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This warm-up lab is intended to get students familiar with the large numbers encountered in astronomy (e.g. distances, times, numbers of stars and galaxies in the universe). Students will measure the dimensions of the classroom and/or the distance between objects in the classroom, and report their findings in units of millimeters, micrometers and nanometers.
Evolving education methods and greater use of technology in the classroom are dictating the need to rethink facility designs, including classroom lighting. Advances in LED-based lighting technology have created the possibility of lighting systems that are not only cost effective and energy efficient, but also color-tunable and as durable as other facility infrastructures (a 20-30 year life expectancy). Thus, there is the opportunity that the modern lighting system can be used by educators as a tool in their teaching strategy. To meet this need, RTI International and Finelite, Inc. teamed to develop and test the Next Generation Integrated Classroom Lighting System (NICLS). The NICLS technology incorporates a high performance, color-tunable light engine into new luminaire designs (e.g., pendant, direct-indirect, downlight, troffers) that are acceptable for use in classrooms. During this project, we successfully demonstrated that the NICLS technology achieves exceptional performance and exceeds all DOE goals for the classroom of the future, including: Luminous efficacy value for NICLS luminaires in excess of 125 lpw at all CCT values; TWL range of 2,700 K to 6,500 K while maintaining a CRI of 82 or higher at all values; Capability for full-range dimming (100% to 1%) at all CCT values with flicker levels below industry guidelines; Performance of the lighting system in a classroom mock-up, incorporating daylight and occupancy sensing to provide automatic control of lighting zones to further reduce energy consumption; Rated lifetime on the system exceeding 50,000 hours with a lumen maintenance of at least 85% at 50,000 hours; and Teacher-focused UI located at the front of the classroom to operate the lighting system. A smartphone-based UI is also available to accommodate teacher movement in the classroom. A critical element of developing this technology is designing the user interface to be compatible with modern teaching methods, including increased use of icons and colors and intuitive appearance. The design of the NICLS technology and the user interface was modified with assistance from focus groups consisting of more than 80 teachers and educational professionals total. The focus groups were held in a full-sized classroom that served as a technology demonstration site for the NICLS. The NICLS technology is an advanced lighting system for educational settings that meets or exceeds all DOE photometric, electrical, and reliability goals for the COF. The NICLS technology has been demonstrated at the classroom level, and the feedback from the dozens of teachers and educational professionals who visited the demonstration site has been overwhelmingly positive. NICLS provides a state-of-the-art lighting environment that adjusts the lighting conditions—both color and illuminance levels—to the needs of students and teachers for the task at hand. Early research has suggested that such lighting conditions will improve not only teacher effectiveness but also a student’s ability to concentrate on learning activities.
Within the energy and utilities sectors, the most significant barrier for consideration and submittal of diverse applicants for skilled labor opportunities is their inability to successfully pass the industry’s Construction And Skilled Trades (CAST) examination. The exam is collectively accepted as the benchmark for prospective candidates and assess if they have the baseline skills and knowledge to apply for skilled positions within those industries. It is an exam that was created by the Edison Electric Institute. Students were taught for a full 40-hr week M-F. We conducted one class in each of the following locations: Philadelphia, Chicago and Washington, DC. The students learned and practiced curriculum prepared by the utility industry for increased success for the examination. They were also taught how to successfully navigate the final barrier of employment opportunity: behavior-based interviewing. They were then directed to the website in order to apply for the positions they desired, and then scheduled to take the exam. We were targeting at least 70% of those who sit for the exam to pass the first time. If they were unsuccessful, candidates could re-test within 3 months. We then sent their resumes directly to the hiring recruiters and managers so that they received prime consideration. Our target number of applicants who were successful in being invited for interviews was 15 candidates.
Coastal towns and cities across the Northeastern US, with their high population density, aged utility infrastructure, and unique geography, are increasingly vulnerable to climate change related storm events. In October 2012 superstorm Sandy highlighted the fragility of our current coastal building types and made clear the need for a new model of design and construction which works to understand and mitigate these weaknesses. Dramatic changes in public policy, championed by both The Federal Emergency Management Agency (FEMA) and the National Flood Insurance Program (NFIP) are driving the rebuilding of these shore communities, often resulting in costly renovations, un-sustainable neighborhood configurations and in direct conflict with concurrent government policies such as The American with Disabilities Act (ADA). The SURE HOUSE demonstrates a series of new design solutions to these conflicting public policies and environmental imperatives. At Stevens Institute of Technology, the 2015 Solar Decathlon started with the challenge: Can we design a home for coastal New Jersey that dramatically reduces its energy use while protecting itself from the realities of a changing, more extreme climate? The SURE HOUSE merges the iconic 20th century shore home with 21st century building science. Utilizing innovative renewable energy technologies, a ‘Passive House’ level building envelope, and rugged glass-fiber-composite materials to flood-proof the home, the SURE HOUSE is a high-performance, net-zero-energy home, armored against extreme weather, designed for the contemporary lifestyle of the Jersey Shore and other vulnerable coastal communities. SUSTAINABLE At Stevens, we recognize that energy use in the home and workplace is directly connected to the growing problem of climate change. Reducing our energy consumption by designing higher performing, compact homes that are both functional, comfortable and desirable is the first critical step towards a modern, sustainable architecture for New Jersey and beyond. This is what informed the architectural design of the house. Configured about a compact form, thickly insulated and air-sealed walls eliminate thermal bridging and minimize energy losses while advanced glazing brings in free solar heat during the winter months. As a result of these passive design strategies, the SURE HOUSE has a greatly reduced carbon footprint requiring 91% less energy than a typical New Jersey home. Photovoltaic (PV) arrays on both the rooftop and operable shutters easily provide energy in excess of the home’s modest demands. The Stevens team considers a truly sustainable home in the era of climate change, one that prioritizes low energy use, and integrates right-sized renewable generation to supply the home’s needs. Low consumption, low production. RESILIENT In October of 2012, Hurricane Sandy wreaked havoc along the east coast of the US. In New Jersey alone there was an estimated 29.4 billion dollars in damages, 346,000 homes affected, and almost two and a half million people left without power, in some cases for over 10 days. Recovery from this storm and associated flooding is ongoing to this day, as many New Jersey homeowners grapple with the large costs of rebuilding and struggle to adapt to complicated new home building regulations. Damage from this storm to Hoboken, the home of the Stevens Institute of Technology’s campus, and to the New Jersey shore was extensive and many students on the SURE HOUSE team were directly affected by this historic event. The Stevens design team recognizes that in a world of more frequent and stronger storms, the ability to absorb and adapt to change is more important than ever. Successfully weathering the next storm and its aftermath is one of the primary goals in the design of the SURE HOUSE prototype. The SURE HOUSE introduces unique ‘dry flood-proofing’ methods to residential construction. Innovative wall and floor flood-proofing, utilizing durable composite sheathing materials adapted from the boating industry, were developed by the student team to render the SURE House’s building envelope flood proof up to the FEMA AE 6/7 Zone (+ 6/7 feet of water above sea-level). Designed and fabricated utilizing glass-fiber composite materials, the custom storm shutter system serves to protect the large glazed openings of the home from both air-borne debris impact and water infiltration during a storm event while also providing deterrence from the vandalism that often occurs in the aftermath of a calamitous event. During extended power outages, a ‘resilient’ solar array is capable of supplying critical amounts of energy and hot water to the home, without the use of battery storage or grid infrastructure. PV Description AC GRID-TIED PV SYSTEM The SURE HOUSE solar system consists of two distinct arrays, the grid-tied rooftop array which produces AC Powerand the shutter-mounted array which converts DC power generated by the modules directly into usable heat for the domestic hot water (DHW). The roof-mounted AC grid-tied array is comprised of three strings, two 11 module strings connected to an SMA SB 5000TL-US-223 inverter and a single 10 module string equipped and an SMA SB 3000TL-US-22 central inverter. All modules for the rooftop AC array are LG MonoX 2804 watt solar panels, chosen for their durability and efficiency. Inverter sizing and string size are optimized to the electrical characteristics of the chosen PV modules and the desired energy production, see Appendix 5B. The SURE HOUSE is projected to produce 12,353 kWh per year to meet 6,157 kWh per year of estimated consumption. Solar modules for the two AC grid-tied sub arrays are mounted on the main roof surface of the SURE HOUSE with a 10 degree tilt angle using a partially-ballasted polyethylene roof mounting system made by Renusol, which is particularly suited to the corrosive salt air of a coastal environment. This method was chosen for its installation simplicity and to limit detrimental roof penetrations. The 10 degree tilt optimizes the energy generated per roof area at a lower price, see Appendix 5A, and ensures that there is minimal wind uplift. DC SOLAR ELECTRIC DOMESTIC HOT WATER The SURE HOUSE’s approach to sustainable and resilient domestic hot water (DHW) consists of a unique, custom engineered DC solar electric hot water system. Employing the use of Advanced Energy’s DC electric PV heater (DCPVH)5 to heat domestic water well beyond the draw temperature, the SURE HOUSE is able to obtain a remarkably high solar fraction of 75% or more. The custom modified 80 gallon Vaughn DHW tank acts as a large solar ‘battery’ that stores heat energy in the form of hot water at almost 150 degrees, harvesting energy when the sun is out for use later in the day or overnight. The system, which uses electricity rather than heated fluid, is distinct from traditional ‘solar thermal’ systems by eliminating the dangers and associated maintenance issues of fluid based systems. By forgoing the use of external fluid loops, overheated solar collectors and pipes are not an issue for the SURE HOUSE system which never needs any yearly or seasonal flushing. In weather conditions where the integrated DCPVH unit cannot produce enough hot water via solar energy alone, the Vaughn hot water tank comes factory made with an AC powered 2.6 COP heat pump and a AC heating coil that serve as back-up heating elements. The DCPVH is powered by a DC array consisting of 10 custom-made Solbian by PVilion 180 watt, monocrystalline, flexible solar modules6. The Solbian modules are directly mounted to the top half of the operable storm shutters on the south façade of the SURE HOUSE. The SURE HOUSE team worked closely with PVillion, a PV system designer specializing in flexible architectural photovoltaics, to design an adhesive system that works with the glass-fiber storm shutter surface in a reliable manner over an extended period. Because this system operates in DC-only mode and never connects to the municipal power grid, the system can continue to create hot water safely and effectively even during grid disruption events. This hot water, and the energy stored within it, could be used for a range of activities including washing and cooking to more elaborate hydronic heating systems as desired. See Appendix 6 for system engineering, sizing and modeling.
Plasma Sciences Expo provides an exhibition that focuses on interactive, hands-on informal science education for students at all levels, parents, teachers and the general public. DPP research students and scientists inform this audience of the wonders of science with a particular focus on fusion and plasma science. School groups attend 8:00 am to 2:00 pm and the public attends 6 to 8 pm.
This report presents results from the DOE-sponsored workshop titled, Advancing X-Cutting Ideas for Computational Climate Science Workshop,'' known as AXICCS, held on September 12--13, 2016 in Rockville, MD. The workshop brought together experts in climate science, computational climate science, computer science, and mathematics to discuss interesting but unsolved science questions regarding climate modeling and simulation, promoted collaboration among the diverse scientists in attendance, and brainstormed about possible tools and capabilities that could be developed to help address them. Emerged from discussions at the workshop were several research opportunities that the group felt could advance climate science significantly. These include (1) process-resolving models to provide insight into important processes and features of interest and inform the development of advanced physical parameterizations, (2) a community effort to develop and provide integrated model credibility, (3) including, organizing, and managing increasingly connected model components that increase model fidelity yet complexity, and (4) treating Earth system models as one interconnected organism without numerical or data based boundaries that limit interactions. The group also identified several cross-cutting advances in mathematics, computer science, and computational science that would be needed to enable one or more of these big ideas. It is critical to address the need for organized, verified, and optimized software, which enables the models to grow and continue to provide solutions in which the community can have confidence. Effectively utilizing the newest computer hardware enables simulation efficiency and the ability to handle output from increasingly complex and detailed models. This will be accomplished through hierarchical multiscale algorithms in tandem with new strategies for data handling, analysis, and storage. These big ideas and cross-cutting technologies for enabling breakthrough climate simulation advancements also need the "glue" of outreach and learning across the scientific domains to be successful. The workshop identified several strategies to allow productive, continuous engagement across those who have a broad knowledge of the various angles of the problem. Specific ideas to foster education and tools to make material progress were discussed. Examples include follow-on cross-cutting meetings that enable unstructured discussions of the types this workshop fostered. A concerted effort to recruit undergraduate and graduate students from all relevant domains and provide them experience, training, and networking across their immediate expertise is needed. This will broaden and expand their exposure to the future needs and solutions, and provide a pipeline of scientists with a diversity of knowledge and know-how. Providing real-world experience with subject matter experts from multiple angles may also motivate the students to attack these problems and even come up with the missing solutions.
All members of the T Division Community, students, staff members, group leaders, division management, and other interested individuals are invited to come and support the following student(s) as they present their Lightning Talks.
The forefront of particle physics has focused on possible physics beyond the standard model which might help explain its peculiarities, including the nature of the spectrum of masses of elementary particles, the peculiar hierarchy between the Planck scale and the electroweak scale, and the possible manner in which the standard model might be embedded in a quantum theory which incorporates gravity. Over the past several decades it has become clear that several of the key out-standing problems associated with our understanding of fundamental interactions are inextricably tied to questions that are also of current interest in cosmology and astrophysics. At the same time, remarkable new data is being gathered that will allow empirical testing of theoretical ideas that have been around for a generation, from the discovery of the Higgs at the LHC to the possible detection of gravitational waves from Inflation at the GUT scale. The questions of the origin of mass, and possible grand unification are both tied to the possible existence of phase transitions in the early universe. Neutrino masses, as probed from astrophysical sources, may play a key role in elucidating the physics associated with the generation of baryon number. It is also possible that new physics at the electroweak scale may play a role in the nature of primordial cosmological magnetic fields. Low Energy Supersymmetry as a solution to the hierarchy problem can predict, besides events detectable at the LHC, stable weakly interacting particles that might make up the dark matter of the universe. The possible existence of large extra dimensions might also impact upon the hierarchy problem, but these could also dramatically affect our picture of the evolution of the Universe both at early times, and possibly on large scales. Inflation may depend upon new physics at the GUT scale, but its detection may now be imminent with the possible detection of a gravitational wave signature in the Cosmic Microwave Background Radiation. Undoubtedly the most significant outstanding problem in high-energy physics is also a problem in cosmology, and indeed originated not from accelerators but from astrophysical observations: What is the origin and nature of the dark energy that appears to dominate the Universe? An understanding of quantum gravity, and perhaps a new understanding of quantum mechanics or quantum field theory may be required to fully address this problem. At the moment, the physics of black holes may provide the best opportunity to explore these issues, while the discovery of the Higgs suggests several new possible connections to physics that might be relevant for dark energy. Finally, pending confirmation of a gravitational wave signal from inflation, to date the only direct evidence for fundamental particle physics beyond the standard model comes, at least in part, from astrophysical neutrino observations. A remarkable convergence of theory, observation and experiment has been taking place that is allowing great strides to be made in our knowledge of the parameters that describe the universe, if not the origin of these parameters. Given the new discoveries now being made, and the incredible capabilities of future instruments, it is an exciting time to make progress in our fundamental understanding the origin and evolution of the Universe and the fundamental forces that guide that evolution. As a result, it is natural that our DOE theory research program at Arizona State University focuses in large part on the connections between particle physics and cosmology and astrophysics in order to improve our understanding of fundamental physics. Our areas of research cover all of the areas described above. Our group now consists of four faculty PI’s and their postdocs and students, complemented by long term visitor Frank Wilczek, and physics faculty colleagues Cecilia Lunardini, Richard Lebed, and Andrei Belitsky, whose interests overlap in areas ranging from particle theory and phenomenology to neutrino astrophysics. In addition, we interact with astronomers, and experimentalists in both Physics and the School of Earth and Space Exploration. In addition, Krauss and Parikh are associated, respectively, with the ASU Origins Project and the ASU Beyond Center. Both of these groups have helped us leverage DOE funds by supporting workshops associated with our activities from time to time. To continue the active program we have built up here, we are asking for support for 3 graduate students, and 3 postdocs (note that the PI will forego summer salary support in order to support one additional postdoc beyond the request in our last proposal for 2 postdocs). We have been fortunate to build a vibrant group based in part on University startup support for our program. Now that that support is coming to a close for most of our group, we are hoping that the exciting program we have created motivates continued DOE support at a level that, while not as great as the level we enjoyed with startup support, will nevertheless allow us to maintain our momentum.
In-core nuclear materials including fuel pins and cladding materials fail due to issues including corrosion, mechanical wear, and pellet cladding interaction. In most such scenario microstructure dependent and corrosioninduced chemistry dependent property changes significantly affect performance of cladding, pellet, and housing. Emphasis of this work was on replace conventional pellet-cladding material models with a new straingradient viscoplasticity model that is informed by transmission electron microscopy (TEM) based measurements and by nanomechanical Raman spectroscopy (NMRS) based measurements. The TEM measurements are quantitative in nature and therefore reveal stress-strain relations with simultaneous insights into mechanisms of deformation at nanoscale. The NMRS measurements reveal the similar information at mesoscale along with additional information on relating local microstructural stresses with applied stresses. The resulting information is used to fit constants in the strain gradient viscoplasticity model as well as to validate one. During TEM measurements, a micro-electro-mechanical system based setup was developed with mechanical actuation, sensing, heating, and electrical loading. Contrary to post-mortem analysis or qualitative visualization, this setup combines direct visualization of the mechanisms behind deformation with measurement of stress, strain, thermal and electrical properties. The unique research philosophy of visualizing the microstructure at high resolution while measuring the properties led to fundamental understanding in grain size and temperature effects on measured mechanical properties such as fracture toughness. A key contribution is the role of mechanical loading boundary conditions to deconvolute the insitu TEM based nanoscale and NMRS based mesoscale data to bulk behavior. First the literature based pellet cladding mechanical interaction model based on the work of Retel’s and Williamson’s in literature work to predict tempurature and stress distribution in cladding and pellet at normal operating condition was analyzed. Later the data was fitted to find constants for a viscoplastic strain gradient model. The developed model still needs to be refined and calibrated using various experimental results. That remains the focus of future work. Overall, a major thrust of the work was therefore on active control of the microstructure (grain size, defect density and types) exploiting the multi-physics coupling in materials. In particular, using experiments the synergy of current density, mechanical stress and temperature were studied to annihilate defects and recrystallize grains. The developed model is being examined for implementation in BISON. Multiple invited talks, international journal publications, and conference publications were performed by students supported on this work. Another output is support multiple PhD and masters thesis students who will be an important asset for future basic nuclear research. Future Work Recommendations: A nuclear reactor operates under significant variations of thermal loads due to energy cycling and mechanical loads due to constraint effects. Significant thermal and chemical diffusion takes place at the pallet-cladding level. While the proposed work established new experimental approach and new dataset for Zircaloy-4, the irradiation level was in the range of 1-2 dpa. Samples with higher dpa need to be examined. Therefore, a continual of support of the performed work is essential. Currently, these are the only experiments that can measure the produced data. The work also needs to be extended to different fuel types and cladding types such as SiC and FeCrAl based claddings. A combination of datasets for these materials can then be used to analyze accurately predict behavior of critical pellet cladding systems in accident scenario with high heat flux and high thermal loads. This is a BIG unknown as if now.
The project aimed to provide solar energy education to students from underrepresented groups and to develop a novel, nano-scale approach, in utilizing Fe 2 SiS 4 and Fe 2 GeS 4 materials as precursors to the absorber layer in photovoltaic thin-film devices. The objectives of the project were as follows: 1. Develop and implement one solar-related course at Delaware State University and train two graduate students in solar research. 2. Fabricate and characterize high-efficiency (larger than 7%) Fe 2 SiS 4 and Fe 2 GeS 4 -based solar devices. The project has been successful in both the educational components, implementing the solar course at DSU as well as in developing multiple routes to prepare the Fe 2 GeS 4 with high purity and in large quantities. The project did not meet the efficiency objective, however, a functional solar device was demonstrated.
Over the five years of funding from this grant, I produced 26 publications. These include a book-long monograph on "Holographic Quantum Matter" that is currently in press with MIT press. The remainder were mostly published in Physical Review Letters, the Journal of High Energy Physics, Nature Physics, Classical and Quantum Gravity and Physical Review B. Over this period, the field of holography applied to condensed matter physics developed from a promising theoretical approach to a mature conceptual and practical edifice, whose ideas were realized in experiments. My own work played a central role in this development. In particular, in the final year of this grant, I co-authored two experimental papers in which ideas that I had developed in earlier years were shown to usefully describe transport in strongly correlated materials — these papers were published in Science and in the Proceedings of the National Academy of Sciences (obviously my contribution to these papers was theoretical). My theoretical work in this period developed several new directions of research that have proven to be influential. These include (i) The construction of highly inhomogeneous black hole event horizons, realizing disordered fixed points and describing new regimes of classical gravity, (ii) The conjecture of a bound on diffusivities that could underpin transport in strongly interacting media — an idea which may be proven in the near future and has turned out to be intimately connected to studies of quantum chaos in black holes and strongly correlated media, (iii) The characterization of new forms of hydrodynamic transport, e.g. with phase-disordered order parameters. These studies pertain to key open questions in our understanding of how non-quasiparticle, intrinsically strongly interacting systems can behave. In addition to the interface between holography and strongly interacting condensed matter systems, I made several advances on understanding the role of entanglement in quantum gravity. These included the first computation of holographic entanglement beyond the bulk classical limit as well understanding short distance entanglement in the emergent spacetime of the c=1 matrix quantum mechanics. The objective here is ultimately to understanding how a priori non-local degrees of freedom can re-arrange themselves quantum mechanically to support emergent local dynamics. Much of work funded by this grant involved collaboration with postdocs and graduate students, several of which were directly funded by the grant. These students have now successfully graduated to postdoctoral positions and in one case to high tech industry. The ideas developed in this work have directly fed into my current research in which I am aiming to prove fundamental bounds on entropy production and transport from quantum mechanics and statistical physics. As often, as with much of my previous work, black hole physics can be an inspiration for extreme dynamics such as fundamental bounds, but ultimately one hopes to prove them using more general tools of quantum field theory.
This document describes the problem statement that students at the University of Texas will use for their senior level capstone design class. The purpose of this project is to introduce students to Safeguards by Design concepts as part of their capstone design course at the culmination of their degree program. This work is supported by Los Alamos National Laboratory with FY17 and FY18 programmatic funding from the U. S. Department of Energy’s (DOE) National Nuclear Security Administration (NNSA), through the Office of Defense Nuclear Nonproliferation (DNN), Office of International Nuclear Safeguards (INS), Next Generation Safeguards Initiative (NGSI), Human Resource Development Program, Safeguards by Design Project.
Research in our labs, supported since 2005 by Basic Energy Sciences, has led to the discovery of a new lipid mediator pathway that influences phytohormone-mediated regulation of plant growth and development—the so-called N-acylethanolamine (NAE) regulatory pathway. This pathway in plants shares conserved metabolic machinery with the endocannabinoid signaling system of vertebrates that regulates a multitude of physiological and behavioral processes in mammals, suggesting that the metabolism of NAEs is an important regulatory feature of eukaryotic biology. Current evidence in plants points to interactions between NAE metabolism, abscisic acid (ABA) signaling and light signaling to modulate seedling establishment and the acquisition of photoautotrophic growth. The proposed research fits well within the mission of Photosynthetic Systems and Physical Biosciences which seek “to understand the processes by which plants, algae and non-medical microbes capture, convert and/or store energy”. The fundamental regulatory processes that govern seedling establishment directly influence the assembly of photosynthetic energy conversion systems in essentially all higher plants. Our main hypothesis is that seedlings coordinate the metabolic depletion of NAEs during seedling establishment through a complex interaction of hydrolysis (by fatty acid amide hydrolase, FAAH) and oxidation (by lipoxygenases, LOX) and that newly-reported oxylipin metabolites of polyunsaturated NAEs help to coordinate seedling development and acquisition of photoautotrophy in response to appropriate environmental cues. Evidence suggests that ethanolmide oxylipins derived from NAEs can reversibly accumulate in seedlings and adjust/arrest seedling establishment and chloroplast development in conjunction with ABA signaling and light-signaling pathways. Our results provide important new information linking the production of small molecule lipid mediators in seedlings to the coordinated development of photoautorophy. While relevant to how plants capture, convert and store energy, this work also extends to the general understanding of acylethanolamides and their bioactivity in eukaryotic organisms. In addition, analytical mass spectrometry methodology developed in this work also helped to demonstrate the identification, quantification and spatial localization of NAEs and other lipids in various plant and animal tissues. Cumulative scholarly output includes 45 publications, 2 U.S. Patents, and 24 invited research seminars. This research funding also supported the training of 2 master’s students, 4 Ph.D. students and 3 postdoctoral scholars, enhancing the human infrastructure of the U.S. science enterprise.
The first US-based summer school and workshop on Time-Dependent Density Functional Theory (TDDFT) was held July 11-21, 2017 in Telluride, CO. This grant provided funding to enable 33 students to attend the school, specifically with lodging and registration fee reductions. TDDFT is increasingly used in computational molecular and materials science to calculate electronic-excitation spectra and dynamics in a wide variety of applications, including photocatalysis, photo-controlled bond dissociation, and light-induced charge transfer. Software development in this community targets multiple software packages, many of which are open source, such as octopus, NWchem and Qb@ll, which are the ones our school focused on. The goal of this first iteration was to create a home for a national community of scholars, including users and developers, with a deep understanding of TDDFT, its capabilities, limitations, and high-performance computing context. We used this opportunity to explore interest in such an event in the future and based on overwhelmingly positive feedback from students and teachers, we intend to hold a similar school+workshop every two years in the US, in order to maintain the high level of interest that we witnessed and the enthusiasm amongst participants.
This project concentrated on various aspects of creating and applying tool infrastructure to make it easier to effectively use large-scale parallel computers. This project was collaborative with Argonne National Laboratory, Lawrence Berkeley National Laboratory, Lawrence Livermore National Laboratory, Oak Ridge National Laboratory, U.C. San Diego, University of Maryland, University of North Carolina, University of Oregon, University Southern California, University of Tennessee, and University of Utah. The research conducted during this project at the University of Maryland is summarized in this report. The complete details of the work are available in the publications listed at the end of the report. Many of the concepts created during this project have been incorporated into tools and made available as freely downloadable software (www.dyninst.org/harmony). It also supported the studies of six graduate students, one undergraduate student, and two post-docs. The funding also provided summer support for the PI and part of the salary of a research staff member.
Unique opportunity for industry to engage in original, highly leveraged precompetitive research in automotive and transportation systems, with focus on advanced propulsion systems; fuel economy; vehicle safety, connectivity and autonomy; and advanced driver assistance systems Additional benefits: prepare graduate students for future careers in automotive industry, reaching undergraduate students through capstone design and other project activities, focused recruitment events
Particulate separations are of considerable significance in many areas of technology ranging from pharmaceutics and microelectronics, to mining and construction materials industries. In addition, particulate separation technology is of critical importance in the environmental area, for example, the development of advanced water treatment processes for the 21st century will rely on more efficient particulate separation techniques. In this regard it is most appropriate that the Separations Program of the Division of Chemical Sciences, Geosciences, and Biosciences, Office of Basic Energy Sciences, of DOE supports basic science research in the area of particulate separations. One such particulate separation process of special importance is froth flotation, a physico-chemical process that is used to separate particles in an aqueous suspension via differences in hydrophobicity as established by the interaction of various reagents at the solid/water, solid/gas and water/gas interfaces. Surfactants, called collectors, are added to a suspension to selectively adsorb at the surface of specific particles, rendering these particles hydrophobic. Regulators are employed to promote collector adsorption at the desired surfaces, while preventing such reactions at other surfaces. When air is dispersed into the suspension, the bubbles generated attach to the hydrophobic particles. The resulting bubble/particle aggregates float to the suspension surface and are collected in a froth phase as a concentrate. The remaining hydrophilic particles are retained in suspension and discharged as a tailings product. Clearly, particulate separation by froth flotation is an outstanding example of applied surface chemistry, and is used in the food, petroleum, pulp/paper, and mineral industries. The use of flotation technology is perhaps most significant in the mineral industry where, in the U. S. alone, over 500,000 tons/day of nonsulfide minerals are processed. The estimated value of all nonfuel mineral materials processed in the United States during 2015 totaled $630 billion. It is evident that particle separation by flotation is an important process that is used in many of the mineral industries. Understanding of the interfacial chemistry for the development of improved flotation separations is required for more effective production and utilization of our mineral resources, especially the critical minerals as identified in the 2017 USGS report, “Critical Mineral Resources of the United States – Economic and Environmental Geology and Prospects for Future Supply.” In this regard, a research program has been in progress with DOE support from Grant DE-FGO2-93ER14315 to study the fundamental interfacial chemistry features in nonsulfide mineral flotation systems in order to increase our understanding and provide for improved separation efficiencies and energy economy in the processing of our mineral resources. Significant contributions have been made to the flotation chemistry of flotation separations in many areas, including, salt minerals; collector adsorption; wetting, surface forces, bubble attachment; interfacial water structure; phyllosilicate minerals, and critical mineral resources such as rare earth minerals and lithium resources. The research results summarized herein have resulted in more than 225 publications, the education of 28 PhD graduate students, and impressive recognition with university, national, and international awards. For example, among many other awards, Distinguished Professor Jan Miller, PI, was elected to be a member of the National Academy of Engineering (1993) and the National Academy of Inventors (2014). In 2015 he received the University of Utah’s most prestigious award presented annually to a faculty member, the Rosenblatt Prize for Excellence. Research Professor Xuming Wang was selected by SME to be a Henry Krumb Lecturer (2013-2014), and many of the student researchers involved in the program received national awards from AIME, ICE, IPMI, SME, and TMS. It is evident that the flotation separation research program has been quite successful. Unfortunately, the flotation chemistry research for mineral particle separation has been terminated even though the renewal proposal received excellent reviews with recommended funding. The need for continued support of minerals separation research is of critical importance as recognized by 1) the recent 2017 USGS report, “Critical Mineral Resources of the United States – Economic and Environmental Geology and Prospects for Future Supply,” and by 2) the 20 December 2017 executive order from President Trump to increase the discovery, production, and domestic refining of critical minerals. In view of our research accomplishments, the excellent reviews of the renewal proposal, and the expressed need for attention to the production of critical minerals, termination of “The Flotation Chemistry of Nonsulfide Minerals” research program by DOE is not appropriate, and continued support should be reconsidered.
This NEUP Project aimed to generate accurate atomic structural models of nuclear waste glasses by using large-scale molecular dynamics-based computer simulations and to use these models to investigate self-diffusion behaviors, interfacial structures, and hydrated gel structures formed during dissolution of these glasses. The goal was to obtain realistic and accurate short and medium range structures of these complex oxide glasses, to provide a mechanistic understanding of the dissolution behaviors, and to generate reliable information with predictive power in designing nuclear waste glasses for long-term geological storage. Looking back of the research accomplishments of this project, most of the scientific goals initially proposed have been achieved through intensive research in the three and a half year period of the project. This project has also generated a wealth of scientific data and vibrant discussions with various groups through collaborations within and outside of this project. Throughout the project one book chapter and 14 peer reviewed journal publications have been generated (including one under review) and 16 presentations (including 8 invited talks) have been made to disseminate the results of this project in national and international conference. Furthermore, this project has trained several outstanding graduate students and young researchers for future workforce in nuclear related field, especially on nuclear waste immobilization. One postdoc and four PhD students have been fully or partially supported through the project with intensive training in the field material science and engineering with expertise on glass science and nuclear waste disposal