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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 883 records · Page 49

Sensitivity and Bias in Searches of Cockpit Display of Traffic Information Utilizing Highlighting/Lowlighting

A previous investigation showed that when bright and dim traffic symbols were mixed together on a cockpit display of traffic information, dim targets required longer search times than bright targets. The current experiment utilized Signal Detection methodology to determine the cause of this effect. Two factors were manipulated, Intensity and Mixture. The Intensity manipulation varied whether targets were bright or dim. The Mixture manipulation varied whether the brightness of all aircraft symbols was the same, or if half were bright and half dim. Participants were given 1.25 s to search a display of eight aircraft and determine whether a target was present or absent (50% of the time a target was present) and then rated their confidence in the accuracy of their decision. A Mixture by Intensity repeated-measures ANOVA on the signal detectability measure, A (a non- parametric variant of d ), revealed that targets presented at the dim intensity in the mixed condition yielded significantly lower sensitivity than either of the pure (homogenous) conditions or the bright targets in the mixed condition. There was not a significant difference in False Alarm rates between any conditions, indicating no change in decision criterion. Findings are discussed in terms of possible masking effects evoked by bright aircraft over the dim aircraft. Funding for this work was provided by the Advanced Air Transportation Technologies Project of NASA s Airspace Operation Systems Program.

Johnson, Walter W.↗

Benchmark Wall Heat Flux Data for a GO2/GH2 Single Element Combustor

Wall heat flux measurements in a 1.5 in. diameter circular cross-section rocket chamber for a uni-element shear coaxial injector element operating on gaseous oxygen (GOz)/gaseous hydrogen (GH,) propellants are presented. The wall heat flux measurements were made using arrays of Gardon type heat flux gauges and coaxial thermocouple instrumentation. Wall heat flux measurements were made for two cases. For the first case, GOZ/GHz oxidizer-rich (O/F=l65) and fuel-rich preburners (O/F=1.09) integrated with the main chamber were utilized to provide vitiated hot fuel and oxidizer to the study shear coaxial injector element. For the second case, the preburners were removed and ambient temperature gaseous oxygen/gaseous hydrogen propellants were supplied to the study injector. Experiments were conducted at four chamber pressures of 750, 600, 450 and 300psia for each case. The overall mixture ratio for the preburner case was 6.6, whereas for the ambient propellant case, the mixture ratio was 6.0. Total propellant flow was nominally 0.27-0.29 Ibm/s for the 750 psia case with flowrates scaled down linearly for lower chamber pressures. The axial heat flux profile results for both the preburner and ambient propellant cases show peak heat flux levels a t axial locations between 2.0 and 3.0 in. from the injector face. The maximum heat flux level was about two times greater for the preburner case. This is attributed to the higher injector fuel-to-oxidizer momentum flux ratio that promotes mixing and higher initial propellant temperature for the preburner case which results in a shorter reaction zone. The axial heat flux profiles were also scaled with respect to the chamber pressure to the power 0.8. The results at the four chamber pressures for both cases collapsed to a single profile indicating that at least to first approximation, the basic fluid dynamic structures in the flow field are pressure independent as long as the chamber/njector/nozzle geometry and injection velocities remain the same.

Marshall, William M.↗

Computational Tools to Design Molten Salt Electrolytes for High-Temperature Environments

Current Li-ion batteries are designed for a small operating window of 5 °C to 55 °C. Modifications to the electrolyte for operation in Mars atmosphere extended this range on the lower bound to ~ -40 °C. These operating-temperature ranges are far from those presented in high-temperature environments, such as the Venus surface, where temperatures are around 450 °C. Protecting the state-of-the-art Li-ion batteries require insulations that decreases the volumetric capacity and limiting the operational time-window. These unique challenges require a paradigm shift in materials used for designing high-temperature batteries. Molten salt electrolyte-based batteries offer a plausible route to designing high-temperature batteries. ZEBRA batteries are known to be one of the safest energy storage devices operating at 270-350 °C. Nitrate based eutectics, operating at 150 °C have also been used in Li-O2 batteries. In this study, we will examine molten-salt electrolyte transport and electrochemical properties using first-principles computations and benchmark against experiments. Further, we will present thermodynamics-based models for designing and predicting melting point of molten salt mixtures. Based on these computational tools, new molten salt mixtures designed with desired operating temperatures and electrochemical windows will be presented. Implications of these new eutectics in the context of high-temperature environment exploration will also be discussed.

Balachandran Radhakrishnan↗

Analysis of Double-encapsulated Fuel Rods

In an LWR fuel rod, the cladding encapsulates the fuel, contains fission products, and transfers heat directly to the water coolant. In some situations, it may be advantageous to separate the cladding from the coolant through use of a secondary cladding or capsule. This may be done to increase confidence that the fuel or fission products will not mix with the coolant, to provide a mechanism for controlling the rod temperature, or to place multiple experimental rodlets within a single housing. With an axisymmetric assumption, it is possible to derive closed-form expressions for the temperature profile in a fuel rod using radially-constant thermal conductivity in the fuel. This is true for both a traditional fuel-cladding rod and a double-encapsulated fuel (fuel, cladding, capsule) configuration. Likewise, it is possible to employ a fuel performance code to analyse both a traditional and a double-encapsulated fuel. In the case of the latter, two sets of gap heat transfer conditions must be imposed. In this work, we review the equations associated with radial heat transfer in a cylindrical system, present analytic and computational results for a postulated power and gas mixture history for IFA-744, and describe the analysis of the AFC-2A, 2B metallic fuel alloy experiments at the Advanced Test Reactor, including the effect of a release of fission products into the cladding-capsule gap. The computational results for these two cases were obtained using BISON, a fuel performance code under development at Idaho National Laboratory.

BISON↗

The 1953 Stanley L. Miller Experiment: Fifty Years of Prebiotic Organic Chemistry

The field of prebiotic chemistry effectively began with a publication in Science 50 years ago by Stanley L. Miller on the spark discharge synthesis of amino acids and other compounds using a mixture of reduced gases that were thought to represent the components of the atmosphere on the primitive Earth. On the anniversary of this landmark publication, we provide here an accounting of the events leading to the publication of the paper. We also discuss the historical aspects that lead up to the landmark Miller experiment.

Lazcano, Antonio↗

The 1953 Stanley L. Miller Experiment: Fifty Years of Prebiotic Organic Chemistry

The field of prebiotic chemistry effectively began with a publication in Science 50 years ago by Stanley L. Miller on the spark discharge synthesis of amino acids and other compounds using a mixture of reduced gases that were thought to represent the components of the atmosphere on the primitive Earth. On the anniversary of this landmark publication, we provide here an accounting of the events leading to the publication of the paper. We also discuss the historical aspects that lead up to the landmark Miller experiment.

Lazcano, Antonio↗

Shock-Induced Solid-State Reactions in Powders: An Experimentally-Based Reassessment

We have performed a series of ten planar impact experiments on six different materials, including certain reactive powders and two inert materials, using Sandia's 89 - mm powder gun at the STAR facility. Time - resolved particle - velocity histories were determined during each of the experiments from one or more VISAR measurements. We have analyzed the results of these measurements 1) by using jump conditions to determine shock and first reshock states and 2) by comparing measured particle velocity histories to synthetic histories predicted by one - dimensional computational analyses using the CTH shock physics code with various models for inert and reactive materials . These comparisons are consistent with the conclusion for these particular reactive powders, that for the duration of shock loading either 1) there is insignificant reaction or 2) the products of any reaction are indistinguishable from the reactants under the experimental conditions. Shock and reshock states were extracted for shock pressures between 5 and 40 GPa. Densities were at or greater than the theoretical maximum zero - pressure density of the starting mixture. This result would be expected if there were no reaction or negligible reaction for the first two shock states. Two experiments were performed on one reactive powder in a "ring - down " geometry to look for evidence of vapor production on pressure release. In both cases, the measured velocity continued to increase slowly over a period of microseconds for the du ration of the experiment. This observation suggests that vapor is produced along the release path, but information about the mechanism for vapor production cannot be extracted from these data. While it is possible that vapor is produced by a shock - induced reaction involving more than one of the original constituents, a simpler interpretation is that the vapor is made up of products of shock - induced decomposition reactions and/or simple vaporization of the constituents as would be expected to take place under the conditions of these experiments. Other sources of vapor could be water adsorbed on grain surfaces and air originally in the voids. Thus it is not necessary to invoke significant recombination reactions to explain the data. However, in the absence of ring - down control experiments, the possibility remains open. These conclusions are different from those of previous workers, but reassessment of a subset of the earlier data yields results consistent with the present work, i.e., the shock compression data do not provide evidence for strong exothermic reactions.

36 MATERIALS SCIENCE↗

Some Recent Observations on the Burning of Isolated N-Heptane and Alcohol Droplets

In a joint program involving Prof F.A. Williams of the University of California, San Diego and Dr. Vedha Nayagam of the National Center for Microgravity Research on Fluid and Combustion, the combustion of liquid fuel droplets having initial diameters between about 1 mm and 6 mm is being studied. The objectives of the work are to improve fundamental knowledge of droplet combustion dynamics through microgravity experiments and theoretical analyses. The Princeton contributions to the collaborative program supports the engineering design, data analysis, and data interpretation requirements for the study of initially single component, spherically symmetric, isolated droplet combustion studies through experiments and numerical modeling. The complementary UCSD contributions apply asymptotic theoretical analyses and are described in the published literature and in a companion communication in this volume. Emphases of the Princeton work are on the study of simple alcohols (methanol, ethanol), alcohol/water mixtures, and pure alkanes (n-heptane, n-decane) as fuels, with time dependent measurements of drop size, flame-stand-off, liquid-phase composition, and finally, extinction. Ground based experiments have included bench-scale studies at Princeton and collaborative experimental studies in the 2.2 and 5.18 second drop towers at NASA-Glenn Research Center. Spacelab studies have included fiber-supported droplet combustion (FSDC) experiments in the Glovebox facility with accompanying numerical analyses. Experiments include FSDC-1, performed on the USML-2 mission in October, 1995 (STS-73) and FSDC-2, on the second flight of the MSL-1 mission in July, 1997 (STS-94).

Dryer, F. L.↗

Matrix-isolation and ab initio study of HKrCCCl and HXeCCCl

We report on two new noble-gas molecules, HKrCCCl and HXeCCCl, prepared in low-temperature Kr and Xe matrices. These molecules are made by UV photolysis of HCCCl in the matrices and subsequent thermal annealing. The HCCCl precursor is produced by microwave discharge of a mixture of a matrix gas with trichloroethylene (HClC=CCl{sub 2}). The assignments of the new noble-gas molecules are supported by deuteration experiments and quantum chemical calculations at the MP2(full) and CCSD(T) levels of theory with the def2-TZVPPD basis set. No evidence of ClXeCCH, which is computationally reliably stable, is found in the experiments. ClKrCCH as well as the Ar compounds HArCCCl and ClArCCH are not observed either, which is in agreement with the calculations.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Design, testing and emplacement of sand-bentonite for the construction of a gas-permeable seal test (gast)

The main aim of a gas-permeable seal is to increase the gas transport capacity of the backfilled underground structures without compromising the radionuclide retention capacity of the engineered barrier system or the host rock. Such a seal, proposed by NAGRA as part of the 'Engineered Gas Transport System' in a L/ILW repository, considers specially designed backfill and sealing materials such as sand/bentonite (S/B) mixtures with a bentonite content of 20- 30%. NAGRA's RD and D plan foresees demonstrating the construction and performance of repository seals and improving the understanding and the database for reliably predicting water and gas transport through these systems. The fluid flow and gas transport properties of these backfills have been determined at the laboratory scale and through modelling the maximum gas pressures in the near field of a repository system and the gas flow rates have been evaluated. Within this context, the Gas-permeable Seal Test (GAST) was constructed at Grimsel Test Site (GTS) to validate the effective functioning of gas-permeable seals at realistic scale. The intrinsic permeability of such seals should be in the order of 10-18 m2. Because the construction of S/B seals is not common practice for construction companies, a stepwise approach was followed to evaluate different construction and quality assurance methods. As a first step, an investigation campaign with simple tests in the laboratory and in the field followed by 1:1 scale pre-tests at GTS was performed. Through this gradual increase of the degree of complexity, practical experience was gained and confidence in the methods and procedures to be used was built, which allowed reliably producing and working with S/B mixtures at a realistic scale. During the whole pre-testing phase, a quality assurance (QA) programme for S/B mixtures was developed and different methods were assessed. They helped to evaluate and choose appropriate emplacement techniques and methodologies to achieve the target S/B dry density of 1.70 g/cm{sup 3}, which results in the desired intrinsic permeability throughout the experiment. The final QA methodology was targeted at engineering measures to decide if the work can proceed, and at producing high resolution material properties database for future water and gas transport modelling activities. The different applied QA techniques included standard core cutter tests, the application of neutron-gamma (Troxler) probes and two mass balance methods (2D and 3D). The methods, looking at different representative scales, have provided only slightly different results and showed that the average density of the emplaced S/B plug was between 1.65 and 1.73 g/cm{sup 3}. Spatial variability of dry densities was observed at decimeter scale. Overall, the pre-testing and QA programme performed for the GAST project demonstrated how the given design criteria and requirements can be met by appropriately planning and designing the material emplacement. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

Recent results from the University of Washington's 38 mm ram accelerator

The ram accelerator is a propulsive device that accelerates projectiles using gasdynamic cycles similar to those which generate thrust in airbreathing ramjets. The projectile, analogous to the centerbody of a ramjet, travels supersonically through a stationary tube containing a gaseous fuel and oxidizer mixture. The projectile itself carries no onboard propellant. A combustion zone follows the projectile and stabilizes the shock structure. The resulting pressure distribution continuously accelerates the projectile. Several modes of ram accelerator operation have been investigated experimentally and theoretically. At velocities below the Chapman-Jouguet (C-J) detonation speed of the propellant mixture, the thermally choked propulsion mode accelerates the projectiles. At projectile velocities between approximately 90 and 110 percent of the C-J speed, a transdetonative propulsion mode occurs. At velocities beyond 110 percent of the C-J speed, projectiles experience superdetonative propulsion. This paper presents recent experimental results from these propulsion modes obtained with the University of Washington's 38-mm bore ram accelerator. Data from investigations with hydrogen diluted-gas mixtures are also introduced.

De Turenne, J. A.↗

Investigation of the thermal conductivity of molten LiF-NaF-KF with experiments, theory, and equilibrium molecular dynamics

Molten salts are being proposed for numerous advanced energy applications, including advanced nuclear reactors, concentrating solar power plants, thermal energy storage, and fusion reactors. Accurate knowledge of the thermophysical properties of molten salts directly impact the performance of these energy systems and are essential for design and safety analyses. Thermal conductivity data for fluoride molten salts and mixtures are especially lacking. In this work, experimental measurements of thermal conductivity using the steady-state variable gap technique were performed on eutectic LiF-NaF-KF from 834 to 1195 K. The experiment accounts for radiative, convective, and conductive heat losses. In addition, theoretical and molecular dynamics models are used, from 750 K up to 1300 K, to estimate the thermal conductivity for comparison with the experimental results. The results of experiments show a weak negative deviation of thermal conductivity with temperature, unlike previous experimental results in the literature. The measured thermal conductivity magnitudes agree with the theoretical and molecular dynamics predictions, aside from the data above 1100 K, where heat losses and radiative errors are the most significant, having a 16% maximum deviation from theory. These experimental results provide new thermal conductivity data for the LiF-NaF-KF system and further validation of the predictive models. The theoretical model was used to map the composition and temperature dependent thermal conductivity of LiF-NaF-KF and the mapping’s deviation from a linear additivity estimation of thermal conductivity. Additionally, this mapping showed the highest deviations from linearity for KF-LiF rich mixtures and increasing deviation with temperature. Notably, the deviation from linearity near the LiF-NaF-KF eutectic composition was around 25%.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

A crucible salt saturation method for determining sulfur solubility in glass melt

Experiments were conducted to determine sulfur solubility in Hanford low-activity waste (LAW) glass melts by a sulfur saturation method. Sulfur-incorporated glass melts were prepared by salt saturation and bubbling methods. The salt saturation method was performed by mixing crushed pre-melted baseline glasses with an excess amount of Na2SO4 prior to melting the mixture at 1150°C for one hour. The bubbling method involved bubbling the glass melt at 1150°C in a Pt crucible with an SO2/O2/N2 gas mix to equilibrate the melt at a known pressure of SO3. Preliminary results suggested that performing one cycle of mixing and melting was not sufficient to saturate the glass. The bubbling method successfully incorporated sulfur into the glass but caused significant losses of sodium from the melt. In order to saturate the glass melt with sulfate without causing noticeable sodium loss, a modified crucible salt saturation method was developed by repeating the mixing and melting of the glass and salt mixture. For all three representative LAW glasses tested in this study, it was found that after three mixing and melting cycles, the sulfur concentration reaches a plateau, indicating reasonable sulfur saturation.

Jin, Tongan↗

The carbon dioxide chaperon efficiency for the reaction H + O2 + M yields HO2 + M from ignition delay times behind reflected shock waves

Ignition delay times for stoichiometric hydrogen-oxygen in argon with and without carbon dioxide were measured behind reflected shock waves. A 20-reaction kinetic mechanism models the measured hydrogen-oxygen delay times over the temperature range 950 to 1300 K. The chaperon efficiency for carbon dioxide determined for the hydrogen-oxygen carbon dioxide mixture was 7.0. This value is in agreement with literature values but much less than a recent value obtained from flow tube experiments. Delay times measured behind a reflected shock wave were about 20% longer than those measured behind incident shock waves. The kinetic mechanism successfully modeled the high-pressure data of Skinner and the hydrogen-air data of Stack. It is suggested that the lowest temperature points for the hydrogen-air data of Slack are unreliable and that the 0.27-atm data may illustrate a case where vibrational relaxation of nitrogen is important. The reaction pathway HO2 yields H2O2 yields OH yields H was required to model the high-pressure data of Skinner. The successful modeling of the stoichiometric hydrogen-air data demonstrates the appropriateness of deriving kinetic models from data for gas mixtures highly diluted with argon. The technique of reducing a detailed kinetic mechanism to only the important reactions for a limited range of experimental data may render the mechanism useless for other test conditions.

Brabbs, Theodore A.↗

Flory-Huggins parameter χ, from binary mixtures of Lennard-Jones particles to block copolymer melts

In this contribution, we develop a coarse-graining methodology for mapping specific block copolymer systems to bead-spring particle-based models. We map the constituent Kuhn segments to Lennard-Jones particles, and establish a semi-empirical correlation between the experimentally determined Flory-Huggins parameter χ and the interaction of the model potential. For these purposes, we have performed an extensive set of isobaric–isothermal Monte Carlo simulations of binary mixtures of Lennard-Jones particles with the same size but with asymmetric energetic parameters. The phase behavior of these monomeric mixtures is then extended to chains with finite sizes through theoretical considerations. Such a top-down coarse-graining approach is important from a computational point of view, since many characteristic features of block copolymer systems are on time and length scales which are still inaccessible through fully atomistic simulations. We demonstrate the applicability of our method for generating parameters by reproducing the morphology diagram of a specific diblock copolymer, namely, poly(styrene-b-methyl methacrylate), which has been extensively studied in experiments.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

SPE-CZE-MS Quantifies Zeptomole Amounts of Phosphorylated Peptides

Capillary zone electrophoresis (CZE) is gaining attention in the field of single-cell proteomics for its ultralow-flow and high-resolution separation abilities. Even more sample-limited yet rich in biological information are phosphoproteomics experiments, as the phosphoproteome composes only a fraction of the whole cellular proteome. Rapid analysis, high sensitivity, and maximization of sample utilization are paramount for single-cell analysis. Some challenges of coupling CZE analysis with mass spectrometry analysis (MS) of complex mixtures include 1. sensitivity due to volume loading limitations of CZE and 2. incompatibility of MS duty cycles with electropherographic time scales. Here, we address these two challenges as applied to singlecell- equivalent phosphoproteomics experiments by interfacing a microchip-based CZE device integrated with a solid-phaseextraction (SPE) bed with the Orbitrap Astral mass spectrometer. Using 225 phosphorylated peptide standards and phosphorylated peptide-enriched mouse brain tissue, we investigate microchip-based SPE-CZE functionality, quantitative performance, and complementarity to nano-LC-MS (nLC-MS) analysis. We highlight unique SPE-CZE separation mechanisms that can empower fitfor- purpose applications in single-cell-equivalent phosphoproteomics.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

An ECT/ERT dual-modality sensor for oil-water two-phase flow measurement

This paper presents a new sensor for ECT/ERT dual-modality system which can simultaneously obtain the permittivity and conductivity of the materials in the pipeline. Quasi-static electromagnetic fields are produced by the inner electrodes array sensor of electrical capacitance tomography (ECT) system. The results of simulation show that the data of permittivity and conductivity can be simultaneously obtained from the same measurement electrode and the fusion of two kinds of data may improve the quality of the reconstructed images. For uniform oil-water mixtures, the performance of designed dual-modality sensor for measuring the various oil fractions has been tested on representative data and the results of experiments show that the designed sensor broadens the measurement range compared to single modality.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

Characterizing the contribution of bioaerosols diversity from complex aerosol particle samples.

Current global change scenarios expect to significantly increase the contribution of pollen to the total organic aerosol budget. In addition, pollen can burst into smaller fragments that are highly efficient as cloud condensation nuclei. However, current climate models still do not incorporate the effects of these particles due to detection and quantification challenges in complex aerosol mixtures. Chemical biomarkers (i.e. fructose) have commonly been used to trace pollen but this approximation can generate false positive results given the large number of shared compounds between different bioaerosols. A previous pilot EMSL experiment performed on pure pollen samples suggested that using a set of metabolites as a fingerprint of bioaerosols could serve to substantially increase detection accuracy over single biomarker approaches. In this proposal we developed novel bioinformatic strategies to characterize and quantify complex pollen mixtures present in the atmosphere. For that, we used diverse machine learning algorithms to analyze metabolic fingerprints from complex mixtures of different pollen acquired with high-resolution mass spectrometry (Orbitrap Q-Exactive). Our preliminary results demonstrated the potential to accurately discern and identify at specific relative abundances different pollen species in complex mixtures. Our research will lead to a significant advancement in the atmospheric chemistry and provide much needed data to improve the accuracy of climate models.

54 ENVIRONMENTAL SCIENCES↗