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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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DOE OSTI2016

2016 LLNL Nuclear Forensics Summer Program

The Lawrence Livermore National Laboratory (LLNL) Nuclear Forensics Summer Program is designed to give graduate students an opportunity to come to LLNL for 8–10 weeks for a hands-on research experience. Students conduct research under the supervision of a staff scientist, attend a weekly lecture series, interact with other students, and present their work in poster format at the end of the program. Students also have the opportunity to meet staff scientists one-on-one, participate in LLNL facility tours (e.g., the National Ignition Facility and Center for Accelerator Mass Spectrometry), and gain a better understanding of the various science programs at LLNL.

99 GENERAL AND MISCELLANEOUS↗
DOE OSTI2017

Nuclear Data 101: The Good, The Bad, and The Ugly

This lecture is an attempt to cover in one hour the fundamentals of what nuclear data are, where they come from and how they affect nuclear science applications.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2017

The Potentialities of the Atomic Bomb

In January 1949, Norris Bradbury gave a lecture at the National War College which summarized the progress Los Alamos had made since the end of the war. The transcript of the talk was filed and forgotten until it surfaced fifty years later. It is, perhaps, one of the best summaries of the state of the United States nuclear weapons program in 1949. It is also evidence of how Bradbury saw the future of atomic weapons. It is presented in full, with minor editing, and begins as follows: Since the first use of an atomic bomb on August 5 [sic], 1945, over the city of Hiroshima, Japan, there has been a continual flood of speculation and discussion concerning the effect of this new weapon on military technology. Much of this speculation and discussion has been intelligent and fruitful; much, I regret to say, has had neither of these characteristics. The enormity of the device, in terms of potential destruction and loss of life, and the practical necessity to surround the technical facts with full security restrictions have only combined to make the problem more difficult. At the same time, it is imperative that policymaking personnel in charge of long range national planning know the basic facts concerning atomic weapons and have these facts in a reasonable perspective. This document describes these potentialities in detail.

45 MILITARY TECHNOLOGY, WEAPONRY, AND NATIONAL DEF↗
DOE OSTI2017

Combustion energy frontier research center (CEFRC) final report (August 1, 2009 – July 31, 2016)

The Combustion Energy Frontier Research Center (CEFRC) was established to tackle the single overarching grand challenge of energy sustainability, energy security and global warming: to develop a “validated, predictive, multi-scale, combustion modeling capability to optimize the design and operation of evolving fuels in advanced engines for transportation applications,” as identified in the DOE report on “Basic Energy Needs for Clean and Efficient Combustion of 21st Century Transportation Fuels”. The challenge is particularly daunting since energy conversion efficiencies and exhaust emissions are governed by coupled chemical and transport processes at multiple length scales ranging from electron excitation to molecular rearrangements to nanoscale particulate formation to turbulent fuel/air mixing. To tackle this challenge, the CEFRC assembled a world-class team of 15 principal investigators, with the objectives to: 1) develop and test theoretical models to predict elementary reaction rates, molecule thermalization rates, chemical bond dissociation energies, and nonequilibrium transport properties using quantum chemistry calculations that account for strong electron correlation and multiple electronic potential energy surfaces; 2) develop automated kinetic mechanism generation, reduction, and error control methods for predicting alternative fuel including biofuel oxidation, fuel droplet decomposition, and NOx and particulate formation; 3) validate and improve the predictions of these models by measuring ignition delay times, species profiles, flame structures, burning limits, turbulence-kinetic coupling, and NOx and soot emissions at high-pressures and near-limit conditions, by using advanced experimental diagnostic techniques including multiple laser techniques, molecular beam sampling and synchrotron photoionization, and by conducting the measurements in high-pressure shock tubes, jet-stirred and flow reactors, flame bombs, counterflow flames, and advanced-design rapid compression ignition instruments; and 4) develop a suite of validated petascale high-fidelity simulation and modeling capabilities to understand and predict chemistry-turbulence-radiation coupling for new fuels in new regimes, including the high pressure, low-temperature combustion in advanced engine and turbine designs, and 5) establish a knowledge highway between researchers and engineers in academia, national laboratories, and industry to facilitate the dissemination and exchange of knowledge on national and international levels, and enrich the talent pool and capabilities of the next generation of combustion scientists and engineers. The technical activities of the CEFRC were conducted through three Disciplinary Working Groups – Chemistry Theory, Experiment and Mechanism, and Reacting Flows, which coordinated the Center’s research on the development of combustion chemistry of Foundation Fuels (C0–C4 hydrocarbons), Alcohols, and Biodiesel through three corresponding Mechanism Thrust Groups. Such a two-dimensional coordinated and tightly interwoven research structure has been proven to be highly effective in assuring the interplay between the developments of the fundamentals of combustion science and the utilization of the various categories of fuels. The Center has accomplished the above goals over the five year period (August 1, 2009 – July 31, 2014) with appropriated funding, followed by two additional no-cost-extension (NCE) years. The research results are documented in 230 journal publications, with six legacy review papers on the study of combustion chemistry using shock tubes, flow reactors, rapid compression machines, and flames, on uncertainty quantification, and on theoretical reaction dynamics and chemical modeling of combustion. A robust outreach program complemented these PI-led research activities, consisting of: 1) a roving post-doc program comprised of a corps of Center-appointed, co- or multi-sponsored post-doctoral fellows with rotating assignments to conduct seed projects initiated by at least two PIs, in residence with these sponsoring PIs, to rapidly pursue new and high-risk, high-payoff interdisciplinary ideas; 2) an annual summer school on combustion heavily attended (~200) by senior graduate students and practicing researchers covering advanced topics on chemical kinetics, fluid mechanics, turbulent combustion, engine combustion, new technologies, etc.; 3) a robust open web-site providing Center and community information as well as the lecture videos and notes of the summer school; and 4) widely distributed biannual newsletters.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗
DOE OSTI2017

Plutonium Packaging

This report is the plutonium packaging portion of the ADPSM plutonium engineering lecture series.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗
DOE OSTI2017

Consortium for Verification Technology Fellowship Report.

As one recipient of the Consortium for Verification Technology (CVT) Fellowship, I spent eight days as a visiting scientist at the University of Michigan, Department of Nuclear Engineering and Radiological Sciences (NERS). During this time, I participated in multiple department and research group meetings and presentations, met with individual faculty and students, toured multiple laboratories, and taught one-half of a one-unit class on Risk Analysis in Nuclear Arms control (six 1.5 hour lectures). The following report describes some of the interactions that I had during my time as well as a brief discussion of the impact of this fellowship on members of the consortium and on me/my laboratory’s technical knowledge and network.

98 NUCLEAR DISARMAMENT, SAFEGUARDS, AND PHYSICAL P↗
DOE OSTI2017

4th Penn State Bioinorganic Workshop

The research area of biological inorganic chemistry encompasses a wide variety of subfields, including molecular biology, biochemistry, biophysics, inorganic chemistry, analytical chemistry, physical chemistry, and theoretical chemistry, as well as many different methods, such as biochemical characterization of enzymes, reaction kinetics, a plethora of spectroscopic techniques, and computational methods. The above methods are combined to understand the formation, function, and regulation of the many metallo-cofactors found in Nature as well as to identify novel metallo-cofactors. Many metalloenzyme-catalyzed reactions are extremely complex, but are of fundamental importance to science and society. Examples include (i) the reduction of the chemically inert molecule, dinitrogen, to ammonia by the enzyme nitrogenase (this reaction is fundamental for the production of nitrogen fertilizers); (ii) the oxidation of water to dioxygen by the Mn4Ca cluster found in photosystem II; and (iii) myriad reactions in which aliphatic, inert C-H bonds are cleaved for subsequent functionalization of the carbon atoms (the latter reactions are important in the biosynthesis of many natural products). Because of the broad range of areas and techniques employed in this field, research in bioinorganic chemistry is typically carried out collaboratively between two or more research groups. It is of paramount importance that researchers working in this field have a good, basic, working knowledge of many methods and approaches employed in the field, in order to design and discuss experiments with collaborators. Therefore, the training of students working in bioinorganic chemistry is an important aspect of this field. Hugely successful “bioinorganic workshops” were offered in the 1990s at The University of Georgia. These workshops laid the foundation for many of the extant collaborative research efforts in this area today. The large and diverse group of bioinorganic chemists at The Pennsylvania State University and our unique laboratory space are well suited for the continuation of such training workshops. The co-principal investigators of this award lead these efforts. After a smaller “trial workshop” in 2010, the Penn State bioinorganic group, led by the co-PIs, offers these workshops biennially. The 2012, 2014, and 2016 workshops provided training to 123, 162, and 153 participants, respectively, by offering (i) a series of lectures given by faculty experts on the given topic, (ii) hands-on training in small groups by experts in the various methods, and (iii) sharing research results of the participants by oral and poster presentations. The centerpiece of the workshops is the hands-on training, in which approximately half of the participants from all ranks (undergraduate students to faculty) served as teachers. In this section, the traditional roles of teachers and students were sometimes reversed to the extent that undergraduate students taught faculty in the students' areas of specialty. We anticipate that these workshops will facilitate research in bioinorganic chemistry and will help establish future collaborations among “workshop alumni” to carry out cutting-edge research in bioinorganic chemistry that will address many important topics relevant to our society.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2017

Nuclear Forensics and Radiochemistry: Cross Sections

The neutron activation of components in a nuclear device can provide useful signatures of weapon design or sophistication. This lecture will cover some of the basics of neutron reaction cross sections. Nuclear reactor cross sections will also be presented to illustrate the complexity of convolving neutron energy spectra with nuclear excitation functions to calculate useful effective reactor cross sections. Deficiencies in the nuclear database will be discussed along with tools available at Los Alamos to provide new neutron cross section data.

38 RADIATION CHEMISTRY, RADIOCHEMISTRY, AND NUCLEA↗
DOE OSTI2017

Introduction to Chiral Symmetry

These lectures are an attempt to a pedagogical introduction into the elementary concepts of chiral symmetry in nuclear physics. We will also discuss some effective chiral models such as the linear and nonlinear sigma model as well as the essential ideas of chiral perturbation theory. We will present some applications to the physics of ultrarelativistic heavy ion collisionsd.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2013

Selected Topics in Microwave Instabilities and Linacs

The Shanghai Institute of Applied Physics (SINAP) is embarking on its first X-ray free-electron laser (FEL) project. It is a cascading high-gain harmonic generation FEL. Microwave instabilities driven by various effects, especially the space-charge force, will degrade the quality of the electron beam before entering into the undulator. However, inside the undulator, the occurrence of microbunching becomes an utmost important ingredient for the generation of coherent radiation. In short, controlled and uncontrolled microwave instabilities must be fully understood in such a project. These are the slides of a series of eight-hour lectures given at the SINAP in June of 2013, with the intention of a fully understanding of the microbunching phenomenon. The sections of wake field and impedance theory are added as an introduction for those who are not familiar with the subject.

43 PARTICLE ACCELERATORS↗
DOE OSTI2018

The Flotation Chemistry of Nonsulfide Minerals

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.

58 GEOSCIENCES↗
DOE OSTI2018

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↗
DOE OSTI2018

Teaching Game Theory to Kids and Limits of Prediction

I have once been asked to read a lecture to a group of 6th graders on Game Theory. After agreeing to it, I realized that explaining the game theory basics to 6th graders my be difficult, given that terms such as Nash equilibrium, minimax, maximin, optimization may not resonate in a 6th grade classroom. Instead I've introduced game theory using the rock-paper-scissors (RPS) game. Turns out kids are excellent gametheoreticians. In RPS, they understood both the benefits of randomizing their own strategy and of predicting their opponent's moves. They offered a number of heuristics both for the prediction and opening move. These heuristics included optimizing against past opponent moves, such as not playing rock if the opponent just played scissors, and playing a specific opening hand, such as "paper". Visualizing the effects of such strategic choices on-the-fly would be interesting and educational. This brief essay attempts demonstrating and visualizing the value of a few different strategic options in RPS. Specifically, we would like to illustrate the following: 1) what is the value of being unpredictable?; and 2) what is the value of being able to predict your opponent? In regard to prediction of human players, the question 2) has been reflected in Jon McLoone's entry in Wolfram Blog from January 20, 2014[1]. McLoone created a predictive algorithm for playing against human opponents, that learns to beat human opponents reliably after approximately 30 - 40 games. I use McLoone's implementation to represent a predictive and random strategies. The rest of this documents 1) investigates performance of this predictive strategy against a random strategy (which is optimal in RPS) and in 2) attempts to turn this predictive power against the predictive strategy by allowing the opponent the full knowledge of the predictor's strategy (but not the choices made using the strategy). This exposes a weakness in predictions made without taking risks into account by illustrating that predictive strategy may make the predictor predictable as well.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2018

Convex Relaxations in Power System Optimization, A Brief Introduction

Convex relaxations of the AC power ow equations have attracted signi cant interest in the power systems research community in recent years. The following collection of video lectures provides a brief introduction to the mathematics of AC power systems, continuous nonlinear optimization, and relaxations of the power ow equations. The aim of the videos is to provide the high level ideas of convex relaxations and their applications in power system optimization, and could be used as a starting point for researchers who want to study, use or develop new convex relaxations for use in their own research. The videos do not aim to provide an in-depth tutorial about speci c convex relaxations, but rather focus on ideas that are common to all convex relaxations of the AC optimal power ow problem. The videos assume minimal prerequisite knowledge and are designed to be accessible to a variety of disciplines (e.g. power system engineers, industrial engineers and computer scientists). They are designed to be modular, such that interested listeners can either watch the series as a whole, or choose only the subset that matches their interest. The following sections provide a brief overview of the topics and references covered in each video.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2016

PRA technology and regulatory perspectives P-111

The course is divided into two parts. The first part of the course presents basic PRA concepts and terminology in a lecture format supplemented with student exercises, some exercises using actual plant PRAs, and required reading of agency PRA policy and guidance documents. This portion of the course includes a closed-book exam at the beginning of the second week. The second part of the course is a series of integrated workshops that build upon the material presented in the first part of the course. The second part culminates with an open-book exam at the end of the second week.

98 NUCLEAR DISARMAMENT, SAFEGUARDS, AND PHYSICAL P↗
DOE OSTI2018

4th Kokkos Bootcamp [Poster]

Scope and Objectives: Kokkos Support provides cyber resources and conducts training events for current and prospective Kokkos users; In person training events are organized in various venues providing both generic Kokkos tutorials with lectures and exercises, as well as hands-on work on users applications.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2018

Final Report on "Collaborative Research to Narrow Uncertainties in Precipitation and the Hydrological Cycle in Climate Models"

The central objectives of this work have been to explore and improve the depiction of precipitation and related processes in climate models by developing and analyzing observations and their gridded analyses, and developing new approaches and metrics. All three groups worked with the NCAR-based Community Earth System Model (CESM) and international community Climate Model Inter-comparison Project version 5 (CMIP5) models in various ways. At NCAR and SUNYA an initial focus was on the observational record, including updating of the river discharge dataset. A major focus at NCAR was extensive work on new datasets of hourly precipitation from CMORPH (observations) and CESM, and commentary on and validation of the CESM. SUNYA contributed to the comparison and evaluation of existing precipitation products widely used in climate research, the analysis of precipitation characteristics in CESM and other CMIP5 models, and decadal precipitation variability associated with decadal variability. At NCAR and SUNYA work was focused on the frequency and intensity of precipitation, including their dependence on the temporal and spatial resolution of the data used to calculate the frequency and intensity, as well as additional analyses on the effects of precipitation data uncertainties on the estimated historical drying trends. LLNL focused on the diurnal cycle. New insights have resulted in the characteristics of precipitation (frequency, intensity, amount, duration, diurnal cycle, covariability in space and time) and evaluation of these in models. In general models perform poorly and this provides a much-needed focus on what aspects of models are greatly in need of improvement. A substantial number of papers have now been published on these topics. The focus on the characteristics of precipitation and not just amount also provides a natural entrée into examining the extremes of precipitation, that are very important to the general public in terms of impacts. Examples are the deluges from Florence and Harvey, and extensive work has been performed on the latter. On the other side of the coin, considerable work has been performed on dry spells and drought, including improvements in a drought index. There has been considerable outreach to the general public, especially through the media, but also via talks and lectures, and a strong educational component at SUNYA. For example, the Harvey paper has an altimetrics rating of 827 and is the highest for any paper from that journal, it is at the 99th percentile of all papers of the same age, and is in the top 95 percent of all papers. The energy cycle and ocean heat content has been another focus. The entire atmospheric energy cycle has been reformulated and applied to the latest data to include effects from the enthalpy of precipitation. Relationships between ocean heat content and sea level rise have also been extensively explored in observations and models, with new insights into the role of Mount Pinatubo volcanic eruption on distorting and hiding the accelerating sea level rise. This work has been also widely featured in news media. The “year without a summer” has also been explored in the past using models, and how changes in the vertical structure and stability of the ocean with a warming climate may influence a future such volcanic event by amplifying the surface temperature response.

58 GEOSCIENCES↗