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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 523 records · Page 29
All sourcesNASA NTRSDOE OSTI
DOE OSTI2022

Whole-plant phenotypic engineering: moving beyond ratios for multi-objective optimization of nutrient use efficiency

Nutrient use efficiency (NUE) is typically measured as the ratio of yield to soil nutrient availability but ignores contributions of underlying plant traits. Relevant plant traits can be grouped as root acquisition efficiency, shoot radiation use efficiency, and plant metabolic efficiency. The intentional integration of these traits will lead to synergistic improvements of NUE. Recent progress in trait-focused research includes phenotyping root nutrient uptake rates and respiration, engineering reduced photorespiration, and identification of nutrient assimilation pathways. Traits need to be conceptualized in agricultural systems contexts to improve synchrony of plant demand and soil supply of nutrients, including consideration of crop mixtures. Use of simulation modeling and multi-objective optimization will allow accelerating NUE gains beyond selection for a single ratio.

59 BASIC BIOLOGICAL SCIENCES↗
DOE OSTI2024

A regularized-interface method as a unified formulation for simulations of high-pressure multiphase flows

The injection of multi-species fluids into high-pressure and high-temperature environments beyond the species' critical points is commonly found in engineering applications. At these conditions, for immiscible species, both subcritical interfacial dynamics and supercritical mixing can coexist due to variations in temperature around the mixture critical point. The modeling of these complex transcritical phenomena for large-scale configurations is so far not possible. To address this issue, we propose the Regularized-Interface Method (RIM) as a unified formulation that can describe both sub- and supercritical processes as well as the transition between them. The proposed method is derived via filtering of the nanoscale interface-resolving formulation based on van der Waals' linear gradient theory. Thus, this approach allows for the consistent modeling of interfacial dynamics that vanishes at supercritical conditions, while significantly reducing the temporal and spatial resolution constraints of the original nanoscale formulation. The resulting RIM formulation is examined in interface-capturing simulations of sub-, trans-, and supercritical fuel injection processes, involving droplets and jets. Furthermore, these results highlight the importance of resolving spatio-temporal transitions from subcritical interfacial dynamics to supercritical mixing in high-pressure multiphase simulations, in contrast to commonly employed diffused-interface methods, where interfacial dynamics are often neglected.

Interface capturing↗
DOE OSTI2020

Selecting Adsorbents to Separate Diverse Near-Azeotropic Chemicals

Industrial separations of near-azeotropic chemicals, species with very similar boiling points, are energy- and capital-intensive. Adsorption-based processes can energy-efficiently separate near-azeotropic mixtures provided suitable adsorbent materials can be found. Among the full diversity of industry-relevant molecules, millions of these mixtures exist, meaning that discovery of mixture-specific adsorbents by direct experiment is infeasible. We show that vast numbers of adsorbents and adsorbing molecules can be explored in a powerful way by coupling atomistic simulations with machine learning. This concept is demonstrated by describing the adsorption of ~54000 industry-relevant chemicals in an experimentally derived set of thousands of metal–organic framework materials. Here, our results identify thousands of near-azeotropic mixtures that can be efficiently separated using adsorption and open possibilities for creating adsorption processes for complex mixtures with many components.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2024

Diamond precipitation dynamics from hydrocarbons at icy planet interior conditions

The pressure and temperature conditions at which precipitation of diamond occurs from hydrocarbon mixtures is important for modelling the interior dynamics of icy planets. However, there is substantial disagreement from laboratory experiments, with those using dynamic compression techniques finding much more extreme conditions are required than in static compression. Here we report the time-resolved observation of diamond formation from statically compressed polystyrene, (C 8 H 8 ) n , heated using the 4.5 MHz X-ray pulse trains at the European X-ray Free Electron Laser facility. Diamond formation is observed above 2,500 K from 19 GPa to 27 GPa, conditions representative of Uranus’s and Neptune’s shallow interiors, on 30 μs to 40 μs timescales. This is much slower than may be observed during the ~10 ns duration of typical dynamic compression experiments, revealing reaction kinetics to be the reason for the discrepancy. In conclusion, reduced pressure and temperature conditions for diamond formation has implications for icy planetary interiors, where diamond subduction leads to heating and could drive convection in the conductive ice layer that has a role in their magnetic fields.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2024

Optical and transport properties of plasma mixtures from ab initio molecular dynamics

Predicting the charged particle transport properties of warm dense matter/hot dense plasma mixtures is a challenge for analytical models. High accuracy ab initio methods are more computationally expensive, but can provide critical insight by explicitly simulating mixtures. In this work, we investigate the transport properties and optical response of warm dense carbon–hydrogen mixtures at varying concentrations under either conserved electronic pressure or mass density at a constant temperature. We compare options for mixing the calculated pure species properties to estimate the results of the mixtures. We find that a combination of the Drude model with the Matthiessen's rule works well for DC electron transport and low-frequency optical response. This breaks down at higher frequencies, where a volumetric mix of pure-species AC conductivities works better.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
NASA NTRS1977

Bhatnagar-Gross-Krook model solution of back-scattering of outgas flow from spherical spacecraft

The BGK kinetic model for a binary mixture of gases was used to predict the backscattering return flux of molecules outgassing from a spherical spacecraft. For simplicity, the outgassing molecules were considered to be a single species, with the ambient atmospheric molecules being the second species in the binary mixture. Two basic collision mechanisms were considered: 1) collisions involving only outgas molecules (self-scattering); and 2) collisions between outgas molecules and molecules in the ambient atmosphere (ambient-scattering). Results were obtained in the form of simple equations relating outgas return flux to parameters based on outgas characteristics, spacecraft size, and the characteristics of the ambient flow.

Robertson, S. J.↗
NASA NTRS1979

Prebiotic nucleotide oligomerization in a fluctuating environment - Effects of kaolinite and cyanamide

The clay kaolinite was tested for its ability to promote nucleotide oligomerization in model prebiotic systems. Heterogeneous mixtures of clay, water and nucleotide were repeatedly evaporated to dryness at 60 C and redissolved in water in cyclic fashion in the presence or absence of cyanamide and/or ammonium chloride. With or without cycling, kaolinite alone did not promote the oligomerization of nucleotides at detectable levels. Cycling of clay in combination with cyanamide, however, promoted high levels of condensation to a mixture of oligonucleotides and dinucleotide pyrophosphate without requiring ammonium chloride. Although cycling with clay favored synthesis of dinucleotide pyrophosphate, cycling without clay enhanced formation of oligonucleotides. These results support the hypothesis that the presence of clays in fluctuating environments would have influenced the course of prebiotic condensation reactions.

Odom, D. G.↗
NASA NTRS1981

Collisional radiative recombination in high-pressure noble gas mixtures

Rate coefficients are calculated for neutral-assisted collisional radiative recombination in dense, weakly ionized rare-gas mixtures using the quasiequilibrium model developed by Bates. It is shown that the recombination rate can be significantly altered by the presence of a buffer gas. In particular, the presence of helium can enhance the collisional radiative recombination rate coefficient of heavy rare gases by a factor of 5.

Whitten, B. L.↗
NASA NTRS1982

The dryout region in frictionally heated sliding contacts

Some conditions under which boiling and two-phase flow can occur in or near a wet sliding contact are determined and illustrated. The experimental apparatus consisted of a tool pressed against an instrumented slider plate and motion picture sequences at 4000 frames/sec. The temperature and photographic data demonstrated surface conditions of boiling, drying, trapped gas evolution (solutions), and volatility of fluid mixture components. The theoretical modeling and analysis are in reasonable agreement with experimental data.

Hendricks, R. C.↗
NASA NTRS1982

Volcanism and igneous processes in small icy satellites

Evidence for the production of endogenic processes of the small Saturnian satellites by igneous activity of low melting point NH3-H2O magma heated radiogenically is presented. An initial state of the inner satellites is modeled as a homogeneous mixture of particulate silicates and ices. Conductive transport is assumed to have either combined with heat capacity in a mixture of crystalline phases, or to have been reduced by the presence of dust, defects, vitreous or amorphous phases, and clathrates. The extent to which a eutectic melt could form is calculated in terms of the volume percentage of melt, with all heating above 175 K going toward overcoming the latent heat of the eutectic mix. Mimas and Enceladus were treated as free from radiogenic heat sources, which were significant for Tethys, Dione, Rhea, and Iapetus. The migrations of inner materials to form surface structures and seal off the interiors of the moons are described.

Stevenson, D. J.↗
NASA NTRS1982

The dryout region in frictionally heated sliding contacts

Some conditions under which boiling and two-phase flow can occur in or near a wet sliding contact are determined and illustrated. The experimental apparatus consisted of a tool pressed against an instrumented slider plate and motion picture sequences at 4000 frames/sec. The temperature and photographic data demonstated surface conditions of boiling, dry, trapped gas evolution (solutions), and volatility of fluid mixture components. The theoretical modeling and analysi are in reasonable agreement with experimental data. Previously announced in STAR as N82-28574

Hendricks, R. C.↗
NASA NTRS1985

Spectrophotometric and model-atmosphere analyses of the hot DO and DAO white dwarfs from the Palomar-Green survey

Recent optical and spectrophotometric observations of all currently known DAO and DO hot white dwarf candidates from the Palomar-Green Survey are presented. The optical observations were carried out using the Kitt Peak National Observatory Intensified Image Dissector Scanner (IIDS) system, the Multiple Mirror Telescope (MMT), and two photon-counting Reticon systems. Ultraviolet spectrophotometry was obtained using the International Ultraviolet Explorer (IUE) short-wavelength and long-wavelength cameras. The following spectroscopic subgroups were identified in the observations: the cool DO stars with spectra showing H I features together with He II + H blends; the hot DO stars, with spectra exhibiting weak He II (+H) lines; and hydrogen-rich DAO stars with broad H lines and sharp H II lines at 4686 A. A fourth subgroup of stars resembling PG 1159 with He at He II lines at 4686, and a C, N ion blend in the optical spectrum were also found. The spectroscopic data were analyzed in terms of a grid of hot, high-gravity LTE model atmospheres composed of a mixture of hydrogen and helium, and atmospheric parameters are deduced for each class of objects. On the basis of the model atmosphere analysis, the local space density of the DO stars is estimated to be 1.9-3.0 x 10 to the -7th per cubic pc, depending on the scale height.

Wesemael, F.↗
NASA NTRS1985

An experimental investigation on flame interaction and the existence of negative flame speeds

Downstream interaction between two counterflow premixed flames of different stoichiometries are investigated. Various flame configurations are observed and quantified; these include the binary system of two lean or rich flames, the triplet system of a lean and a rich flame separated by a diffusion flame, and single diffusion flames with some degree of premixedness. Extinction limits are determined for methane/air and butane/air mixtures over the entire range of mixture concentrations. Results show that these extinction limits can be significantly modified in the presence of interaction such that a mixture much beyond the flammability limit can still burn if it is supported by a stronger flame. The experiment also demonstrates the existence of negative flames whose propagation velocity is in the same general direction as that of the bulk convective flow. Implications of the present results on the flammability of stratified mixtures and on the modeling of turbulent flames are discussed.

Sohrab, S. H.↗
NASA NTRS1988

A multicomponent model of the infrared emission from Comet Halley

A model based on a mixture of coated silicates and amorphous carbon grains produces a good spectral match to the available Halley data and is consistent with the compositional and morphological information derived from interplanetary dust particle studies and Halley flyby data. The dark appearance of comets may be due to carbonaceous coatings on the dominant (by mass) silicates. The lack of a 10 micrometer feature may be due to the presence of large silicate grains. The optical properties of pure materials apparently are not representative of cometary materials. The determination of the optical properties of additional silicates and carbonaceous materials would clearly be of use.

Swamy, K. S. Krishna↗
NASA NTRS1991

Analysis of model Titan atmospheric components using ion mobility spectrometry

The Gas Chromatograph-Ion Mobility Spectrometer (GC-IMS) was proposed as an analytical technique for the analysis of Titan's atmosphere during the Cassini Mission. The IMS is an atmospheric pressure, chemical detector that produces an identifying spectrum of each chemical species measured. When the IMS is combined with a GC as a GC-IMS, the GC is used to separate the sample into its individual components, or perhaps small groups of components. The IMS is then used to detect, quantify, and identify each sample component. Conventional IMS detection and identification of sample components depends upon a source of energetic radiation, such as beta radiation, which ionizes the atmospheric pressure host gas. This primary ionization initiates a sequence of ion-molecule reactions leading to the formation of sufficiently energetic positive or negative ions, which in turn ionize most constituents in the sample. In conventional IMS, this reaction sequence is dominated by the water cluster ion. However, many of the light hydrocarbons expected in Titan's atmosphere cannot be analyzed by IMS using this mechanism at the concentrations expected. Research at NASA Ames and PCP Inc., has demonstrated IMS analysis of expected Titan atmospheric components, including saturated aliphatic hydrocarbons, using two alternate sample ionizations mechanisms. The sensitivity of the IMS to hydrocarbons such as propane and butane was increased by several orders of magnitude. Both ultra dry (waterless) IMS sample ionization and metastable ionization were successfully used to analyze a model Titan atmospheric gas mixture.

Kojiro, D. R.↗
NASA NTRS1992

A method of analyzing holographic interferograms of ballistic models in hypersonic free-flight

The objective of this research was to develop a method to extract integrated flowfield density information from finite-fringe interferograms produced with a laser holographic interferometer. This method was applied to two sets of holograms. An aeroassist flight experiment model flown in a mixture of 50 percent air - 50 percent argon and a blunt slender cone flown in air were flown at Mach 14.5 into freestream static pressures of 0.04 and 0.08 atm, respectively. The method of analysis can be separated into two main divisions. The first step is to identify fringes inside the wake in terms of the fringes in the freestream. This is important because refraction effects have obscured the region near the shock such that fringes cannot be followed into the wake region. The second step is to extrapolate the freestream fringes into the wake to determine the location of disturbance-related fringe shifts. Coupled with assumptions about the shape of the wake region, the locations of the disturbance-related fringe shifts can be related to the integrated density.

Kieffer, Douglas L.↗