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DOE OSTI2024

Observational benchmarks inform representation of soil organic carbon dynamics in land surface models

Abstract. Representing soil organic carbon (SOC) dynamics in Earth system models (ESMs) is a key source of uncertainty in predicting carbon–climate feedbacks. Machine learning models can help identify dominant environmental controllers and establish their functional relationships with SOC stocks. The resulting knowledge can be integrated into ESMs to reduce uncertainty and improve predictions of SOC dynamics over space and time. In this study, we used a large number of SOC field observations (n=54 000), geospatial datasets of environmental factors (n=46), and two machine learning approaches (namely random forest, RF, and generalized additive modeling, GAM) to (1) identify dominant environmental controllers of global and biome-specific SOC stocks, (2) derive functional relationships between environmental controllers and SOC stocks, and (3) compare the identified environmental controllers and predictive relationships with those in models used in Phase 6 of the Coupled Model Intercomparison Project (CMIP6). Our results showed that the diurnal temperature, drought index, cation exchange capacity, and precipitation were important observed environmental predictors of global SOC stocks. While the RF model identified 14 environmental factors that describe climatic, vegetation, and edaphic conditions as important predictors of global SOC stocks (R2=0.61, RMSE = 0.46 kg m−2), current ESMs oversimplify the relationships between environmental factors and SOC, with precipitation, temperature, and net primary productivity explaining > 96 % of the variability in ESM-modeled SOC stocks. Further, our study revealed notable disparities among the functional relationships between environmental factors and SOC stocks simulated by ESMs compared with observed relationships. To improve SOC representations in ESMs, it is imperative to incorporate additional environmental controls, such as the cation exchange capacity, and refine the functional relationships to align more closely with observations.

54 ENVIRONMENTAL SCIENCES↗

NASA NTRS1989

A novel multistage estimation of the signal parameters of a possibly data-modulated sinusoid under very high dynamics

A novel multistage estimation scheme is presented for estimating the parameters of a received carrier signal possibly phase-modulated by unknown data, and experiencing very high Doppler, Doppler rate, etc. Such a situation arises, for example, in the case of Global Positioning Systems (GPS) where the signal parameters are directly related to the position, velocity, acceleration and jerk of the GPS receiver. In the proposed multistage scheme, the first stage estimator operates as a coarse estimator resulting in higher rms estimation errors but with a relatively small probability of the frequency estimation error exceeding one-half of the sampling frequency (an event termed cycle slip). The second state of the estimator operates on the error signal available from the first stage, refining the overall estimates, and in the process also reduces the number of cycle slips. The first stage algorithm is selected to be a modified least squares algorithm operating upon the differential signal model and referred to as differential least squares. This estimation stage provides relatively coarse estimates of the frequency and its derivatives. The second algorithm is simply an extended Kalman filter which also yields the estimate of the phase along with a more refined estimate of frequency as well. A major advantage of the proposed algorithm is a reduction in the threshold on received carrier power-to-noise power spectral density ratio as compared to the threshold achievable by either of these algorithms alone. In fact, it appears from the simulations that for the case of an unmodulated carrier, the proposed scheme achieves the same threshold as for an almost exact and computationally intensive implementation of the maximum likelihood estimator.

Kumar, Rajendra↗

NASA NTRS2017

The Global Precipitation Measurement (GPM) Mission for Science and Society

Precipitation is a key source of freshwater; therefore, observing global patterns of precipitation and its intensity is important for science, society, and understanding our planet in a changing climate. In 2014, the National Aeronautics and Space Administration (NASA) and the Japan Aerospace Exploration Agency (JAXA) launched the Global Precipitation Measurement (GPM) Core Observatory (CO) spacecraft. The GPM CO carries the most advanced precipitation sensors currently in space including a dual-frequency precipitation radar provided by JAXA for measuring the three-dimensional structures of precipitation and a well-calibrated, multifrequency passive microwave radiometer that provides wide-swath precipitation data. The GPM CO was designed to measure rain rates from 0.2 to 110.0 mm h1 and to detect moderate to intense snow events. The GPM CO serves as a reference for unifying the data from a constellation of partner satellites to provide next-generation, merged precipitation estimates globally and with high spatial and temporal resolutions. Through improved measurements of rain and snow, precipitation data from GPM provides new information such as details on precipitation structure and intensity; observations of hurricanes and typhoons as they transition from the tropics to the midlatitudes; data to advance near-real-time hazard assessment for floods, landslides, and droughts; inputs to improve weather and climate models; and insights into agricultural productivity, famine, and public health. Since launch, GPM teams have calibrated satellite instruments, refined precipitation retrieval algorithms, expanded science investigations, and processed and disseminated precipitation data for a range of applications. The current status of GPM, its ongoing science, and its future plans are presented.

Gail Skofronick-Jackson↗

DOE OSTI2026

Rare Earth Production in the United States: A Concise Review of Resource Development and Commercial Processes

This review article presents a concise review of estimated resources, processing methods and challenges involved in domestic rare earth mining projects in the United States (US). It also highlights the current status of major mining projects, anticipated rare earth production in the near future, and commercial projects utilizing non-traditional feedstocks for rare earth production and recycling. Based on the current industry outlook, opportunities for R&D have also been highlighted. Perspective on domestic rare earth production capability is essential because global rare earth production is currently dominated by China. Given potential export controls by China, this imbalance has created supply chain risk. The US and other countries have limited rare earth production capacity and relatively little expertise in rare earth processing. However, in the last decade, efforts have been made by several nations, including the US, to reduce their reliance on China for rare earth and other critical minerals. The US is currently investing in projects to develop domestic rare earth separation and refining capacity. These projects are discussed here. When backed by R&D and government support, these projects have potential to make significant progress towards establishment of domestic rare earth separation capabilities.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

DOE OSTI2013

On the reproducibility of protein crystal structures: five atomic resolution structures of trypsin

Details of five very high-resolution accurate structures of bovine trypsin are compared in the context of the reproducibility of models obtained from crystals grown under identical conditions. Structural studies of proteins usually rely on a model obtained from one crystal. By investigating the details of this model, crystallographers seek to obtain insight into the function of the macromolecule. It is therefore important to know which details of a protein structure are reproducible or to what extent they might differ. To address this question, the high-resolution structures of five crystals of bovine trypsin obtained under analogous conditions were compared. Global parameters and structural details were investigated. All of the models were of similar quality and the pairwise merged intensities had large correlation coefficients. The C{sup α} and backbone atoms of the structures superposed very well. The occupancy of ligands in regions of low thermal motion was reproducible, whereas solvent molecules containing heavier atoms (such as sulfur) or those located on the surface could differ significantly. The coordination lengths of the calcium ion were conserved. A large proportion of the multiple conformations refined to similar occupancies and the residues adopted similar orientations. More than three quarters of the water-molecule sites were conserved within 0.5 Å and more than one third were conserved within 0.1 Å. An investigation of the protonation states of histidine residues and carboxylate moieties was consistent for all of the models. Radiation-damage effects to disulfide bridges were observed for the same residues and to similar extents. Main-chain bond lengths and angles averaged to similar values and were in agreement with the Engh and Huber targets. Other features, such as peptide flips and the double conformation of the inhibitor molecule, were also reproducible in all of the trypsin structures. Therefore, many details are similar in models obtained from different crystals. However, several features of residues or ligands located in flexible parts of the macromolecule may vary significantly, such as side-chain orientations and the occupancies of certain fragments.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

NASA NTRS2007

Launching to the Moon, Mars, and Beyond

America is returning to the Moon in preparation for the first human footprint on Mars, guided by the U.S. Vision for Space Exploration. This presentation will discuss NASA's mission today, the reasons for returning to the Moon and going to Mars, and how NASA will accomplish that mission. The primary goals of the Vision for Space Exploration are to finish the International Space Station, retire the Space Shuttle, and build the new spacecraft needed to return people to the Moon and go to Mars. Unlike the Apollo program of the 1960s, this phase of exploration will be a journey, not a race. In 1966, the NASA's budget was 4 percent of federal spending. Today, with 6/10 of 1 percent of the budget, NASA must incrementally develop the vehicles, infrastructure, technology, and organization to accomplish this goal. Fortunately, our knowledge and experience are greater than they were 40 years ago. NASA's goal is a return to the Moon by 2020. The Moon is the first step to America's exploration of Mars. Many questions about the Moon's history and how its history is linked to that of Earth remain even after the brief Apollo explorations of the 1960s and 1970s. This new venture will carry more explorers to more diverse landing sites with more capable tools and equipment. The Moon also will serve as a training ground in several respects before embarking on the longer, more perilous trip to Mars. The journeys to the Moon and Mars will require a variety of vehicles, including the Ares I Crew Launch Vehicle, the Ares V Cargo Launch Vehicle, the Orion Crew Exploration Vehicle, and the Lunar Surface Access Module. The architecture for the lunar missions will use one launch to ferry the crew into orbit on the Ares I and a second launch to orbit the lunar lander and the Earth Departure Stage to send the lander and crew vehicle to the Moon. In order to reach the Moon and Mars within a lifetime and within budget, NASA is building on proven hardware and decades of experience derived from the Apollo Saturn, Space Shuttle, and contemporary commercial launch vehicle programs. Less than one year after the Exploration Launch Projects Office was formed at NASA's Marshall Space Flight Center, engineers are testing engine components, firing test rocket motors, refining vehicle designs in wind tunnel tests, and building hardware for the first flight test of Ares I, scheduled for spring 2009. The Vision for Exploration will require this nation to develop tools, machines, materials, and processes never before invented, technologies and capabilities that can be turned over to the private sector to benefit nearly all aspects of life on Earth. This new pioneering venture, as did the Apollo Program before it, will contribute to America's economic leadership, national security, and technological global competitiveness and serve as an inspiration for all its citizens.

Sumrall, John P.↗

NASA NTRS1984

Refinement and evaluation of helicopter real-time self-adaptive active vibration controller algorithms

A Real-Time Self-Adaptive (RTSA) active vibration controller was used as the framework in developing a computer program for a generic controller that can be used to alleviate helicopter vibration. Based upon on-line identification of system parameters, the generic controller minimizes vibration in the fuselage by closed-loop implementation of higher harmonic control in the main rotor system. The new generic controller incorporates a set of improved algorithms that gives the capability to readily define many different configurations by selecting one of three different controller types (deterministic, cautious, and dual), one of two linear system models (local and global), and one or more of several methods of applying limits on control inputs (external and/or internal limits on higher harmonic pitch amplitude and rate). A helicopter rotor simulation analysis was used to evaluate the algorithms associated with the alternative controller types as applied to the four-bladed H-34 rotor mounted on the NASA Ames Rotor Test Apparatus (RTA) which represents the fuselage. After proper tuning all three controllers provide more effective vibration reduction and converge more quickly and smoothly with smaller control inputs than the initial RTSA controller (deterministic with external pitch-rate limiting). It is demonstrated that internal limiting of the control inputs a significantly improves the overall performance of the deterministic controller.

Davis, M. W.↗

DOE OSTI2025

Exploration of Electronic and Magnetic Properties of Ceria for Applications of Microwave Assisted Catalysis

This was presented at APS Global Physics Summit 2025 in Anaheim, CA. This study focuses on characterizing how vacancies and other dopants influence the electronic and magnetic properties of ceria and exploring the potential mechanisms by which these properties affect or control its catalytic behavior under microwave radiation. By examining ceria’s electronic response to external electromagnetic fields, specifically magnetic fields within the microwave range, the work aims to uncover insights into how microwaves might optimize catalytic effects. The study also includes a comparative analysis of different functionals to refine understanding of ceria’s electronic behavior and catalytic efficacy in these applications.

ammonia synthesis↗

DOE OSTI2022

Investigating coastal backwater effects and flooding in the coastal zone using a global river transport model on an unstructured mesh

Abstract. Coastal backwater effects are caused by the downstream water level increase as a result of elevated sea level, high river discharge and their compounding influence. Such effects have crucial impacts on floods in densely populated regions but have not been well represented in large-scale river models used in Earth system models (ESMs), partly due to model mesh deficiency and oversimplifications of river hydrodynamics. Using two mid-Atlantic river basins as a testbed, we perform the first attempt to simulate the backwater effects comprehensively over a coastal region using the MOSART river transport model under an ESM framework, i.e., Energy Exascale Earth System Model (E3SM) configured on a regionally refined unstructured mesh, with a focus on understanding the backwater drivers and their long-term variations. By including sea level variations at the river downstream boundary, the model performance in capturing backwaters is greatly improved. We also propose a new flood event selection scheme to facilitate the decomposition of backwater drivers into different components. Our results show that while storm surge is a key driver, the influence of extreme discharge cannot be neglected, particularly when the river drains to a narrow river-like estuary. Compound flooding, while not necessarily increasing the flood peaks, exacerbates the flood risk by extending the duration of multiple coastal and fluvial processes. Furthermore, our simulations and analysis highlight the increasing strength of backwater effects due to sea level rise and more frequent storm surge during 1990–2019. Thus, backwaters need to be properly represented in ESMs to improve the predictive understanding of coastal flooding.

54 ENVIRONMENTAL SCIENCES↗

NASA NTRS2004

Refinement of Phobos Ephemeris Using Mars Orbiter Laser Altimeter Radiometry

Radiometric observations from the Mars Orbiter Laser Altimeter (MOLA) can be used to improve the ephemeris of Phobos, with particular interest in refining estimates of the secular acceleration due to tidal dissipation within Mars. We have searched the Mars Orbiter Laser Altimeter (MOLA) radiometry data for shadows cast by the moon Phobos, finding 7 such profiles during the Mapping and Extended Mission phases, and 5 during the last two years of radiometry operations. Preliminary data suggest that the motion of Phobos has advanced by one or more seconds beyond that predicted by the current ephemerides, and the advance has increased over the 5 years of Mars Global Surveyor (MGS) operations.

Neumann, G. A.↗

DOE OSTI2015

Structural, Functional, and Immunogenic Insights on Cu,Zn Superoxide Dismutase Pathogenic Virulence Factors from Neisseria meningitidis and Brucella abortus

ABSTRACT Bacterial pathogens Neisseria meningitidis and Brucella abortus pose threats to human and animal health worldwide, causing meningococcal disease and brucellosis, respectively. Mortality from acute N. meningitidis infections remains high despite antibiotics, and brucellosis presents alimentary and health consequences. Superoxide dismutases are master regulators of reactive oxygen and general pathogenicity factors and are therefore therapeutic targets. Cu,Zn superoxide dismutases (SODs) localized to the periplasm promote survival by detoxifying superoxide radicals generated by major host antimicrobial immune responses. We discovered that passive immunization with an antibody directed at N. meningitidis SOD (NmSOD) was protective in a mouse infection model. To define the relevant atomic details and solution assembly states of this important virulence factor, we report high-resolution and X-ray scattering analyses of NmSOD and of SOD from B. abortus (BaSOD). The NmSOD structures revealed an auxiliary tetrahedral Cu-binding site bridging the dimer interface; mutational analyses suggested that this metal site contributes to protein stability, with implications for bacterial defense mechanisms. Biochemical and structural analyses informed us about electrostatic substrate guidance, dimer assembly, and an exposed C-terminal epitope in the NmSOD dimer. In contrast, the monomeric BaSOD structure provided insights for extending immunogenic peptide epitopes derived from the protein. These collective results reveal unique contributions of SOD to pathogenic virulence, refine predictive motifs for distinguishing SOD classes, and suggest general targets for antibacterial immune responses. The identified functional contributions, motifs, and targets distinguishing bacterial and eukaryotic SOD assemblies presented here provide a foundation for efforts to develop SOD-specific inhibitors of or vaccines against these harmful pathogens. IMPORTANCE By protecting microbes against reactive oxygen insults, SODs aid survival of many bacteria within their hosts. Despite the ubiquity and conservation of these key enzymes, notable species-specific differences relevant to pathogenesis remain undefined. To probe mechanisms that govern the functioning of Neisseria meningitidis and Brucella abortus SODs, we used X-ray structures, enzymology, modeling, and murine infection experiments. We identified virulence determinants common to the two homologs, assembly differences, and a unique metal reservoir within meningococcal SOD that stabilizes the enzyme and may provide a safeguard against copper toxicity. The insights reported here provide a rationale and a basis for SOD-specific drug design and an extension of immunogen design to target two important pathogens that continue to pose global health threats.

38 RADIATION CHEMISTRY, RADIOCHEMISTRY, AND NUCLEA↗

NASA NTRS1983

The 1980 US/Canada wheat and barley exploratory experiment, volume 1

The results from the U.S./Canada Wheat and Barley Exploratory Experiment which was completed during FY 1980 are presented. The results indicate that the new crop identification procedures performed well for spring small grains and that they are conductive to automation. The performance of the machine processing techniques shows a significant improvement over previously evaluated technology. However, the crop calendars will require additional development and refinements prior to integration into automated area estimation technology. The evaluation showed the integrated technology to be capable of producing accurate and consistent spring small grains proportion estimates. However, barley proportion estimation technology was not satisfactorily evaluated. The low-density segments examined were judged not to give indicative or unequivocal results. It is concluded that, generally, the spring small grains technology is ready for evaluation in a pilot experiment focusing on sensitivity analyses to a variety of agricultural and meteorological conditions representative of the global environment. It is further concluded that a strong potential exists for establishing a highly efficient technology or spring small grains.

Bizzell, R. M.↗

NASA NTRS1985

Hot Spots on Io: Correlation of Infrared Emission and Visible Reflectance

The Voyager 1 infrared spectrometer (IRIS) data and two recently compiled data sets (Voyager imaging mosaics and measurements of Io's thermal emission from the NASA Infrared Telescope Facility) are correlated. These data were used to refine the correlation between dark spot optical properties (albedo and color) and thermal emission, to examine this correspondence on a satellite-wide scale, and to identify additional hot spots not included in the IRIS inventory. The results suggest the hot spots are liquid sulfur lava lakes, for the following reasons: (1) the melting point of sulfur is 390 K, and the model hot spot temperatures range from approximately 200 to 450 K; (2) the albedos and color of the dark spots, measured from the global mosaics, are consistent with laboratory measurements for liquid sulfur; (3) high resolution images of the dark features show morphologies suggestive of lava lakes; and (4) this hypothesis provides a simple and direct explanation for why dark spots are hot on Io.

Mcewen, A. S.↗

NASA NTRS1989

An embedded grid formulation applied to delta wings

An embedded grid algorithm for the Euler and/or Navier-Stokes equations is developed and applied to delta wings at high angles of attack in low speed flow. The Navier-Stokes code is an implicit, finite volume algorithm, using flux difference splitting for the convective and pressure terms and central differencing for the viscous and heat transfer terms. Calculations are compared with detailed experimental results over an angle of attack range up to and beyond the maximum lift coefficient, corresponding to vortex breakdown at the trailing edge, for a delta wing nominally of unit aspect ratio. The results indicate that the overall flowfield, including surface pressures, surface streamlines, and vortex trajectories, can be simulated accurately with the global grid version of the present algorithm. However, comparison of computed velocities and vorticity with experimentally measured off-body values at an angle of attack of 20.5 deg indicates the core region is substantially more diffuse in the computations than that measured with either a five-hole probe or a laser velocimeter. Embedded grids, used to improve the numerical discretization in the core region, are formulated within the framework of the implicit, upwind-biased multi-grid algorithm. Structured levels of local nested refinements are made. Three-dimensional results for both Euler and Navier-Stokes calculations are shown, with up to 3 levels of embedded refinement. The embedding procedure was effective in eliminating a crossflow secondary separation produced in the Euler solutions on coarse grids.

Thomas, James L.↗

NASA NTRS2010

Quantifying Uncertainty in Projections of Stratospheric Ozone Over the 21st Century

Future stratospheric ozone concentrations will be determined both by changes in the concentration of ozone depleting substances (ODSs) and by changes in stratospheric and tropospheric climate, including those caused by changes in anthropogenic greenhouse gases (GHGs). Since future economic development pathways and resultant emissions of GHGs are uncertain, anthropogenic climate change could be a significant source of uncertainty for future projections of stratospheric ozone. In this pilot study, using an ensemble of opportunity of chemistry-climate model (CCM) simulations, the contribution of scenario uncertainty from different plausible emissions pathways for 10 ODSs and GHGs to future ozone projections is quantified relative to the contribution from model uncertainty and internal variability of the chemistry-climate system. For both the global, annual mean ozone concentration and for ozone in specific geographical regions, differences between CCMs are the dominant source of uncertainty for the first two-thirds of the 21 st century, up-to and after the time when ozone concentrations 15 return to 1980 values. In the last third of the 21st century, dependent upon the set of greenhouse gas scenarios used, scenario uncertainty can be the dominant contributor. This result suggests that investment in chemistry-climate modelling is likely to continue to refine projections of stratospheric ozone and estimates of the return of stratospheric ozone concentrations to pre-1980 levels.

Charlton-Perez, A. J.↗

NASA NTRSDate not supplied

Advancing Satellite-Constrained Modeled Air-Sea CO 2 Fluxes With a Focus on the Strength of the Southern Ocean Carbon Sink

Challenge and Motivation: The ocean plays a critical role in mitigating climate change by removing approximately a quarter of annual anthropogenic CO 2 emissions from the atmosphere. Model-based estimates point to the Southern Ocean as a key marine region, responsible for approximately 40 % of the anthropogenic carbon uptake by the global ocean. However, the contemporary strength of the Southern Ocean carbon sink has recently come into question. On the one hand, airborne-based observations of atmospheric CO 2 gradients indicate that the Southern Ocean represents a strong net sink of atmospheric CO 2 , consistent in magnitude with atmospheric inversion estimates and surface-ocean partial pressure of CO 2 (pCO 2 )-based products. On the other hand, estimates of pCO 2 based on in situ pH measurements taken by biogeochemical profiling floats yield strong wintertime outgassing fluxes that greatly reduce the Southern Ocean’s annually integrated CO 2 uptake. This uncertainty in the strength of the Southern Ocean air-sea CO 2 flux and its role in the global carbon cycle hinders our ability to constrain global carbon fluxes, one of the major goals of NASA’s Carbon Monitoring System (CMS). Opportunity: The NASA Ocean Biogeochemical Model (NOBM) produces near-global pCO 2 and air-sea CO 2 flux estimates that are currently included into the NASA’s Goddard Earth Observing System (GEOS) models in support of the CMS effort to monitor global carbon fluxes. The NOBM assimilates ocean color data to improve the representation of biogeochemical fluxes and overcome spatial and temporal gaps in the space-based retrievals. Here, we propose to advance the satellite-constrained flux estimates by investigating the uncertainties in the Southern Ocean air-sea CO 2 flux produced by the NOBM, and assess the value that remote sensing ocean color data can have in providing improved estimates of carbon fluxes in the ocean. Our proposed work includes the delivery of refined in situ float-based carbon fluxes to serve as a constraint on the model-based estimates. Taking advantage of the model’s integration of satellite ocean color data to represent multiple phytoplankton groups, we propose to deliver maps of biogenic carbon export specific to each modeled phytoplankton type and investigate the role of ecological plankton complexity in regulating marine carbon uptake and export. Goals: (a) Delivery of seasonally-adjusted float-based Southern Ocean air-sea CO 2 fluxes: We will produce updated and improved float-based air-sea CO 2 fluxes that will serve as a bias-reduced float-based constraint to evaluate our model-based estimates of the NOBM. (b) Investigation of uncertainties in Southern Ocean air-sea CO 2 flux from the NOBM: Modeled air-sea carbon fluxes will be evaluated against the updated float product as well as ship- and airborne-based data to identify uncertainties and potential model deficiencies. (c) Delivery of model-based carbon export partitioning by phytoplankton functional types (PFTs): We will produce depth-resolved maps of particulate organic export production integrated for all phytoplankton groups and allocated to each individual PFT in the model. The expected significance of this goal is to quantify the role that the functional-oriented diversity in phytoplankton groups represented in the NOBM plays in regulating air-sea CO 2 fluxes in the Southern Ocean.

Lionel A. Arteaga↗

DOE OSTI2014

Performance and Fabrication Status of TREAT LEU Conversion Conceptual Design Concepts

Resumption of transient testing at the TREAT facility was approved in February 2014 to meet U.S. Department of Energy (DOE) objectives. The National Nuclear Security Administration’s Global Threat Reduction Initiative Convert Program is evaluating conversion of TREAT from its existing highly enriched uranium (HEU) core to a new core containing low enriched uranium (LEU). This paper describes briefly the initial pre-conceptual designs screening decisions with more detailed discussions on current feasibility, qualification and fabrication approaches. Feasible fabrication will be shown for a LEU fuel element assembly that can meet TREAT design, performance, and safety requirements. The statement of feasibility recognizes that further development, analysis, and testing must be completed to refine the conceptual design. Engineering challenges such as cladding oxidation, high temperature material properties, and fuel block fabrication along with neutronics performance, will be highlighted. Preliminary engineering and supply chain evaluation provided confidence that the conceptual designs can be achieved.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

DOE OSTI2015

Novel pathways for fuels and lubricants from biomass optimized using life-cycle greenhouse gas assessment

Decarbonizing the transportation sector is critical to achieving global climate change mitigation. Although biofuels will play an important role in conventional gasoline and diesel applications, bioderived solutions are particularly important in jet fuels and lubricants, for which no other viable renewable alternatives exist. Producing compounds for jet fuel and lubricant base oil applications often requires upgrading fermentation products, such as alcohols and ketones, to reach the appropriate molecular-weight range. Ketones possess both electrophilic and nucleophilic functionality, which allows them to be used as building blocks similar to alkenes and aromatics in a petroleum refining complex. Here, we develop a method for selectively upgrading biomass-derived alkyl methyl ketones with >95% yields into trimer condensates, which can then be hydrodeoxygenated in near-quantitative yields to give a new class of cycloalkane compounds. The basic chemistry developed here can be tailored for aviation fuels as well as lubricants by changing the production strategy. We demonstrate that a sugarcane biorefinery could use natural synergies between various routes to produce a mixture of lubricant base oils and jet fuels that achieve net life-cycle greenhouse gas savings of up to 80%.

09 BIOMASS FUELS↗