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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 667 records · Page 37
All sourcesNASA NTRSDOE OSTI
DOE OSTI2018

On computing the evolution of temperature for materials under dynamic loading

Modeling and simulation of the dynamic response of materials is important to many applications including the development of armor systems, understanding the safety of explosives, and assessing the crashworthiness of vehicles. Within such applications it is often critical to accurately compute the evolution of the temperature because it is a state variable that affects the kinetics of competing active processes within the material (e.g., dislocation motion, phase transformation, decomposition). Depending on the selection of an independent state variable, e.g. temperature or entropy, the approach for computing temperature is well understood based on the thermodynamic framework attributed to Coleman and Noll. However, different computational codes used for modeling the dynamic response of materials adopt different independent state variables. In this work, two thermodynamically consistent strategies for computing the temperature of a coupled thermodynamic state are compared and implemented into two different Lagrangian computational codes. The equivalence of these two approaches is established through the numerical solutions of several test problems. Finally, the implication of various approximations made to each of these approaches within the literature are assessed in the context of uniaxial stress conditions (split Hopkinson pressure bar experiments) and uniaxial strain conditions (plate impact experiments). Here, it is shown that the temperature rate or energy partition approaches are equivalent when implemented in their complete forms, but that several common simplifying assumptions, that are warranted in the case of uniaxial stress, lead to significant errors in the resulting Hugoniot state for plate impact.

36 MATERIALS SCIENCE↗
DOE OSTI2018

The evolution history of superalloy powders during hot consolidation and plastic deformation

Highlights: • Element segregations in a powder metallurgy superalloy at different states are identified. • The surface energy drives precipitation of oxides, carbides, and γ' particles on powder surface during hot consolidation. • Prior particle boundary structure is distorted and more uniformly refined grains are obtained after hot extrusion. - Abstract: Powder metallurgy superalloys are widely used to produce critical rotating parts in turbine engines. However, the issues like what is the driving force of precipitation on prior particle boundary (PPB) during consolidation and how the PPB structure evolves during plastic deformation still remain to be resolved. In this study, with the characterization of the microstructure evolution from powder, consolidation, to plastic deformation, the segregation of alloying elements on the particle boundaries at elevated temperature was analyzed by equilibrium thermodynamic calculations, and the distortion of PPB structure under large plastic deformation was quantitively simulated by finite element (FE) methods. The results indicated that surface energy serves as the main driving force of PPB precipitation and hot extrusion could distort the PPB structure and yield more uniformly refined grains.

36 MATERIALS SCIENCE↗
DOE OSTI2021

Improving the Comprehensive Performance of Na 0.7 MnO 2 for Sodium Ion Batteries by ZrO 2 Atomic Layer Deposition

Sodium ion batteries with Na-Mn-O compounds as cathode have been widely studied as substitutes for lithium ion batteries due to their abundant resources. Still, the relatively poor cycling stability and low capacity of Na-Mn-O compounds significantly limit their applications. Different approaches, including element substitution and surface modification, have been applied to improve the electrochemical performance of those cathode materials. Herein, element doping and coating of ZrO 2 on Na 0.7 MnO 2 particles have been achieved by atomic layer deposition (ALD) followed by post-annealing. The rate capability and cycling stability of the modified material were significantly improved, and the mechanism of performance enhancement was revealed. The ZrO 2 coatings acted as a stable interfacial layer to enhance the cycling stability of Na 0.7 MnO 2 by suppressing side reactions between the electrode and electrolyte. The doping of transition metal ions reduced energy barriers for sodium ion insertion and deintercalation during cycling, further improving the charge and discharge capacity and rate performance of Na 0.7 MnO 2 .

25 ENERGY STORAGE↗
DOE OSTI2019

Mysterious SiB 3 : Identifying the Relation between α- and β-SiB 3

Binary silicon boride SiB 3 has been reported to occur in two forms, as disordered and nonstoichiometric α-SiB 3–x , which relates to the α-rhombohedral phase of boron, and as strictly ordered and stoichiometric β-SiB 3 . Similar to other boron-rich icosahedral solids, these SiB 3 phases represent potentially interesting refractory materials. However, their thermal stability, formation conditions, and thermodynamic relation are poorly understood. Here, we map the formation conditions of α-SiB 3–x and β-SiB 3 and analyze their relative thermodynamic stabilities. α-SiB 3–x is metastable (with respect to β-SiB 3 and Si), and its formation is kinetically driven. Pure polycrystalline bulk samples may be obtained within hours when heating stoichiometric mixtures of elemental silicon and boron at temperatures 1200–1300 °C. At the same time, α-SiB 3–x decomposes into SiB6 and Si, and optimum time-temperature synthesis conditions represent a trade-off between rates of formation and decomposition. The formation of stable β-SiB 3 was observed after prolonged treatment (days to weeks) of elemental mixtures with ratios Si/B = 1:1–1:4 at temperatures 1175–1200 °C. The application of high pressures greatly improves the kinetics of SiB 3 formation and allows decoupling of SiB 3 formation from decomposition. Quantitative formation of β-SiB 3 was seen at 1100 °C for samples pressurized to 5.5–8 GPa. β-SiB 3 decomposes peritectoidally at temperatures between 1250 and 1300 °C. The highly ordered nature of β-SiB 3 is reflected in its Raman spectrum, which features narrow and distinct lines. In contrast, the Raman spectrum of α-SiB 3–x is characterized by broad bands, which show a clear relation to the vibrational modes of isostructural, ordered B 6 P. The detailed composition and structural properties of disordered α-SiB 3–x were ascertained by a combination of single-crystal X-ray diffraction and 29 Si magic angle spinning NMR experiments. Notably, the compositions of polycrystalline bulk samples (obtained at T ≤ 1200 °C) and single crystal samples (obtained from Si-rich molten Si–B mixtures at T > 1400 °C) are different, SiB 2.93(7) and SiB 2.64(2) , respectively. The incorporation of Si in the polar position of B 12 icosahedra results in highly strained cluster units. This disorder feature was accounted for in the refined crystal structure model by splitting the polar position into three sites. The electron-precise composition of α-SiB 3–x is SiB 2.5 and corresponds to the incorporation of, on average, two Si atoms in each B 12 icosahedron. Accordingly, α-SiB 3–x constitutes a mixture of B 10 Si 2 and B 11 Si clusters. The structural and phase stability of α-SiB 3–x were explored using a first-principles cluster expansion. The most stable composition at 0 K is SiB 2.5 , which however is unstable with respect to the decomposition β-SiB 3 + Si. Modeling of the configurational and vibrational entropies suggests that α-SiB 3–x only becomes more stable than β-SiB 3 at temperatures above its decomposition into SiB 6 and Si. Hence, we conclude that α-SiB 3–x is metastable at all temperatures. Density functional theory electronic structure calculations yield band gaps of similar size for electron-precise α-SiB 2.5 and β-SiB 3 , whereas α-SiB 3 represents a p-type conductor.

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

Assessment of thermal loads in the CERN SPS crab cavities cryomodule 1

As a part of the HL-LHC upgrade, we designed a cryomodule to host two crab cavities for a first test with protons in the SPS machine. The evaluation of the cryomodule heat loads is essential to dimension the cryogenic infrastructure of the system. The current design features two cryogenic circuits. The first circuit adopts superfluid helium at 2 K to maintain the cavities in the superconducting state. The second circuit, based on helium gas at a temperature between 50 K and 70 K, is connected to the thermal screen, also serving as heat intercept for all the interfaces between the cold mass and the external environment. We present an overview of the heat loads to both circuits, and the combined numerical and analytical estimations. The heat load of each element is detailed for the static and dynamic scenarios, with considerations on the design choices for the thermal optimization of the most critical components.

43 PARTICLE ACCELERATORS↗
DOE OSTI2018

Performance of quartz- and sapphire-based double-crystal high-resolution (~10 meV) RIXS monochromators under varying power loads

In the context of a novel, high-resolution resonant inelastic X-ray scattering spectrometer, a flat-crystal-based quartz analyzer system has recently been demonstrated to provide an unprecedented intrinsic-energy resolution of 3.9 meV at the Ir L 3 absorption edge (11.215 keV) [Kim et al. (2018) Sci. Rep. 8 , 1958]. However, the overall instrument resolution was limited to 9.7 meV because of an 8.9 meV incident band pass, generated by the available high-resolution four-bounce Si(844) monochromator. In order to better match the potent resolving power of the novel analyzer with the energy band pass of the incident beam, a quartz(309)-based double-bounce, high-resolution monochromator was designed and implemented, expected to yield an overall instrument resolution of 6.0 meV. The choice of lower-symmetry quartz is very attractive because of its wealth of suitable near-backscattering reflections. However, it was found that during room-temperature operation typical levels of incident power, barely affecting the Si monochromator, caused substantial thermal distortions in the first crystal of the quartz monochromator, rendering it practically unusable. Finite-element analyses and heat-flow analyses corroborate this finding. As a high-flux, lower resolution (15.8 meV) alternative, a two-bounce sapphire(078) version was also tested and found to be less affected than quartz, but notably more than silicon.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2022

The Influence of Environment on Post-Detonation Chemistry and Debris Formation (Abbreviated Final Report: 20-SI-006)

Predicting, responding to, or interpreting the chemical record preserved in debris derived from nuclear events can be challenging due to chemical fractionation. Chemical fractionation is where different species of the evolving radionuclide inventory segregate and/or are lost from the system over the timescales of debris formation. Both historic data and recent research suggest that the interaction and character of the local environment may exert controls on chemical fractionation by influencing the cooling and evolution of the associated fireball as well as the composition of the vapor term and resultant speciation. Prior to this work, an integrated platform permitting dynamic and concurrent consideration of physical and chemical evolution of early time post-detonation event environments did not exist. Our work merged historic data and experimental approaches to support development of a computational framework able to simulate fundamental processes (e.g., entrainment of local environment, oxidation chemistry, and cooling time scales) that may perturb the radionuclide inventory captured in post-detonation debris. Work with historic debris confirmed that entrained environmental material affect debris composition, structure, and radionuclide incorporation. Complementary work utilizing a readily controllable and tunable benchtop setup (a plasma flow reactor) simulated the late cooling of a nuclear fireball (e.g., T < 6000 K) and bounded the sensitivity of actinide speciation and particle size distribution to variations in oxygen concentration and cooling rates. Concurrent laser ablation and laser heating experiments were used to investigate the chemistry and physics of processes occurring in vaporized and/or rapidly heated actinides and other elements in the presence of oxygen. A more computationally efficient microphysical model was developed for predicting and evolving size distributions of particles forming from mixed vapor terms and simulating particle formation processes under a variety of extreme conditions. Continued study of historic nuclear event film confirmed that shockwave data and physics codes agree to within the uncertainty of the data. Good agreement was achieved for thermal emission from an airburst, however the paucity of low-temperature molecular opacity data for mixtures of air, bomb debris, entrained dirt, and water vapor complicate agreement for more elaborate scenarios. A multiphysics code (ALE3D) was modified to bring the necessary physics and chemistry, including these new data and insights, onto a single platform. Code development included improved initialization of large physical systems, modernization of chemistry capabilities, and modifications to enable inclusion of particle transport.

07 ISOTOPE AND RADIATION SOURCES↗
DOE OSTI2026

r -process Nucleosynthesis from Hyperaccreting Neutron Stars in Common Envelopes

We investigate nuclear reactions and feedback in hyperaccreting neutron star environments, considering accretion rates in the range 0.3–3 × 10 4 M ⊙ yr −1 , typical of short-period compact-object binaries in common envelopes. Our models account for weak reactions, neutrino energy loss, nuclear energy release, pair production, degenerate equations of state, and general relativistic hydrodynamics. Depending on the accretion rates, these systems can develop both proton- and neutron-rich atmospheres with strong convective instabilities linking the neutrino sphere to the outgoing accretion shock inside the radiation trapping zone. Convection drives nucleons through multiple heating and cooling cycles, with photodisintegration dominating during the heating phase and heavy element synthesis during the cooling phase, ejecting material with abundances that depend on the accretion rate and depth of the final decompression trajectory. The turbulent nature of convective currents is conducive to creating a wide range of nuclear products through a variety of effects, including nuclear statistical equilibrium freeze-out and the r-, p-, and γ-processes. We also observe a novel multistep process in reheated trajectories, consisting of proton-capture and photodissociation reactions operating on r-process seeds, producing overall neutron-deficient isotopes. A significant amount of infalling gas experiences high entropy and short (millisecond) freeze-out timescales capable of making r-process elements with high overabundances through a disequilibrium effect between neutrons and α-particles that does not require an excess of neutrons.

79 ASTRONOMY AND ASTROPHYSICS↗
NASA NTRS1971

NASTRAN: Users' Experiences

The maintenance and development of NASTRAN has been centralized at the Langley Research Center in the NASTRAN Systems Management Office (NSMO ). Several important system improvements are in progress which will result in a significant reduction of average computer run time. The maintenance contractor, MacNeal-Schwendler, is also engaged in the addition of comprehensive substructuring capability. A dummy element capability which allows the test, evaluation, checkout, and temporary use of a new element in the NASTRAN environment is also underway and planned for inclusion in Level 15. Several new elements and a comprehensive heat transfer capability are in development under a contract with the Bell Aerospace Company. These enhancements are planned for inclusion in Level 16. In summary, NASTRAN has emerged as a powerful , generalized facility for the analysis of complex aerospace structures and is rapidly gaining acceptance from the community of aerospace and industrial users. NASA is, therefore, committed to manage and maintain the NASTRAN system as a valuable national resource.

Phillip R Wilcox↗
NASA NTRS1972

Review of jet engine emissions.

The various constituents in jet engine exhaust during typical takeoff or cruise conditions are presented in a table. The categories considered include inerts and unreacted oxygen from air, products of complete combustion of fuel, products of incomplete combustion, oxides of nitrogen formed during the heating of air, and elements or compounds derived from sulfur and trace metals present in kerosene fuel. Typical jet engine emission characteristics are discussed together with the effect of operating variables on emissions, and combustor design techniques to reduce emissions. Particular attention is given to emissions in the upper atmosphere, and to methods to reduce nitric oxide emissions.

Grobman, J. S.↗
NASA NTRS1977

Effects of scaled heatshield tile misalignment on Orbiter boundary-layer transition

The article addresses the problem of assessing the sensitivity of the heat transfer rate of a Space Orbiter windward surface and boundary-layer transition data to surface features, or 'roughness elements', characteristic of randomly misaligned heat shield tiles. Selected heat shield tiles were precision-formed on the surface of a 0.0175-scale Orbiter model. Selective electroless plating and selective electrochemical etching techniques were employed. Effects of roughness on the location of boundary-layer transition were markedly influenced by the wall-to-total temperature ratios, according to wind-tunnel test results.

Goodrich, W. D.↗
NASA NTRS1979

Thermostructural design of a carbon-carbon heatshield for a Jovian entry

The thermostructural response of three candidate carbon-carbon composites for the Jovian entry probe heatshield was investigated. The analysis for the three materials, Sandia Felt, Carbitex 700, and SAI 4-D weave carbon-carbon was conducted using a dual finite element approach which involved heat conduction as well as the structural response. A receding boundary due to ablation and inertial loads encountered by the probe were included. Severe cracking, circumferential and radial, and interlaminar shear failure was observed during the radiative heating pulse for the Sandia Felt and Carbitex 700 materials, respectively. The 4-D weave material showed no failures over the entire entry.

White, M. J.↗
NASA NTRS1984

Continous Monitoring of Melt Composition

Compositions of glasses and alloys analyzed and corrected in real time. Spectral analysis and temperature measurement performed simultaneously on molten material in container, such as open-hearth furnace, crucible or tank of continuous furnace. Speed of analysis makes it possible to quickly measure concentration of volatile elements depleted by prolonged heating.

Frazer, R. E.↗
NASA NTRS1986

On the Theory of Type 1 X-Ray Bursts: The Energetics of Bursts and the Nuclear Fuel Reservoir in the Envelope

The observed properties of type 1 X-ray bursts from 4U/MXB 1636-53 and those of models of thermonuclear flashes on accreting neutron stars are compared. Ways to explain variations in the burst recurrence properties without an apparent correlation with the accretion rate, including the rapid succession of bursts at intervals 10 min are discussed. The strongest X-ray bursts, which occur after a very long interval, are well described by thermonuclear flash models with simple accumulation of accreted fuel, and a spherically symmetric structure in the burning shell. The majority of observed bursts, however, occur after much shorter intervals, and radiate much smaller amounts of energy, by a factor of up to 10 times that predicted by the spherical models. An ignition mechanism of the bursts is proposed in terms of elemental mixing and dissipative heating associated with hydrodynamical instabilities in the neutron star envelope caused by angular momentum carried inward by accreted gas.

Fujimoto, Masayuki Y.↗
NASA NTRS1987

Rate limits in silicon sheet growth - The connections between vertical and horizontal methods

Meniscus-defined techniques for the growth of thin silicon sheets fall into two categories: vertical and horizontal growth. The interactions of the temperature field and the crystal shape are analyzed for both methods using two-dimensional finite-element models which include heat transfer and capillarity. Heat transfer in vertical growth systems is dominated by conduction in the melt and the crystal, with almost flat melt/crystal interfaces that are perpendicular to the direction of growth. The high axial temperature gradients characteristic of vertical growth lead to high thermal stresses. The maximum growth rate is also limited by capillarity which can restrict the conduction of heat from the melt into the crystal. In horizontal growth the melt/crystal interface stretches across the surface of the melt pool many times the crystal thickness, and low growth rates are achievable with careful temperature control. With a moderate axial temperature gradient in the sheet a substantial portion of the latent heat conducts along the sheet and the surface of the melt pool becomes supercooled, leading to dendritic growth. The thermal supercooling is surpressed by lowering the axial gradient in the crystal; this configuration is the most desirable for the growth of high quality crystals. An expression derived from scaling analysis relating the growth rate and the crucible temperature is shown to be reliable for horizontal growth.

Thomas, Paul D.↗
NASA NTRS1987

Time- and position-varying infrared scene simulation

Rapidly changing infrared scenes can be generated as a function of position using thermally produced irradiance. This can be done most conveniently by using a variable dwell-time, variable diameter, and scanning laser beam to deposit a predetermined amount of laser energy, as a function of position, on the target surface. An infrared target simulator has been designed and tested to perform within stringent temperature simulation requirements: heating rate of over 100 K/sec is achieved, and temperature gradients of 200 K/mm can be maintained. Problems with heat transfer between adjacent elements at different temperatures are solved by modeling the thermal layer on the target surface as a low-pass filter, which cuts off all the frequencies above the thermal cutoff frequency. When the system approach is taken to the infrared simulation design, the optical system limited performance results in the best realizable performance. In this case, the thermal layer on the target surface is designed so that the thermal cutoff frequency is above the optical cutoff frequency.

Scholl, Marija S.↗