUTING↗

Scientific Computation Application Partnerships in Materials and Chemical Sciences, Charge Transfer and Charge Transport in Photoactivated Systems, Developing Electron-Correlated Methods for Excited State Structure and Dynamics in the NWChem Software Suite

Charge transfer and charge transport in photoactivated systems are fundamental processes that underlie solar energy capture, solar energy conversion, and photoactivated catalysis, both organometallic and enzymatic. We developed methods, algorithms, and software tools needed for reliable treatment of the underlying physics for charge transfer and charge transport, an undertaking with broad applicability to the goals of the fundamental-interaction component of the Department of Energy Office of Basic Energy Sciences and the exascale initiative of the Office of Advanced Scientific Computing Research.

14 SOLAR ENERGY↗

Institutional Transformation (IX) 2.5 Building Module Help Manual

The Institutional Transformation (IX) building module is a software tool developed at Sandia National Laboratories to evaluate energy conservation measures (ECMs) on hundreds of DOE-2 building energy models simultaneously. In IX, ECMs can be designed through parameterizing DOE-2 building models and doing further processing via visual basic for applications subroutines. IX provides the functionality to handle multiple building models for different years, which enables incrementally changing a site of hundreds of buildings over time. It also enables evaluation of the effects of changing climate, comparisons between data and modeling results, and energy use of centralized utility buildings (CUBs). IX consists of a Microsoft Excel® user interface, Microsoft Access® database, and Microsoft Excel® CUB build utility whose functionalities are described in detail in this report. In addition to descriptions of the user interfaces, descriptions of every ECM already designed in IX is included.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

Nebraska Integrated Carbon Capture and Storage Pre-Feasibility Study

In collaboration with the Nebraska Public Power District (NPPD), the Energy & Environmental Research Center (EERC) has conducted a pre-feasibility study for a commercial-scale carbon dioxide (CO 2 ) geologic storage complex in western Nebraska integrated with potential CO 2 capture at Gerald Gentleman Station (GGS). GGS is the largest coal-fired electricity-generating station in Nebraska, emitting 8.5 million metric tons (Mt) of CO 2 annually, and is located near the town of Sutherland. This pre-feasibility (Phase 1) project has been executed as part of the U.S. Department of Energy (DOE) CarbonSAFE program, a multiphase initiative to support the deployment of large-scale carbon capture and storage (CCS) projects. Each CarbonSAFE project is required to demonstrate the potential to capture and store at least 50 million tonnes (Mt) of CO 2 over a 25-year operational period. The EERC and NPPD established a coordination team to identify challenges to a potential Nebraska CCS project, comprising local stakeholder organizations, which met twice in Lincoln and via several Webinars, providing feedback and guidance throughout the pre-feasibility study. The EERC also secured the technical support of Schlumberger Carbon Services and Computer Modelling Group Ltd. (CMG). The project comprised four technical themes, all using published information sources. Regional and stakeholder analysis, including identification of sensitive environmental areas, potential resource conflicts, and strategies for public outreach. A review of geographic and socioeconomic characteristics, in combination with geologic characterization in the subbasinal analysis described below, identified an area to the southwest and within a 75-mile radius of GGS as the most prospective for development of a storage site. This area largely avoided lands with protected status such as wetlands. A public outreach plan has also been developed for implementation in any further phases of CCS assessment in western Nebraska, for example a CarbonSAFE Phase 2 feasibility study. Scenario analysis, addressing economic and regulatory factors. GGS is the only single major source of CO 2 emissions capable of satisfying the CarbonSAFE 50-Mt scale requirement within the study region. Chemical absorption using amines was identified as the most viable technology for postcombustion CO 2 capture at GGS. The total cost of a CCS project at GGS was estimated to be between $67/tonne CO 2 for capture and auxiliary boiler to minimize parasitic load and $70/tonne CO 2 avoided cost, using the Carnegie-Mellon University Integrated Environmental Control Model (IECM). The total avoided cost included the capture facility and parasitic load, a flue gas desulfurization plant required for the use of amine solvent technology, transport via pipeline, and dedicated storage infrastructure. Nebraska has no legislation in place to address typical CCS-specific issues, for example pore space ownership for storage. Long-term liability, therefore, falls under the U.S. Environmental Protection Agency Underground Injection Control (UIC) Class 6 program regulations. Subbasinal analysis, addressing the potential for a dedicated subsurface “container” to store the required 50-Mt quantity of CO 2 . Modeling and simulation studies identified an area to the southwest of GGS with the potential for storage of 50 Mt CO 2 in the Cloverly Formation, comprising sandstones with interbedded and intermingled shales. The area of review (AOR) that would be required for monitoring under a Class VI operating permit was estimated to be as high as 400–700 square miles, due to uncertain pressure effects. The viability of this storage option is subject to significant uncertainty due to the relatively limited amount of existing characterization data available to the pre-feasibility study; for example, dynamic simulation indicated that the proposed storage rate might require as little as two or as many as 14 injection wells. A key uncertainty is the relative proportion and distribution of sandstone and shale within the Cloverly Formation. A preliminary, semiquantitative risk assessment also suggested uncertainty over storage capacity and injectivity constitute the most significant project risks at this pre-feasibility stage. No assessed risks were considered to rule out the possibility of a project moving to deployment. National Risk Assessment Partnership (NRAP) validation, using software tools developed by the National Energy Technology Laboratory (NETL) to assess risks associated with the potential 50-Mt CO 2 storage complex. NRAP tools were used to assess hypothetical leakage scenarios. Results broadly supported the conclusion of the semiquantitative risk analysis – for example, even worst-case analysis of theoretical leakage scenarios found limited migration rates and impacts. In summary, the work undertaken in this Phase 1 pre-feasibility study has shown that western Nebraska has potential to host a commercial-scale CCS project, including a dedicated storage “container” for 50 Mt of CO 2 . However, the following key challenges would need to be overcome: The business case for deploying CCS projects is uncertain; recently announced federal tax credits and sales of CO 2 for enhanced oil recovery may not cover the full costs of a CCS project at GGS, as estimated by this pre-feasibility study. The potential 50-Mt CO 2 dedicated storage container defined in this pre-feasibility study should be regarded as having a relatively low level of readiness to support a CCS project. Public outreach would be a vital element in western Nebraska, where sensitivities around such environmental issues as water resource protection and pipeline construction would need to be carefully addressed.

54 ENVIRONMENTAL SCIENCES↗

PIPER: Performance Insights for Programmers and Exascale Runtimes

During the lifetime of the project, the PIPER at the University of Utah worked in collaboration with the team from the partner institutions to establish a set of software tools for analyzing and improving the performance parallel computing tools. These activities complement and complete the work performed by the other X-Stack 2 projects with the definition of a common data models and computing infrastructures, which have been a central element in the targeted performance analysis pipeline and new programming models. The University of Utah team have focused mainly on developing data analysis and visualization systems to facilitate exploration, comparison and evaluation of the behavior and performance of complex algorithms in modern HPC infrastructures. This is involved several demonstrations of the performance achieved and presentation of the results in a way that facilitates the users understand bottlenecks and ways to overcome them. One major focus of the University of Utah activities has been the analysis of the performance characteristics of Fat-Tree and Dragonfly topology networks. The work involved the development of practical visualization systems especially in collaboration with the team at LLNL, and published several papers and gave invited talks at prestigious venues such as the Salishan Conference on High-Speed Computing or the International Conference on High Performance Computing, Data, and Analytics. In addition, the university of Utah team has advanced the core activities on analyzing the performance characteristics of I/O and other data movement systems and their practical use for scaling Uintah and other simulation codes poised for use in the exascale computing environments of the future.

42 ENGINEERING↗

Feature Detection From LiDAR Point Cloud and Aerial Imagery Using Distance Dependent Chinese Restaurant Process [Slides]

It is possible to integrate data captured by UAS from multiple data modalities spatially. We can detect features by combining information across images and LiDAR point clouds. Performance issues exist with the current algorithms in place & could be improved. We hope to test it for at least 500 iterations. Post processing of data takes enormous efforts in case of data generated by proprietary software tools…We intend to develop a better framework for seamless integration.

97 MATHEMATICS AND COMPUTING↗

Computational Studies of Solid Stoppers for Generating Intense Exotic Radioactive Ion Beams at FRIB

Low-emittance beams of rare isotopes at low energies (less than 3 MeV/u) are required for many high precision measurements in nuclear science research. Such beams will be produced at the Facility for Rare Isotope Beams (FRIB) by first slowing down and thermalizing or stopping fast fragmentation beams, and subsequently reaccelerating them to the required energies for experiments. The use of a solid stopper has the potential to provide high-intensity reaccelerated beams of many species. We performed simulations of the processes critical for generating beams in solid stoppers, including beam heating, external heating, diffusive release, effusive transport, and surface sticking. Using a variety of software tools, we investigated the viability of numerous solid stopper system designs for FRIB. We present our computational approach, the physical processes we modeled, the codes we used, and our results. We conclude with a proof-of-concept solid stopper system that releases ions sufficiently quickly for experiments with unstable reaccelerated beams at FRIB.

47 OTHER INSTRUMENTATION↗

Bird-Strike Analysis Using Eulerian Peridynamic Formulation

The purpose of this project between Sandia National Laboratories (SNL) and The Boeing Company (Boeing) was to develop an analysis capability for predicting the loads on aircraft structures due to the inflight impact of birds. The main technical accomplishment was the development and delivery to Boeing of a new software tool that predicts the pressure over a structure's surface area, as a function of time and impact conditions, during the impact. The benefit to Boeing, and to government agencies such as NASA and the FAA, is an accurate tool to help design structures to withstand potentially catastrophic damage due to bird strike.

42 ENGINEERING↗

Certification and Rating of Attachments for Fenestration Technologies

In the U.S., windows still represent a significant energy savings opportunity in residential and commercial buildings, and for decades the United States Department of Energy (DOE) has funded fenestration software tools, analysis, studies, and the National Fenestration Rating Council (NFRC). Despite significant developments in window technology and recognition of efficient products, studies conducted by the U.S. Energy Information Administration and Pacific Northwest National Laboratory (PNNL) found that approximately 64% of U.S. homes currently have inefficient windows. Window attachments (interior and exterior blinds, shades, storm windows, awnings, shutters, etc.) can offer a more cost-effective option to improve the energy performance of residential and commercial windows. In previous years, the window attachment industry attempted to work with the NFRC to generate a window attachment rating program, but was unable to access funding or technical resources necessary to address window attachments, which added many levels of complexity on top of NFRC’s scope of windows and glazing. Starting in 2014, the DOE Office of Energy Efficiency and Renewable Energy (EERE) funded the Window Coverings Manufacturing Association (WCMA) to develop the Attachments Energy Rating Council (AERC) along with policies and procedures to deliver an unbiased, credible, comparable, relevant, and cost-effective window attachment energy rating program for the residential and commercial sectors over a four-year period. This project was created because there were no consistent and credible performance rating mechanisms for assessing the energy performance of window attachments. Without a standardized approach, consumers found it difficult to make informed and comparative decisions about the energy performance of window attachments, and utilities faced challenges offering incentives for energy-efficient attachments. The goal of this project was two-fold: to develop procedures to rate and certify the energy performance of window attachments and to create an educational, consumer-facing Certified Products Website (CPW) to help consumers and other stakeholders make more informed window attachments purchasing decisions.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

Particle/Ray Interaction Simulation Manager (PRISM) Assessment Report

The Particle/Ray Interaction Simulation Manager (PRISM) is a software tool developed by Triple Ring Technologies (TRT), http://www.tripleringtech.com/, under a Small Business Innovation Research Award from the Department of Homeland Security (DHS) to investigate the utility of simulations in X-ray-based explosive detection systems. The PRISM tool is intended to provide a standardized and intuitive user interface to control and configure realistic simulations of X-ray imaging systems. It includes a command-line interface that enables the user to configure simulated X-ray radiography and computed tomography (CT) systems. It allows the import of computer-aided design (CAD) models of objects and it supports Monte Carlo simulation engines such as GEANT4. PRISM is designed to simulate realistic X-ray projection images including scatter, noise, and various detector effects such as quantum efficiency, lag, and veiling glare. At the request of DHS, the authors assessed PRISM’s capabilities to simulate data generated by a Micro-CT test-bed system (MCT-TB) housed at the Lawrence Livermore National Laboratory (LLNL). This document describes the results of that assessment.

42 ENGINEERING↗

An Initial Investigation of the Design Challenges Associated with Reliable 100GigE Packet Capture

Network security researchers often rely on Emulytics TM to provide a way to evaluate the safety and security of real world systems. This work involves running a large number of virtual machines on a distributed platform to observe how software and hardware will respond to different types of attacks. While Emulytics TM software such as minimega provide a scalable system for conducting experiments, the sheer volume of network traffic produced in an experiment can easily exceed the rate at which data can be recorded for offline analysis. As such, researchers must perform live analytics, narrow their monitoring scope or accept that they must run an experiment multiple times to capture all the information they require. In support of Sandia's commitment to Emulytics TM , we are developing new storage components for the Carlin cluster that will enable researchers to capture significantly more network traffic from their experiments. This report provides a summary of Haoda Wang's initial investigation of how new AMD Epyc storage nodes can be adapted to perform packet capture at 100Gbps speeds with minimal loss. This work found that the NVMe storage capabilities of the Epyc architecture are suitable for capturing 100Gbps Ethernet traffic. While capturing traffic with existing libraries was surprisingly challenging, we were able to develop a DPDK-based software tool that recorded network traffic to disk with minimal packet loss.

97 MATHEMATICS AND COMPUTING↗

PTT System Performance Evaluation in 3-D Imaging of AM Components

Additive manufacturing (AM, or 3D printing) for commercial nuclear energy applications is an emerging method for cost-efficient manufacturing aimed at replacing aging nuclear reactor parts and reducing costs for new construction. Because of the geometry of metallic structures of interest for nuclear applications, which consist of planar primitives with no symmetry of revolution, limited options are available for non-destructive evaluation (NDE) either during or post manufacturing. Known material flaws in AM include low density regions consisting of nonsintered powder, which have to be detected to ensure the safety of long-term performance nuclear reactor components. As a solution to NDE of AM, we are developing pulsed thermal tomography (PTT) models and depth inversion algorithms for 3D imaging. PTT has many advantages because the method is non-contact and allows for in-service, NDE of AM nuclear reactor parts. By analyzing transients of surface temperature response due to internal thermal resistances, one can obtain 3D reconstructions of material effusivity using a unique inversion algorithm developed at Argonne. This study investigates the capability of PTT in imaging several AM structures fabricated from Inconel 718 (IN718) feedstock. The AM structures have complex geometry, but do not have calibrated internal defects. The objective is to determine PTT settings, such as the total integration time, for imaging of representative AM structures. A new FLIR X8500sc IR camera with higher spatial resolution (1280x1024 at 181Hz frame rate) was integrated into the PTT laboratory setup. Software tools were developed to ensure compatibility of new camera files with legacy effusivity reconstruction codes. The new camera was used to obtain 3-D reconstructions of IN718 nozzle plate and a particle filter plate. The results demonstrate the capability of PTT in 3- D imaging of complex geometry AM structures. Further, increased resolution imaging is achieved compared to prior results using older FLIR SC4000 IR camera. In addition, preliminary studies were conducted on developing image processing algorithms for automated detection of flaws. Initial demonstrations are shown for segmentation of PTT images of flat bottom hole (FBH) specimens. Imaging of FBH specimens was described in a prior report. Intermediate results demonstrated in this report will be developed further in detection of flaws in AM specimens.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗

Bayes Inference Engine (BIE) Test Plan: TiltConeBeamCombo

The Bayes Inference Engine (BIE) is a general software tool intended to be used primarily in the analysis of radiographic data for density. An analysis is set up in the BIE by representing the problem as a collection of modules called glyphs. All glyphs to be used in creating the forward model of the experiment will be tested separately for a range of inputs. The testing of the adjoint code is performed in a separate document.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

Production Operations Management System

The Production Operations Management System (POMS) is a set of software tools which allows production teams and analysis groups across multiple Fermilab experiments to launch, modify and monitor large scale campaigns of related Monte Carlo or data processing jobs. POMS provides a web service interface that enables automated jobs submission on distributed resources according to customers’ requests and subsequent monitoring and recovery of failed submissions, debugging and record keeping. POMS interfaces with existing HEP data access, processing, movement and monitoring tools at Fermilab, including Jobsub, dCache, SAM, and FIFEmon, and in combination with them handles the creation and tracking of unique filenames for multistage campaigns. A flexible, interactive GUI interface exists as part of the system to visualize campaign stages, parallelization tracks and data flow. An important feature of POMS is a one-to-one connection between the GUI campaign visualizer and a text based representation of the complete campaign configuration. An extensible library of template campaign configurations is available. The templates are user modifiable and map cleanly to and from the GUI description of the campaign. Future releases of POMS will interface with Rucio for file movement.

97 MATHEMATICS AND COMPUTING↗

Energy Intensity Baselining & Tracking Summary Guide: Better Buildings, Better Plants

The Department of Energy (DOE) Better Plants (BP) program is a voluntary energy efficiency leadership initiative for U.S. manufacturers that encourages companies to reduce their energy intensity, typically by 25% within a ten-year period. BP partners are required to report their progress to the DOE annually by establishing an energy intensity baseline and tracking their energy consumption. BP partners receive access to a Technical Account Manager (TAM), DOE resources including software tools and trainings, and recognition when they achieve their goal. This summary guide provides the basics of baselining and tracking your energy intensity. For a more information and special considerations, please see the Energy Intensity Baselining and Tracking Guidance 2020.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗