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At least 1,747 records · Page 97

Combining Experiments and Simulations of Extraction Kinetics and Thermodynamics in Advanced Separation Processes for Used Nuclear Fuel

This 3-year project was a collaboration between University of California Irvine (UC Irvine), Pacific Northwest National Laboratory (PNNL), Idaho National Laboratory (INL), Argonne National Laboratory (ANL) and with an international collaborator at ForschungZentrum Jülich (FZJ). The project was led from UC Irvine under the direction of Profs. Mikael Nilsson and Hung Nguyen. The leads at PNNL, INL, ANL and FZJ were Dr. Liem Dang, Dr. Peter Zalupski, Dr. Nathaniel Hoyt and Dr. Giuseppe Modolo, respectively. Involved in this project at UC Irvine were three full time PhD graduate students, Tro Babikian, Ted Yoo, and Quynh Vo, and one MS student, Alba Font Bosch. The overall objective of this project was to study how the kinetics and thermodynamics of metal ion extraction can be described by molecular dynamic (MD) simulations and how the simulations can be validated by experimental data. Furthermore, the project includes the applied separation by testing the extraction systems in a single stage annular centrifugal contactor and coupling the experimental data with computational fluid dynamic (CFD) simulations. Specific objectives of the proposed research were: Study and establish a rigorous connection between MD simulations based on polarizable force fields and extraction thermodynamic and kinetic data. Compare and validate CFD simulations of extraction processes for An/Ln separation using different sizes (and types) of annular centrifugal contactors. Provide a theoretical/simulation and experimental base for scale-up of batch-wise extraction to continuous contactors. We approached objective 1 and 2 in parallel. For objective 1 we started by studying a well established extraction system with a relatively simple extraction mechanism, namely tributyl phosphate. What we found was that well optimized simulations can inform experiments and new information on TBP behavior was presented in this project, as well be discussed below. The second objective proved a larger challenge and most of the efforts were devoted to experimental studies.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

Symposium NM09: Novel Approaches and Material Platforms for Plasmonics and Metamaterials

The goal of this symposium was to present through a series of invited lectures from world-leading experts in the field, an overview of the current state-of-the-art in nanophotonics over a broad swath of topics, ranging from metal-based plasmonics to dielectric species. It was focused on investigations into novel resonator designs and into alternative materials. Over the 10 years it has been held, this symposium has provided an excellent education forum to participating students and postdocs through the direct interaction with world-renowned researchers, the opportunity to present their research results in both poster and oral form, the full-day tutorial session before the conference, and in listening to the results of other research groups. DOE funding provided need-based travel support to students and invited speakers who had financial difficulties in participating in the MRS meeting. The organizers made every effort to publicize the available support and were strongly committed to encourage participation from under-represented groups including women and minorities. The organizers are grateful to DOE for its support.

36 MATERIALS SCIENCE↗

Organic Speciation and Interactions in ALSEP. One Step Partitioning Process of MinorActinides, Lanthanides, and Fission Products

Research conducted in this project focused on speciation characterization of the ALSEP extraction system (similar to the TALSPEAK-like application) which addresses recovery of minor actinides and lanthanides from PUREX raffinate. The ALSEP (Actinide-Lanthanide Separation) system proposes a trivalent minor actinide/lanthanide group extraction followed by a selective actinide strip to effectively partition minor actinides, lanthanides, and other fission products. The group extraction is achieved by a mixed organic solvent, combining acidic and neutral extracting ligands. The objective of this work is investigation the interactions of the acidic and neutral ligands with each other in the extraction organic solvent and with desired metals. Four combinations of a cation-exchange ligand (either HDEHP or HEH[EHP]) and a neutral solvating ligand (either TODGA or T2EHDGA) in n-dodecane were studied. Interligand dimers in these combinations were investigated with NMR and FTIR, the strongest interaction was observed for HDEHP+TODGA and weakest for T2EHDGA+HEH[EHP]. Complexes of the trivalent Am and lanthanides Nd, Eu, Ho, Pr in these binary ligand mixtures were probed with spectroscopic (UV–vis, time-resolved fluorescence, XAFS and SAXS-spectroscopies) and extraction (Job’s plot, slope analysis) methods; co-extracted water and nitric acid were analyzed by titration methods. Comparison of the collected spectra showed significant shifting for both DGA ligands with HDEHP, while both combinations of HEH[EHP]+DGA displayed much smaller spectral changes. Data were modeled with HypSpec program, and stability constants for extracted complexes were calculated. Aggregation in these systems were studied by SAXS (small-angle X-ray scattering) spectroscopy and interfacial tension, size of aggregates were measured. Two PhD students graduated (2017, 2018) and one student continues her PhD study.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

Advanced Models for Nondestructive Evaluation of Aging Nuclear Power Plant Cables

Background: Nuclear power plant (NPP) cables must function correctly for proper power supply and control of the nuclear reactor. This is especially important for public and environmental safety at critical times such as during reactor shut-down following loss of coolant. Over extended periods of service, the cable insulation and jacket polymer materials suffer from degradation due to exposure to environmental stressors such as heat and ionizing radiation. The focus of this project has been the development of detailed descriptions of the way in which insulation polymers degrade, from a materials science perspective, and the development of new electrical techniques to monitor cable polymer condition nondestructively. Objectives: The objectives of this project have been to i) perform detailed characterization experiments upon cable insulation polymers that have experienced thermal and radiation exposure mimicking that received during NPP operation, including the exploration of novel cable nondestructive evaluation methods; capacitive, THz and infrared methods; ii) identify the most sensitive indicators of aging in these materials, and iii) develop advanced, validated models describing microstructural and chemical changes that are observed in cable insulation polymers due to thermal and radiation exposure. Methods: Accelerated aging was performed on the two most common United States NPP cable insulation polymers (cross-linked polyethylene (XLPE) and ethylene propylene rubber (EPR)) under various conditions of elevated temperature and gamma radiation dose. Aging mechanisms were elucidated through extensive thermal, mechanical and microscopic characterization of the aged samples, and materials modeling. Dielectric and IR spectra were measured on pristine and aged samples. Data was analyzed statistically, via multiple linear regression, partial least squares and probabilistic neural network approaches. Impact: Extant cable monitoring techniques do not deal successfully with all polymer types. This research has laid a foundation upon which new electrical nondestructive test methods for cable polymer condition monitoring may be developed, hence launching the development of new test methods for cable insulation monitoring based on measuring electrical rather than mechanical parameters. Collaboration: This project has benefitted from collaboration between experts in materials science and engineering, materials modeling, electrical engineering, and nondestructive evaluation. The majority of the characterization measurements were carried out at Iowa State University. Materials modeling was carried out primarily at Washington State University. Irradiation of samples took place at Pacific Northwest National Laboratory (PNNL), where a student intern from Iowa State was hosted for one summer, setting up the aging experiments. A research student from the University of Bologna, Italy, joined the project for their thesis research at Iowa State University with samples provided by PNNL. The project benefitted from regular involvement of senior engineers in US-based industry partners. Project investigators presented findings at various national and international conferences and workshops.

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗

Asparagine synthetase gene regulatory network and plant nitrogen metabolism

This DOE project concerns the molecular mechanisms by which plants coordinate carbon (C) and nitrogen (N) metabolism. Specifically, it focuses on a histone methyltransferase protein that targets C/N-metabolism genes for chromatin modifications. How the dynamic changes of chromatin regulate energy metabolism in response to developmental and environmental cues is a new area of study. We have filled this knowledge-gap with our studies of SDG8, a histone methyltransferase, that targets light, C and N metabolism genes. We aimed to understand how plants allocate C resources to assimilate inorganic N onto C-skeletons -- the most energy-intensive pathway in plants – in order to balance energy production and consumption in a changing environment. In order to achieve more C-efficient N-storage under low energy conditions, plants convert assimilated N from “reactive” Gln (C5:N2) into “inert” Asn (C4:N2) through the enzyme ASN1. To identify regulatory factors in this pathway, we used the ASN1 promoter in a genetic selection and discovered SDG8, a histone methyltransferase. We discovered that histone modification by SDG8 coordinates the expression of genes involved in energy generation (light-harvesting and C fixation) with energy consumption (N assimilation and sulfur metabolism). We used this opportunity to explore how histone modifications control energy metabolism genome-wide. Our aims focus on various levels of the regulation of energy related genes at the level of: 1) Chromatin; 2) Transcription; and 3) Metabolites of the C/N regulatory network. Specifically, we asked: 1) How does histone methylation regulate energy metabolism during the N response? 2) How does histone methylation control transcription of the energy metabolism genes? And 3) how does the histone methyltransferase SDG8 and other TF regulators affect C/N metabolism and N use efficiency? Our study indicates that N supply triggers genome-wide changes in chromatin modification via the histone methyltransferase SDG8 which impacts on gene expression, RNA processing, chlorophyll synthesis, N uptake and metabolism. Our study thus revealed a previously overlooked layer of chromatin regulation during nutrient signaling. In broad terms, our study provides a framework to understand how chromatin modifications influence responses to environmental changes and provides unique opportunities for breeding and engineering resilient crops with better performance in the current climate model. Accomplishments AIM 1 CHROMATIN: Role of histone methylation in the ASN1 energy metabolism network. This aim focuses on understanding the role of chromatin modification in response to the environment. We studied the targeting mechanism of histone methylation by SDG8, in particular the role of the CW domain in reading histone methylation status. We also began to study the effect of nitrogen-treatment on genome-wide chromatin modifications in WT and sdg8 mutant plants. AIM 2 TRANSCRIPTION: Transcription control of the ASN1 energy metabolism network. This aim investigated whether SDG8 and the histone modification it mediates affects mRNA processing. We performed genome-wide profiling that uncovered that histone methylation by SDG8 affects the co-transcriptional RNA processing of downstream genes involved in energy and photosynthesis. AIM 3 METABOLISM: A gene regulatory network controlling energy, C/N metabolism and N use efficiency. In Aim 3A, we showed that SDG8 affects the chromatin modification and expression of a transcription factor, CCT, which in turn affects the regulation of carbon responsive genes. In Aim 3B we showed that C and N metabolism is perturbed in the sdg8 mutant through differences in the chlorophyll content, free amino acids, and N uptake. Project activities In Aim 1, we uncovered that the histone methyltransferase SDG8 affects chromatin modification in response to N treatments. The N treatments causes changes in the H3K36me3 distribution off ~200 genes in WT plants, while the N-triggered changes in H3K36me3 of these genes is abrogated in the sdg8-5 mutant. The functional annotation of these 200 genes shows significant enrichment of N-related pathways. Overall, our study suggests that SDG8 mediates chromatin-level adaption of functionally relevant genes in response to changes in N. In Aim 2, we tested if SDG8 plays a role in transcriptional elongation and/or RNA processing. We detected more N-triggered isoform shifting events in the sdg8-5 mutant than in WT, which provides supports for SDG8 being required for proper RNA processing in response to N signaling. In Aim 3, we identified the gene network controlled by a CCT transcription factor under the epigenetic control of SDG8. Isoform abundance of the CCT protein is regulated by SDG8, which leads to an altered response of energy related genes to N level changes. Using physiological, metabolic and genetic approaches, we found that responses to N, including chlorophyll accumulation, N uptake and free amino acids, are altered in sdg8 mutants. Finally, this project provided training to a high school student who performed experiments on the complex interaction of photosynthesis and N availability. The student was named a semi-finalist in both the Regeneron and Siemens National Science competitions for her work.

59 BASIC BIOLOGICAL SCIENCES↗

Sun Grant/DOE Regional Feedstock Partnership: Final Technical Report

The U.S. Department of Energy (DOE) and the Sun Grant Initiative initiated the Regional Feedstock Partnership (referred to as the Partnership) in 2007 primarily to address information gaps associated with the likelihood for realization of the sustainable and reliable production of a billion-tons of biomass annually to support the U.S. bioenergy industry by the year 2030. Publication of The Technical Feasibility of a Billion-Ton Annual Supply (Perlack et al., 2005) in 2005, with its associated yield assumptions, led to the realization that the yield goals and assumptions utilized in that analysis required careful validation. To achieve the overall goal of validating key yield assumptions, the following objectives were developed: 1. Establishment of replicated field trials across regions to determine the impact of crop residue removal (primarily corn and small grains) on future grain yields and soil health. 2. Establishment of replicated field trials of some of the most promising dedicated energy crops (herbaceous annuals and perennials, as well as woody perennials) to demonstrate the potential performance of these feedstocks across the U.S. 3. Assessment of feedstock resources to be used to estimate a sustainable national supply potential. Teams composed of representatives from Land Grant Universities, USDA ARS, DOE National Laboratories, industry, and other federal agencies were identified and assembled to address each of these objectives. For Objective 1, members of the USDA ARS’ Resilient Economic Agricultural Practices (REAP) team combined with university personnel to leverage on-going work and established new trials to determine sustainable corn residue removal rates. In addition, universities across the continental U.S. conducted surveys of published past research to define parameters for the use of cereal grain residue (primarily wheat) as a biomass feedstock. For Objective 2, and based on input from DOE, USDA, Land Grant university scientists, and others, several herbaceous and woody energy crop species were selected for new or further evaluation across wide geographic areas as cellulosic feedstock sources. Species teams were organized to assess the yield potential of candidate herbaceous feedstocks including sorghum, energycane, Miscanthus x giganteus (hereafter referred to as miscanthus), switchgrass, and mixed perennial species (primarily grasses and some legumes) on Conservation Reserve Program (CRP) land. Woody species will be critical components of the bioenergy sector; therefore, species teams were also organized for shrub willow and hybrid poplar (Populus spp.). Field trials of each species were utilized to determine yield potential across the U.S. For Objective 3, a GIS resource team was organized with representatives from each of the five Sun Grant regions. While some regional assessments were made, the multi-institutional team decided that the group from Oregon State University would utilize their PRISM ELM model to estimate national yield potential of the various species evaluated. The following are key outcomes and impacts • The Partnership demonstrated the production potential of diverse herbaceous and woody feedstocks across much of the U.S. for 5-7 consecutive growing seasons. Long-term studies such as this are not commonly possible due to limitations in funding cycles. • Long-term field trials were valuable in demonstrating the importance of agronomic management practices and genetic resources to yield of sorghum, switchgrass, miscanthus, energycane, CRP mixed perennial grasses, poplar, and willow. • National yield potential maps were developed for all species evaluated in the Partnership. • Sustainable corn stover removal rates were quantified for use by producers, harvesters, and commercial lignocellulosic biorefineries. • Data from the Partnership field trials not only validated initial Billion Ton estimates, but were instrumental in developing both the Billion Ton Update in 2011, and especially the 2016 Billion Ton Report. • The Partnership provided the opportunity to assemble and conserve a poplar germplasm collection that contains more than 20,000 clones for use in breeding programs. New clones resulting from crosses made using this germplasm collection have resulted in significantly improved cultivars that could be scaled up and deployed. • Further validation of improved yields of new varieties/cultivars of biomass sorghum, energycane, hybrid poplars, and shrub willows was produced by the Partnership. • The Partnership demonstrated the potential of energycane in northern parts of the southeastern U.S., particularly in relation to sugarcane varieties. • For certain feedstocks (e.g., CRP mixed grasses, switchgrass, willow, and poplar), production economics were ascertained through Partnership field trials. • Biomass samples collected as part of the Partnership are also being used to populate Idaho National Laboratory’s Bioenergy Feedstock Library. • Because of the size and scope of the Partnership, workforce development was a key component and outcome. Numerous undergraduate students (25), graduate students (15 MS and 8 PhD), and postdoctoral researchers (7) were trained by Partnership participants. This will help to prepare individuals for careers in the emerging fields of plant breeding, biomass production, feedstock supply logistics, and biomass conversion processes. • More than 130 scientific publications have been authored by Partnership team members. Numerous other presentations, outreach publications, book chapters, and websites have also been developed to further the continued development of the bioeconomy.

09 BIOMASS FUELS↗

External Events P-204

Familiarize students with terminology and methodology to understand external event risk analysis. Enable students to understand external event analysis submittals from licensees History and progression of external events analysis. Overview of how external events are incorporated into SAPHIRE Level 1 model

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗

Hypothesis-Based Structural Biology in the High School Classroom

High school students from Shelter Island High School (a small rural district on Shelter Island N.Y. nestled between the Twin Forks of Long Island) are using rotein Data Bank data to answer questions about methylenetetrahydrofolate reductase (MTHFR) (3FSU, 1ZP3), an enzyme implicated in many human diseases. Students Francesca Frasco (class of 2018), Emma Gallagher, and Lauren Gurney are part of a multi-year research class.

59 BASIC BIOLOGICAL SCIENCES↗

Dynamics of X-pinches Powered by a Capacitor Bank

X-pinches are formed by crossing two metal wires in the shape of the letter ‘X’ between the electrodes of a pulsed power device. The plasma generated then evolves in complex ways and has been the subject of many experiments and simulations, both as a plasma object and for its use as a source of intense soft x-rays, of interest to high energy density plasma (HEDP) studies. The dynamics of the x-pinch that lead to the emission x-ray photons begin soon after this initial explosive phase, resulting in the formation of a micro z-pinch (≤ 300 µm long, ~100 µm diameter) at the crossing point. If the current is high enough, then a subsonic plasma implosion in the micro z-pinch begins, which creates a high density, high temperature plasma. These x-pinches have been typically studied at the nanosecond time scale (rise-time $τ_r ≤ 100 ns, dI/dt > 1 kA/ns$). The microsecond x-pinch ($I_p~350 kA, τ_{1/4} = 1 µs, 0.3 kA/ns$) allows a different parameter space to be studied that compliments HEDP studies in the nanosecond regime (with an attendant lower hard-radiation hazard) but it also creates plasma conditions that are interesting in their own right, with features that make it a good model for studying the hydrodynamics of astrophysical jets, for example. With high electron density and temperatures pushing close to 0.5 keV, it is relevant for high energy density studies and provides a suitable test bed for the spectroscopy of highly ionized atoms. The aim of the original proposal was to initiate a new experimental plasma research program at Florida A&M University with three main objectives: (1) To create x-pinch plasmas from different materials using a direct capacitor bank discharge and to study the dynamics of the high-density plasmas and their associated soft x-ray emission properties and potential applications. (2) Understanding the nature of the supersonic plasma jets observed in the mid-plane of the microsecond x-pinch and their relevance as a laboratory model for studying astrophysical jets. (3) To provide a research platform to support the education of under-represented undergraduate and graduate students at Florida A&M University and to provide training in high energy density laboratory plasma physics. Each of the main objectives has been met and results of the work have been published in refereed journals or presented at several scientific meetings. A number of students both undergraduate and graduate have participated in the research program in a hands-on way and have thereby acquired training in high energy density physics. The success of the work can also be measured in two PhD dissertations (one of which is still in progress). The acquisition of important research equipment and instrumentation means that the work can continue in some fashion.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

UW Translational Imaging Biomarker and Therapeutic Development

The development and validation of radiotracers is a critical step in the clinical translation of molecular imaging and theranostics to support personalized medicine. The proposed program is to support such efforts by an interdisciplinary team of investigators at the University of Washington (UW) and Fred Hutchinson Cancer Research Center (FHCRC) and to provide opportunities for trainees to learn the spectrum of translational research in imaging biomarkers and therapeutic development. The proposed translational research projects include "Preclinical Evaluation of PET Imaging for Use in the Translation of Targeted Alpha Therapy of Blood-Related Cancers to Clinical Studies" (Project 1-Wilbur, leader); "Hypoxia Imaging: Radiopharmaceuticals, Preclinical Studies, Mechanisms and Clinical trials" (Project 2-Krohn, leader); and "Diagnostic Applications of Radiolabeled Biologics in Solid Tumors" (Project 3-Minoshima, leader). These projects use radiotracers with long half-lives, such as F-18, Zr-89, I-124, and At-211, that can potentially be handled commercially if translation research is successful. The proposed research method is to use an interdisciplinary 'team' of expert investigators and trainees working on a specific project for 1 or 2 years along the timeline and milestones set by the Program Directors. Each team includes 1) a clinician expert; 2) a radiochemistry expert; 3) an imaging or radiation therapy expert; 4) a physicist; 5) trainees; and 6) a UW technology transfer officer. Two groups of trainees will be involved: clinical and basic science (radiochemistry) trainees. Clinical trainees will be recruited from 3 training programs: Nuclear Medicine Resident Program; Radiology Residency Program; and Residency Program in Radiation Oncology. Basic science trainees will be graduate students from degree-awarding departments (chemistry, material sciences, bioengineering) or post-doctoral students (radiology, radiation oncology, or collaborating departments). A goal of training is to develop future investigators who will be able to conduct independent translational research with knowledge and expertise earned in this interdisciplinary team environment. To address clinically relevant questions, the program will organize regular brainstorming meetings participated by clinicians from various medical disciplines; program investigators; trainees; technology transfer officers to discuss medical questions, relevant targets, and technical feasibility. UW provides outstanding research and clinical facilities and resources that can be accessed by investigators. The Departments of Radiology and Radiation Oncology at UW have been at the forefront of translational imaging and therapeutics research efforts in cancer, neurological disorders, and cardiovascular diseases. This funding opportunity will solidify ongoing efforts of interdisciplinary collaborations at UW into a cohesive program that will train a new generation of investigators. This will, in turn, accelerate the translational potential of new radiotracers by rapid developments of proof-of-concept and first-in-man studies along with in vivo validations in a clinically relevant context.

62 RADIOLOGY AND NUCLEAR MEDICINE↗

Novel, Low-Cost, Light-Weight High Efficiency (H*10 Capable) Neutron Detector-Dosimeter

The goal of this project was to design, develop and validate a novel, spectroscopy enabled H*(10) neutron dosimetry system based on the tensioned metastable fluid detector (TMFD) sensor technology. The project team consisted of staff from Oak Ridge National Laboratory (ORNL), Purdue University (PU) and Sagamore Adams Laboratories, LLC (SAL). PU-SAL staff were tasked with the design, development, construction and testing of the H*TMFD hardware and software, along with developing the control and data acquisition software for comparison of predictions from H*TMFD against a commonly accepted and widely used industry standard system; for this project, the Li-I detector coupled to bonner spheres (LiI-BSS) system manufactured by Ludlum, Inc. was utilized as the reference (“gold”) standard – similar in terms of neutron spectroscopy enablement to another industry recognized, albeit, significantly higher cost (est. $300K) system referred to as “ROSPEC” (from BTI, Inc., which was not available for this project). ORNL staff were tasked with providing field-relevant guidance, apparatus and facilities for acquiring data against calibrated neutron sources, and comparing results of H*TMFD against LiI-BSS system predictions in a series of blind-tests conducted at ORNL. Over the course of 12 months, the PU-SAL-ORNL staff successfully accomplished the proposed technical and administrative tasks, inclusive of engaging in outreach to potential users of this technology in the DOE-wide infrastructure. The proposed tasks were successfully accomplished in timely manner; the follow-up type tasks pertaining to SBIR type Phases 2-3 were discussed and are initiated, inclusive of filing for intellectual property (IP) disclosures and possible patent filings by PU’s Office of Technology Commercialization (OTC). Two H*TMFD system architectures (see Exhibits 1 & 2 in the report) were developed and constructed for hand-portability by health-physicists (HPs) – the HP-H*TMFD, and the H*TMFD system which consists of a side-by-side mounted array of 4 TMFDs of 3 different sizes in sensitive volume (including one with borated fluid) that now simultaneously enables neutron energy spectroscopy: single bin for < 0.1 MeV, and 152 energy bins in the 0.1-15.2 MeV range; H*(10) dosimetry from ~5 μRem/h towards 10 R/h ranges. Several experiments were conducted using neutron sources in various configurations (shielded and unshielded). In direct comparison against the LiI-BSS industry standard (acquiring data for 26h each source), the H*TMFD system (acquiring data for ~6h for each source) offered H*(10) dose predictions for the most part accurate to within +/-10% for dose rates in the 100-300 μRem/h range. The LiI-BSS was impractical to use under ultra-low (~10 μRem/h) dose rate space, as also another metering device used at ORNL (Ludlum 4241L non-spectroscopy enabled) for which the lower limit is set by the manufacturer at 100 μRem/h. The enablement for efficient use in timely manner at the 10 μRem/h levels is deemed to be a strong enabling factor for H*TMFD for use in the DOE-nuclear laboratory arena. In terms of weight, the HP-H*TMFD weighs under ~5-7 lb.; the H*TMFD system weighs ~35-lb. As such, it is ~1/4 the weight of an LiI-BSS system weighing ~120 lb (LiI detector with 6 bonner spheres) and, ~1/2 the weight of ROSPEC. As a result of this activity, two involved post-doctoral student staff have now transitioned their knowledge and experiences to DOE’s Pacific Northwest National Laboratory (PNNL). A PU graduate student has also benefited from this project work which formed a principal basis for his Ph.D. dissertation work (in progress).

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

Collaborative study on Earthquake Ground Motion Simulation Using Rupture Dynamics

The objective of this multi-year project between the LLNL and Kyoto University, is the investigation of effects of rupture dynamics on near-fault ground motion amplitude for strike slip earthquakes through rupture dynamics simulations. The work presented in this report was in part performed by Jikai Sun, a graduate student from Kyoto university, during his visit to the LLNL as a summer student. He was trained by Dr. Pitarka in using computer programs for generating rupture models and performing rupture dynamics simulations.

58 GEOSCIENCES↗

Study of Proton Stopping and Energy Deposition in Warm Dense Matter

This grant supported target fabrication and travel costs for Experiment LQ91 at the Matter in Extreme Conditions endstation (MEC) of the SLAC National Accelerator Laboratory’s Linac Coherent Light Source (LCLS). LQ91 was the first experiment to study proton-heated Warm Dense Matter (WDM) with the MEC end station. It was scheduled as the first experiment in MEC following maintenance and upgrades to the optical high intensity laser during LCLS Run 16. The team consisted of scientists, postdocs, and Ph.D. students from UC San Diego and Stanford University divided into two overlapping shifts. The team arrived onsite during the optical intense laser commissioning time to setup and stayed until the end of the experiment culminating in five shifts of awarded LCLS beam time. Postdoc Mathieu Bailly-Grandvaux led preparations in the months leading up to the experiment. During the experiment and in subsequent analysis work, two other UC San Diego postdocs and five UC San Diego graduate students were heavily involved. In this way, the project provided invaluable hands-on training opportunities in high energy-density science for several early-career scientists.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Voltron Compatible Whole Building Root-Fault Detection and Diagnosis

Buildings consume more than 40% of primary energy in the U.S. Malfunctioning sensors, components, and control systems, as well as degrading components in Heating, Ventilating and Air-conditioning (HVAC) and lighting systems are main reasons for energy waste and unsatisfactory indoor environment. Field studies have shown that an energy saving of 5-30% of total building energy consumption and improved indoor air quality can be achieved by simply applying automated fault detection and diagnosis (AFDD), followed by corrections even if these are not done in real time. Extensive research has been made on the development of component level AFDD tools in the past two decades. However, in recent years, the development of method for a whole building level AFDD has received much attention. Here, a whole building fault refers to a fault happening in one subsystem but impact on more than one subsystems, or has a significant impact on building performances, such as building’s energy consumption. Existing component level AFDD tools could fail to detect or give false alarm for faults that trigger abnormalities in multiple subsystems. Isolating such whole building faults, which have impacts on multiple subsystems, is also challenging by simply using component based AFDD solutions. On the other hand, it might be more cost-effective for medium- or small-sized commercial buildings that have subsystems (e.g. primary cooling subsystem, air loop subsystem, heating subsystem, lighting subsystem, etc.) to install one whole building level AFDD tool, rather than many component level AFDD tools, to focus on significant faults. The focus of this project is firstly to provide training opportunities in building AFDD research area for undergraduate students and to develop a workforce pipeline in building sciences. The objective of the proposed research activities is to develop cost-effective and scalable AFDD solutions for whole building level faults. The developed AFDD solution is VOLTTRONTM compatible to further increase its plug-n-play capacity and the market penetration. VOLTTRONTM is an open-source innovative distributed control and sensing software platform developed by the Pacific Northwest National Laboratory. A VOLTTRONTM compatible AFDD tool brings the benefits such as low-cost deployment, and better building to grid integration, etc. The performance of the developed whole building AFDD tools is evaluated using data collected from a mixed-use medium-sized university campus building. Another significant goal of this project is to engage undergraduate students in research activities and expose them to building control and AFDD fields. A demonstration building – Nesbitt Hall at Drexel University is identified for this study. This demonstration building has a typical HVAC system configuration, which includes a water-cooled chiller system, three variable air volume (VAV) air handling unit (AHU) systems, and a hydronic heating system. Faults, that are expected to have a whole building level impact, are artificially implemented in this demonstration building for three different seasons. Building data have been collected in this project, which include fault free building automation system (BAS) data and BAS data that contain system behaviors caused by artificially implemented and naturally occurred faults. These collected data are used to evaluate the developed whole building AFDD tools. A data-driven method, which includes a weather and schedule-based pattern matching (WPM) method and Feature based Principal Component Analysis (FPCA) method, is developed for whole building level fault detection. Parameter sensitivity tests, including snapshot window size, data sample searching pool size, etc., are implemented to evaluate the impacts of various WPM-FPCA parameters. A data-driven and expert knowledge/rule-based method using Bayesian Network (BN) and WPM is developed for whole building level fault diagnosis. The developed WPM-BN method, which includes a two-layer BN structure model and BN parameters, are either learned from baseline data or developed from expert knowledge. The developed whole building AFDD tools are evaluated using BAS data collected from the demonstration building. Using the evaluation data set, the WPM-FPCA fault detection method is evaluated under two different Principle Component (PC) retention rates, i.e., 0.65 retention rate and 0.95 retention rate. It is observed that when using 0.65 PC retention rate, the WPM-FPCA fault detection method achieves a 79% fault detection rate (this rate reaches to 85% when including the six make-up fault test cases discussed in the next bullet), while when using 0.95 PC retention rate, the WPM-FPCA fault detection method achieves 100% fault detection rate (this rate remains to be 100% when including the six make-up fault test cases). Under both PC retention rates, the WPM-FPCA fault detection method demonstrates 0% false alarm rates. Using the evaluation data set, the developed WPM-BN fault diagnosis method has successfully diagnosed thirteen (13) faults out of the fourteen (14) fault test cases. The one mis-diagnosed case exhibits fewer fault symptoms in different subsystems, when compared with other fault test cases. Overall speaking, the developed whole building AFDD solutions demonstrate satisfactory fault detection/diagnosis accuracy with very low false alarm rate. Lastly, a survey and market study has been performed to understand the existing AFDD market, including its gaps and needs.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

Support for the 2018 Advanced Accelerator Concepts Workshop (Final Report)

We organized the 18th Advanced Accelerator Concepts (AAC18) Workshop at the Beaver Run Resort and Conference Center in Breckenridge, Colorado on August 12–17, 2018. AAC18 was organized under the sponsorship of the IEEE Council on Superconductivity and managed under the supervision of IEEE 2018 Advanced Accelerator Conference Committee. Workshop day-to-day management, including financial, was handled by a qualified conference management company. The 2018 meeting was devoted to cross-disciplinary discussions of advanced accelerator concepts, including progress in various plasma acceleration methods, new methods of particle acceleration and high energy photon generation, techniques for production of ultra-high accelerating gradients in media other than plasmas, diagnostics and control of particle and photon beams and various associated particle beam, RF and energy sources. The Workshop had 278 attendees, including a record 96 students. Attendees came from 12 countries representing a wide range of institutions. The workshop format consisted of plenary sessions in the morning with topical leaders from around the world presenting the latest breakthroughs to the entire workshop. In the late morning and afternoons attendees broke out into eight different Working Groups for more detailed presentations and discussions that were summarized on the final day of the workshop. In addition, there were student tutorial presentations on two afternoons to provide in depth education and training for the next generation of accelerator scientists, as well as a poster session one evening.

43 PARTICLE ACCELERATORS↗

Quantum Computing as a High School Module

Quantum computing is a growing field at the intersection of physics and computer science. This module introduces three of the key principles that govern how quantum computers work: superposition, quantum measurement, and entanglement. The goal of this module is to bridge the gap between popular science articles and advanced undergraduate texts by making some of the more technical aspects accessible to motivated high school students. Problem sets and simulation based labs of various levels are included to reinforce the conceptual ideas described in the text. This is intended as a one week course for high school students between the ages of 15-18 years. The course begins by introducing basic concepts in quantum mechanics which are needed to understand quantum computing.

97 MATHEMATICS AND COMPUTING↗

Saturn Voltage Monitor

The purpose of this project was to involve students in the design of an improved voltage monitor. The purpose of the monitor was to record the trigger pulse on the Saturn accelerator. The students were responsible for designing and building a prototype monitor that could replace the existing monitors on the machine.

Holman, Edward↗

A Century of Noether's Theorem [Slides]

Role of women in US institutions (examples) Princeton: undergraduate women admitted in 1969, first full-time graduate student, 1961 first physics Ph.D., 1971 first tenured professor, 1968; in physics, 1998 Yale: undergraduate women admitted in 1969, graduate students, 1892 first science Ph.D.s, 1894 (astronomy & chemistry) first physics Ph.D., 1932 women on faculty since 1920, first tenured 1950s first tenured in physics, 2001; in math, 2013 Berkeley: undergraduate women from 1870 first physics Ph.D., 1926 first on physics faculty, 1981 (tenured)

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗