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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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At least 901 records · Page 50
All sourcesNASA NTRSDOE OSTI
DOE OSTI2018

A Workshop on the History of Plutonium Processing at Hanford Washington as the Foundation for Modern-day Plutonium Process Science

Numerous national laboratories in the United States have roots related to the Manhattan Project that contributed to the end of World War II. The pioneering science and engineering that took place over the decades that followed continues to influence modern-day actinide-related research at those institutions, leading to unique strengths and cutting-edge ideas and perspectives. These same national laboratories also face a challenge: figuring out how to capture the expertise of a retiring workforce who had first-hand experience in these pioneering nuclear efforts. Recently, at PNNL a “Train-the-Trainer” approach has been piloted where mentors and mentees are paired together to develop and deliver interactive workshops on historical topics that relate to modern-day research, such as Plutonium Processing or Environmental Management of Legacy Nuclear Waste. This approach was used to develop a workshop that beings with the Historic Hanford process plutonium chemistry and engineering, describes its influence on current plutonium separation and process science, and then details the chemistry of plutonium as it progresses from a minor constituent in irradiated fuel to purified solid product. This workshop is targeted to the practitioner of applied science and technology wishing to gain a better understanding of the history and process-related chemistry of element 94 so that they may better direct the tools of their specific craft toward the present and future needs of plutonium science.

Smith, Frances N.↗
DOE OSTI2021

On-board separation of oxygenates from fuels

Methods for separation of oxygenates or other chemical components from fuels using chemical processes and separations including, but not limited to, onboard applications in vehicles. These separations may take place using a variety of materials and substances whereby a target material of interest is captured, held, and then released at a desired location and under desired conditions. In one set of experiments we demonstrated an enhancement in the separation of diaromatics by >38 times over gasoline and aromatics by >3.5 times over gasoline. This would give an advantage to reducing cold-start emissions, or emissions during transient conditions, in either gasoline or diesel.

Bays, John T.↗
DOE OSTI2023

Microporous metal–organic frameworks for the purification of propylene

Separation of propylene from its analogous hydrocarbons such as propane is of great importance in the petrochemical industry to produce valuable chemical feedstocks with desired purity. However, the well-established method currently used for industrial propane/propylene separation is energy intensive. It involves repeated cycling in the cryogenic and high-pressure distillation process and requires multiple columns and high reflux ratios because of the very similar physical properties of the two species. Thus, it is identified as one of the most capital- and energy-intensive processes. Adsorptive separation based on porous adsorbents is regarded as an alternative energy-efficient technology to replace or supplement the traditional heat-driven cryogenic distillation processes. In this context, metal–organic frameworks (MOFs) have emerged as the most promising candidates for propane/propylene separation, taking into consideration their unique tunability with respect to pore geometry and pore functionality. In this highlight, we summarize the latest advancement in developing MOFs as physisorbents for the separation and purification of propylene from propane, with a focus on those that demonstrate selective molecular exclusion and propane-selective adsorption. We discuss the adsorption preferences related to the material design and separation mechanisms, and review the existing challenges. Lastly, we offer our perspectives on various strategies for the future design of MOFs that hold true potential for propylene purification under industrial settings.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2021

Exploring QCD Factorization at Moderate Energy Scales

Asymptotic freedom in QCD facilitates the use of partonic degrees of freedom over short distances, but physical processes are sensitive to a wide range of scales. Thus, it is necessary in QCD calculations to utilize a factorization scheme to separate a process into perturbative and non-perturbative factors. This separation relies on an assumption that one energy scale is infinitely larger than the other scales involved in the process. However, much experimental research in areas such as nucleon structure and quark-hadron duality occur at more moderate energy scales where that basic assumption may not be true but perturbative calculations should still be useful. Thus, an exploration of the limits of factorization at more moderate energy scales is needed. This dissertation examines various aspects of factorization at these energy scales first by applying the necessary approximations to a simple model where exact calculations are possible and so the effects of these approximations can be quantified. This is followed by examining areas where corrections are known to be needed. First is an exploration of target mass corrections (TMCs) in the case of deep inelastic scattering (DIS), including a discussion of what large corrections imply about the target structure. Second, is a general examination of PDFs and FFs at moderate scales. Third, I will discuss how this fits into the long-term effort to study the transition between small transverse momentum (generated non-perturbatively) and large transverse momentum (generated in the hard process)

Moffat, Eric↗
DOE OSTI2016

Fabrication of ThN Using a Carbothermic Reduction to Nitridation Process

A carbothermic reduction to nitridation process was developed which is capable of producing high-purity thorium mononitride (ThN) in bulk quantities. This was accomplished through study of three distinct processing routes using thermogravimetric analysis. The information gathered was then used to guide development of a draft process, which was tested within a tungsten production furnace. Scaling issues were identified and corrected following the draft process. Finally, a partitioned process was developed in response to the draft process which separates the reduction from the nitridation and carbon cleanup steps. This partitioned process was demonstrated to be capable of producing phase-pure ThN, with oxygen and carbon impurities of 990 ± 130 wppm and 240 ± 30 wppm, respectively.

36 MATERIALS SCIENCE↗
NASA NTRS1977

Thermochemical water decomposition

At present, nearly all of the hydrogen consumed in the world is produced by reacting hydrocarbons with water. As the supply of hydrocarbons diminishes, the problem of producing hydrogen from water alone will become increasingly important. Furthermore, producing hydrogen from water is a means of energy conversion by which thermal energy from a primary source, such as solar or nuclear fusion of fission, can be changed into an easily transportable and ecologically acceptable fuel. The attraction of thermochemical processes is that they offer the potential for converting thermal energy to hydrogen more efficiently than by water electrolysis. A thermochemical hydrogen-production process is one which requires only water as material input and mainly thermal energy, or heat, as an energy input. Attention is given to a definition of process thermal efficiency, the thermodynamics of the overall process, the single-stage process, the two-stage process, multistage processes, the work of separation and a process evaluation.

Funk, J. E.↗
NASA NTRS1992

Possible biomedical applications and limitations of a variable-force centrifuge on the lunar surface: A research tool and an enabling resource

Centrifuges will continue to serve as a valuable research tool in gaining an understanding of the biological significance of the inertial acceleration due to gravity. Space- and possibly lunar-based centrifuges will play a significant and enabling role with regard to the human component of future lunar and martian exploration, both as a means of accessing potential health and performance risks and as a means of alleviating these risks. Lunar-based centrifuges could be particularly useful as part of a program of physiologic countermeasures designed to alleviate the physical deconditioning that may result from prolonged exposure to a 1/6-g environment. Centrifuges on the lunar surface could also be used as part of a high-fidelity simulation of a trip to Mars. Other uses could include crew readaptation to 1 g, waste separation, materials processing, optical mirror production in situ on the Moon, and laboratory specimen separation.

Cowing, Keith L.↗
DOE OSTI2018

Aqueous Reprocessing of Used Nuclear Fuel

Aqueous reprocessing of used nuclear fuel has a long history of successful operation worldwide. The history of aqueous reprocessing and a description of current and past operating aqueous reprocessing facilities are provided and the main types of solvent extraction equipment utilized in the nuclear industry are described. While the PUREX process is well established for separating U and Pu from used nuclear fuel, numerous variants to the PUREX process are being developed and are described. Finally, advanced separation processes in which minor actinides are separated from the used nuclear fuel are a key research focus worldwide. These processes and the current state of development are discussed.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗
DOE OSTI2017

Chabazite Zeolite Membranes for Krypton/Xenon Separation: Control of Membrane Properties and Process Modeling

Nuclear energy is considered to be a clean and economical means of carbon-free energy. As part of the overall process for recycling used nuclear fuel (UNF), it is necessary to develop technologies to separate the off-gases formed during the fission of uranium and plutonium in nuclear power reactors. The off-gas stream is generated during the shearing and chopping, voloxidation, and acid dissolution steps, and would have a flow rate of ∼2500 L/min assuming a typical 800 tons heavy metal/yr reprocessing facility. Kr separation from Xe is one of the steps in a proposed UNF off-gas processing flowsheet. The Kr/Xe mixture is approximately 10/90 by volume and hence the separation of Kr would reduce the volume of radioactive {sup 85}Kr waste by a factor of 10. Kr/Xe separation is challenging since they are both chemically inert species and physically very similar (0.036 nm size difference). There is no existing process for this separation that is suitable for use in UNF recycling since conventional cryogenic distillation requires highly intensive power and large system volume. Membrane-based separation using radiation-stable materials such as zeolites could be an attractive separation method, if membranes with sufficient Kr flux and selectivity can be fabricated. Zeolite membranes offer an opportunity to exploit the size difference of Kr (kinetic diameter 0.36 nm) and Xe (0.396 nm) to achieve preferential permeation of the minority component (Kr) from the mixture, leading to an efficient separation with very low energy requirements. An ideal membrane process would permeate a stream of pure Kr for storage and also produce pure Xe which has commercial value (> $8000/kg at 99+% purity). SAPO-34 is a silico-alumino-phosphate zeolite molecular sieve with CHA framework topology and containing uniform micropores (0.38 nm), intermediate in size between the kinetic diameters of Kr and Xe. It was hypothesized that SAPO-34 membranes can separate krypton and xenon by diffusivity differences. Previously we fabricated SAPO-34 membranes and showed that they are capable of separating Kr from Xe. Our previous work also indicated that there is much potential for engineering the separation properties of these membranes with a view to improving permeance and selectivity and evaluating the expected process performance. The main objectives of the present study are: 1) development of SAPO-34 membranes with enhanced membrane performance via thickness reduction and ion exchange, and 2) process modeling for technic-economic analysis of zeolite membrane systems for Kr/Xe separation.

36 MATERIALS SCIENCE↗
DOE OSTI2014

Using High Performance Computing to Examine the Processes of Neurogenesis Underlying Pattern Separation and Completion of Episodic Information

Adult neurogenesis in the hippocampus region of the brain is a neurobiological process that is believed to contribute to the brain's advanced abilities in complex pattern recognition and cognition. Here, we describe how realistic scale simulations of the neurogenesis process can offer both a unique perspective on the biological relevance of this process and confer computational insights that are suggestive of novel machine learning techniques. First, supercomputer based scaling studies of the neurogenesis process demonstrate how a small fraction of adult-born neurons have a uniquely larger impact in biologically realistic scaled networks. Second, we describe a novel technical approach by which the information content of ensembles of neurons can be estimated. Finally, we illustrate several examples of broader algorithmic impact of neurogenesis, including both extending existing machine learning approaches and novel approaches for intelligent sensing.

Aimone, James Bradley↗
DOE OSTI2024

Carbon Capture through Membranes - Leveraging Multiphysics Modeling, Dimensional Analysis and Machine Learning to Scale up and Optimize Devices and Processes for Decarbonization

We study the separation performance using membrane modules through dimensional analysis (DA). We formulate the main process equations to identify relevant dimensionless numbers inherent in the physics. In particular, we identify that the critical step in the separation process is mass transfer through the selective layer. Remarkably, the dimensionless feed flow (DFfeed) emerges as a crucial factor in describing this process. Not only does DFfeed directly appear in the governing equations, but it also holds a physical significance associated with the time scales for the mass transfer across the feed side and through the selective layer. Regarding the output performance variables, we consider the recovery, stage cut, productivity and purity. In this context, we profit from experimental data and CFD simulations to evaluate the separation performance of the modules when varying the input flowrate, the scale of the module, and the CO2 permeance. These datasets enable us to establish correlations between performance metrics and the dimensionless feed flow (DFfeed). Using simple power functions of DFfeed, we obtain R2 coefficients exceeding 0.99, indicating the accuracy of the correlations built in the present work. In the future, we wish to use DA to understand key transport mechanisms, predict and control module performance, and challenge the universality of these findings by testing various gas separations across different membrane modules beyond our case study.

Pedrozo, Hector A.↗
DOE OSTI2011

Optimization of carbon capture systems using surrogate models of simulated processes.

With increasing demand placed on power generation plants to reduce carbon dioxide (CO2) emissions, processes to separate and capture CO2 for eventual sequestration are highly sought after. Carbon capture processes impart a parasitic load on the power plants; it is estimated that this would increase the cost of electricity from existing pulverized coal plants anywhere from 71-85 percent [1]. The National Energy and Technology Lab (NETL) is working to lower this to below a 30 percent increase. To reach this goal, work is being done not only to accurately simulate these processes, but also to leverage those accurate and detailed simulations to design optimal carbon capture processes. The major challenges include the lack of accurate algebraic models of the processes, computationally costly simulations, and insufficiently robust simulations. The first challenge bars the use of provable derivative-based optimization algorithms. The latter two can either lead to difficult or impossible direct derivative-free optimization. To overcome these difficulties, we take a more indirect method to solving this problem by, first, generating an accurate set of algebraic surrogate models from the simulation then using derivative-based solvers to optimize the surrogate models. We developed a method that uses derivative-based and derivative-free optimization alongside machine learning and statistical techniques to generate the set of low-complexity surrogate models using data sampled from detailed simulations. The models are validated and improved through the use of derivative-free solvers to adaptively sample new simulation points. The resulting surrogate models can then be used in a superstructure-based process synthesis and solved using derivative-based methods to optimize carbon capture processes.

01 COAL, LIGNITE, AND PEAT↗
DOE OSTI2018

Post-Fermentation Recovery of Biobased Carboxylic Acids

Carboxylic acids are common products produced from the bioconversion of renewable feedstocks. In these processes the separation of the acid product from fermentation broth is the most energy and cost intensive unit operation. Thus, the development of robust, scalable separation approaches that can be applied to a variety of carboxylates is of critical importance to the development of processes that utilize carboxylic acids as platform chemicals. Here we report a batch separation method that includes cell and particulate removal, cation exchange, activated carbon treatment, dewatering with a polymer resin, and product recovery. This method is demonstrated on two unique fermentation broths both derived from corn stover hydrolysate to separate neat succinic and propionic acid. For succinic acid, a crystallization yield of 91% with a product purity of 99.93% was achieved. To our knowledge this is the highest reported crystallization yield and purity for the recovery of succinic acid. Additionally, the method requires approximately 50% less energy compared to standard evaporative crystallization approaches. For propionic acid, neat liquid product was obtained with a distillation yield of 80% and purity of 98%. Finally, these excellent results achieved in terms of yield and purity for succinic and propionic acid, two acids with widely different physical properties, from chemically complex hydrolysate broth demonstrates the effective and robust nature of this approach.

09 BIOMASS FUELS↗
DOE OSTI2012

Landfill mining: A critical review of two decades of research

Highlights: Black-Right-Pointing-Pointer We analyze two decades of landfill mining research regarding trends and topics. Black-Right-Pointing-Pointer So far landfill mining has mainly been used to solve waste management issues. Black-Right-Pointing-Pointer A new perspective on landfills as resource reservoirs is emerging. Black-Right-Pointing-Pointer The potential of resource extraction from landfills is significant. Black-Right-Pointing-Pointer We outline several key challenges for realization of resource extraction from landfills. - Abstract: Landfills have historically been seen as the ultimate solution for storing waste at minimum cost. It is now a well-known fact that such deposits have related implications such as long-term methane emissions, local pollution concerns, settling issues and limitations on urban development. Landfill mining has been suggested as a strategy to address such problems, and in principle means the excavation, processing, treatment and/or recycling of deposited materials. This study involves a literature review on landfill mining covering a meta-analysis of the main trends, objectives, topics and findings in 39 research papers published during the period 1988-2008. The results show that, so far, landfill mining has primarily been seen as a way to solve traditional management issues related to landfills such as lack of landfill space and local pollution concerns. Although most initiatives have involved some recovery of deposited resources, mainly cover soil and in some cases waste fuel, recycling efforts have often been largely secondary. Typically, simple soil excavation and screening equipment have therefore been applied, often demonstrating moderate performance in obtaining marketable recyclables. Several worldwide changes and recent research findings indicate the emergence of a new perspective on landfills as reservoirs for resource extraction. Although the potential of this approach appears significant, it is argued that facilitating implementation involves a number of research challenges in terms of technology innovation, clarifying the conditions for realization and developing standardized frameworks for evaluating economic and environmental performance from a systems perspective. In order to address these challenges, a combination of applied and theoretical research is required.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗
NASA NTRS1977

Gold recovery process from polyimide film

Process economically separates gold from goldized polyimide film and other nonmetallic scrap without hazards of conventional processes. Technique uses nitric acid to destroy nonmetallic material, leaving gold intact.

Houston, D. W.↗
DOE OSTI2020

Designer Metal–Organic Frameworks for Size–Exclusion–Based Hydrocarbon Separations: Progress and Challenges

The separation of hydrocarbons is of primary importance in the petrochemical industry but remains a challenging process. Hydrocarbon separations have traditionally relied predominantly on costly and energy intensive heat-driven procedures such as low temperature distillations. Adsorptive separation based on porous solids represents an alternative technology that is potentially more energy efficient for the separation of some hydrocarbons. Great efforts have been made recently not only on the development of adsorbents with optimal separation performance but also towards the subsequent implementation of adsorption-based separation technology. Emerging as a relatively new class of multifunctional porous materials, metal-organic frameworks hold substantial promise as adsorbents for highly efficient separation of hydrocarbons. This is because of their exceptional and intrinsic porosity tunability which enables size-exclusion based separations that render the highest possible separation selectivity. In this review, we highlight the recent advances in the development of MOFs for separation of selected groups of hydrocarbons, including methane/C2 hydrocarbons, normal alkanes, alkane isomers, alkane/alkene/alkyne, and C8 alkylaromatics, with a particular focus on separations based on size-exclusion mechanism. Insights into tailor-made structures, material design strategies, and structure-property relations will be elucidated. In addition, the existing challenges and possible future directions of this important research field will be discussed.

36 MATERIALS SCIENCE↗
DOE OSTI2015

Experimental Investigation of Electric Contact Resistance in Spark Plasma Sintering Tooling Setup

An experimental investigation on electric contact resistance in the tooling utilized in spark plasma sintering (SPS) is conducted. Two different SPS regimes are operated without the presence of processed powder to obtain the punch–punch (horizontal) and punch–die (vertical) contact resistance assessments separately. The processing temperature and applied pressure are considered to be the main factors that affect the contact resistance. These effects are analyzed by performing experiments at a maximum temperature of 1600°C with constant heating rate of 100°C/min. The applied pressure is ranging from 20 to 60 MPa and a 1 min holding time‐step is used to ensure stable measurements. It is shown that the contact resistance goes down as the temperature ramps up. An increase in the pressure leads to a decrease in the contact resistance. The mechanisms that cause these variations in the contact resistance are discussed. The dependence of assessed contact resistance of the utilized SPS system on the processing temperature and applied pressure is analytically described based on the regression analysis of the collected experimental data. A finite‐element simulation based on the obtained experimental results evidences that the electric contact resistance dominates the temperature evolution. The obtained results are of significant importance for modeling and optimization of SPS processes.

Wei, Xialu↗
DOE OSTI2018

Scale Up of Malonic Acid Fermentation Process: Cooperative Research and Development Final Report, CRADA Number CRD-16-612

The goal of this work is to use the large fermentation vessels in the National Renewable Energy Laboratory's (NREL) Integrated Biorefinery Research Facility (IBRF) to scale-up Lygos' biological-based process for producing malonic acid and to generate performance data. Initially, work at the 1 L scale validated successful transfer of Lygos' fermentation protocols to NREL using a glucose substrate. Outside of the scope of the CRADA with NREL, Lygos tested their process on lignocellulosic sugars produced by NREL at Lawrence Berkeley National Laboratory's (LBNL) Advanced Biofuels Process Development Unit (ABPDU). NREL produced these cellulosic sugar solutions from corn stover using a separate cellulose/hemicellulose process configuration. Finally, NREL performed fermentations using glucose in large fermentors (1,500- and 9,000-L vessels) to intermediate product and to demonstrate successful performance of Lygos' technology at larger scales.

09 BIOMASS FUELS↗