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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 91 records · Page 5
All sourcesNASA NTRSDOE OSTI
DOE OSTI2020

Structural Transformation and Chemical Stability of a Shock-Compressed Insensitive High Explosive Single Crystal: Time-Resolved Raman Spectroscopy

Despite the considerable interest in insensitive high explosives (IHE) as a safer alternative to conventional high explosives, a good understanding of the low sensitivity of IHEs to shock initiation is lacking. In particular, real-time measurements to directly probe the molecular-level response of shock compressed IHE single crystals constitute an important need. To address this need, plate impact experiments were conducted to determine time-resolved changes in the Raman spectra of 1,1-diamino-2,2-dinitroethene (FOX-7) single crystals – a representative IHE crystal – shock compressed up to 20 GPa longitudinal stress. The Raman measurements examined vibrational frequencies from 800 cm-1 to 1500 cm-1 with 15 nanosecond time resolution and were conducted at several peak stresses. At 4 – 6 GPa, two new Raman peaks appeared, in addition to the original peaks, consistent with onset of the α' – ε structural transformation reported previously in static compression work. The measured spectra indicated completion of the transformation at 10 GPa. Raman data to 20 GPa showed neither additional transformations nor any indication of chemical decomposition. This finding, though consistent with recent continuum measurements, is in marked contrast to the chemical decomposition observed at lower stresses in shock compressed conventional high explosive single crystals. Our Raman results support the previous suggestion that strengthening of intra- and inter-molecular bonds, due to the α' – ε structural transformation, plays a significant role in the insensitivity of FOX-7 single crystals to shock initiation. In conclusion, the present work, in conjunction with previous static compression studies, provides the first experimental insight into the molecular-level response of a shock compressed IHE single crystal and can serve as a bench mark for theoretical studies.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
NASA NTRS1973

Heating and flow-field studies on a straight-wing hypersonic reentry vehicle at angles of attack from 20 to 80 deg with simulation of real-gas trends

Data are presented from a series of phase-change heat transfer and flow visualization tests at Mach 7.4, 8, and 10.3 in air, Mach 19.5 in nitrogen, Mach 20.3 in helium, and Mach 6 in tetrafluoromethane (CF4) on the windward surface of a straight wing hypersonic reentry configuration for angles of attack from 20 deg to 80 deg. The results indicate that: (1) for hypersonic stream Mach numbers, the flow field over the straight-wing configuration is essentially independent of Mach number, (2) transition Reynolds number decreases with increasing angle of attack, (3) at some critical angle of attack, the wing-shock standoff distance is greatly increased and the stagnation line moves downstream from the wing leading edge, (4) value of the critical angle of attack is very sensitive to the flow shock density ratio or effective gamma, and (5) at angles of attack above the critical value for all gases, the nondimensional level of heat transfer to the wing is higher for the higher shock density ratio flows.

Hunt, J. L.↗
NASA NTRS1984

Numerical simulation of flow through inlets/diffusers with terminal shocks

Two-dimensional Euler and Navier-Stokes solutions of the flow through three inlet/diffuser configurations with terminal shock systems are reported. Calculations without bleed indicate that the terminal shock location is very sensitive to the outflow back pressure. For cases where there are no available experimental results, it becomes difficult to estimate the back pressure that will result in a terminal shock. Estimates based on quasi-one-dimensional analysis are not found adequate for complex two-dimensional flows. It is found that since the flow downstream of the terminal shock is subsonic, and what happens at the outflow boundary affects the flow inside the inlet, enough of the subsonic diffuser must be modeled to accurately predict the terminal shock region. The diffuser portion should be fairly long with the outflow boundary occurring in a region of more or less uniform flow to be able to prescribe a uniform back pressure. The third configuration studied was investigated with and without incorporating bleed in the code. It is found that the use of bleed stabilizes the shock location and allows solutions which without bleed result in unstarting of the inlet. Comparisons are made with available experimental data.

Talcott, N. A., Jr.↗
DOE OSTI2021

Strongly Anisotropic Thermomechanical Response to Shock Wave Loading in Oriented Samples of the Triclinic Molecular Crystal 1,3,5-Triamino-2,4,6-trinitrobenzene

All-atom molecular dynamics (MD) simulations were used to study shock wave loading in oriented single crystals of the highly anisotropic triclinic molecular crystal 1,3,5-triamino-2,4,6-trinitrobenzene (TATB). The crystal structure consists of planar hydrogen-bonded sheets of individually planar TATB molecules that stack into graphitic-like layers. Shocks were studied for seven systematically prepared crystal orientations with limiting cases that correspond to shock propagation exactly perpendicular and exactly parallel to the graphitic-like layers. The simulations were performed for initially defect-free crystals using a reverse-ballistic configuration that generates explicit, supported shocks. Final longitudinal stress components are between ≈8.5 and ≈10.5 GPa for the 1.0 km s –1 impact speed studied. Orientation-dependent properties are reported including shock speeds, stresses, temperatures, compression ratios, and local material strain rates. Spatiotemporal maps of the temperature, stress tensor, material flow, and molecular orientations reveal complicated processes that arise for specific shock directions. Furthermore, the results indicate that TATB shock response is highly sensitive to crystal orientation, with significant qualitative differences for the time evolution of the stress tensor and temperature, elastic/inelastic compression response, defect formation and growth, critical von Mises stress, and strain rates during shock rise that span nearly an order of magnitude. A variety of inelastic deformation mechanisms are identified, ranging from crumpling of graphitic-like layers to dislocation-mediated plasticity to intense shear strain localization. To our knowledge, these are the first systematic MD simulations and analysis of explicit shock wave propagation along nontrivial crystal directions in a triclinic molecular crystal.

36 MATERIALS SCIENCE↗
DOE OSTI2024

Synthesis and investigation into explosive sensitivity for a series of new picramide explosives

Tailoring the molecular properties that govern energetic material sensitivity is essential to improve safety and help develop new energetic materials. Despite this need, understanding the complex chemistry and physics of explosive initiation and propagation is still a challenge. Recent work by our group has reinforced the view that explosive sensitivity under sub-shock conditions is connected to the strength of the weakest covalent bond in the molecule, that is, its “trigger linkage.” These correlations have been observed with different classes of energetic molecules and indicate that “trigger linkage” bond breaking, and heat of explosion are good indicators for the sensitivity trends. Herein we report the synthesis of aliphatic energetic materials with ethane, propane and neopentane backbones. Experimental and computational studies show that the trigger linkage model, based on results from quantum molecular dynamics simulations, correctly predicts trends observed in the impact sensitivity of the molecules. However, while the model predicts the impact sensitivities of the ethane series, the neopentane series has higher impact sensitivities than predicted, which is presumably influenced by crystal packing effects.

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

Fuel convergence sensitivity in indirect drive implosions

In inertial confinement fusion experiments at the National Ignition Facility, a spherical shell of deuterium–tritium fuel is imploded in an attempt to reach the conditions needed for fusion, self-heating, and eventual ignition. Since theory and simulations indicate that ignition efficacy in 1D improves with increasing imploded fuel convergence ratio, it is useful to understand the sensitivity of the scale-invariant fuel convergence on all measurable or inferable 1D parameters. In this paper, we develop a simple isobaric and isentropic compression scaling model incorporating sensitivity to the in-flight adiabat inferred from shock strengths, to measured implosion velocity, and to known initial ablator and fuel aspect ratio and mass ratio. The model is first benchmarked to 1D implosion simulations spanning a variety of relevant implosion designs. We then use the model to compare compressibility trends across all existing indirect-drive layered implosion data from the facility spanning three ablators [CH, carbon (C), and Be], for which in-flight fuel adiabats varied from 1.6 to 5 by varying the number of drive shocks from 2 to 4, peak implosion velocities varied by 1.4×, capsule radii by 50%, and initial fuel aspect ratios by 1.4×. We find that the strength of the first shock is the dominant contributor setting the maximum fuel convergence. We also observe additional sensitivities to successive shock strengths and fuel aspect ratios that improve the agreement between the expected and measured compression for carbon and Be designs with adiabats above 3. A principal finding is that the adiabat 2.5 C-shell designs exhibit less convergence than CH-shell designs of similar inferred in-flight adiabat.

Landen, O. L. (ORCID:0000000214998217)↗
DOE OSTI2024

Ignition Delay Times and Chemical Kinetic Model Validation for Hydrogen and Ammonia Blending With Natural Gas at Gas Turbine Relevant Conditions

Ignition delay times from undiluted mixtures of natural gas (NG)/H 2 /Air and NG/NH 3 /Air were measured using a high-pressure shock tube at the University of Central Florida. The combustion temperatures were experimentally tested between 1000 and 1500 K near a constant pressure of 25 bar. As mentioned, mixtures were kept undiluted to replicate the same chemistry pathways seen in gas turbine combustion chambers. Recorded combustion pressures exceeded 200 bar due to the large energy release, hence why these were performed at the high-pressure shock tube facility. The data are compared to the predictions of the NUIGMech 1.1 mechanism for chemical kinetic model validation and refinement. An exceptional agreement was shown for stoichiometric conditions in all cases but strayed at lean and rich equivalence ratios, especially in the lower temperature regime of H 2 addition and all temperature ranges of the baseline NG mixture. Hydrogen addition also decreased ignition delay times by nearly 90%, while NH 3 fuel addition made no noticeable difference in ignition time. NG/NH 3 exhibited similar chemistry to pure NG under the same conditions, which is shown in a sensitivity analysis. Here, the reaction CH 3 + O 2 = CH 3 O + O is identified and suggested as a possible modification target to improve model performance. Increasing the robustness of chemical kinetic models via experimental validation will directly aid in designing next-generation combustion chambers for use in gas turbines, which in turn will greatly lower global emissions and reduce greenhouse effects.

33 ADVANCED PROPULSION SYSTEMS↗
NASA NTRS2021

Skin Friction Extracted from Surface Pressure in Incident Shock-Wave/Boundary-Layer Interaction

High-resolution skin-friction fields are extracted from pressure-sensitive paint (PSP) data obtained in shock-wave/boundary-layer interaction (SWBLI). The method of extracting skin friction from surface pressure is described, including the fundamental relation between skin friction and surface pressure, the variational method, error analysis, and an approximate iterative method. The proposed method is based on a coupling relation between skin friction and surface pressure, where the boundary enstrophy flux is suitably modeled or approximated. This method is applied to unsteady PSP data obtained in incident SWBLIs at Mach 2.5 for different Reynolds numbers, revealing the skin-friction structures of the flows: particularly, the separation bubble induced by the incident shock wave. The extracted results are in good agreement with the data obtained by the surface-stress-sensitive film.

skin friction↗
NASA NTRS1972

Ogo 5 magnetic-field data near the earth's bow shock - A correlation with theory.

Magnetic-field data obtained in the earth's bow-shock region with a high-resolution triaxial fluxgate magnetometer aboard the Ogo 5 satellite have been correlated with a theory of Tidman and Northrop (1968). These authors have shown that either of two hypotheses about the nature of low-frequency magnetic waves could be invoked to explain previous observations. We have observed exponentially decaying upstream waves that are consistent with only one of these hypotheses. This observation allows use of the theory to infer the local shock velocity and frequency of driving currents within the shock. This method of finding the shock velocity is less sensitive to errors in the plasma parameters than is the method based on the Rankine-Hugoniot relations.

Guha, J. K.↗
NASA NTRS1986

Simulations of collisionless shocks

A problem of critical importance to space and astrophysics is the existence and properties of high-Mach-number shocks. In this letter the results of simulations of perpendicular shocks with Alfven Mach number 22 are presented. It is shown that the shock structure is a sensitive function of resistivity, becoming turbulent when the resistivity is too low. The problem of electron heating, and the extension of the results to higher Mach numbers are discussed.

Quest, K. B.↗
NASA NTRS1995

Oxidation Mechanisms of Toluene and Benzene

An expanded and improved version of a previously published benzene oxidation mechanism is presented and shown to model published experimental data fairly successfully. This benzene submodel is coupled to a modified version of a toluene oxidation submodel from the recent literature. This complete mechanism is shown to successfully model published experimental toluene oxidation data for a highly mixed flow reactor and for higher temperature ignition delay times in a shock tube. A comprehensive sensitivity analysis showing the most important reactions is presented for both the benzene and toluene reacting systems. The NASA Lewis toluene mechanism's modeling capability is found to be equivalent to that of the previously published mechanism which contains a somewhat different benzene submodel.

Bittker, David A.↗
NASA NTRS1998

Statistical Treatment of Earth Observing System Pyroshock Separation Test Data

The Earth Observing System (EOS) AM-1 spacecraft for NASA's Mission to Planet Earth is scheduled to be launched on an Atlas IIAS vehicle in June of 1998. One concern is that the instruments on the EOS spacecraft are sensitive to the shock-induced vibration produced when the spacecraft separates from the launch vehicle. By employing unique statistical analysis to the available ground test shock data, the NASA Lewis Research Center found that shock-induced vibrations would not be as great as the previously specified levels of Lockheed Martin. The EOS pyroshock separation testing, which was completed in 1997, produced a large quantity of accelerometer data to characterize the shock response levels at the launch vehicle/spacecraft interface. Thirteen pyroshock separation firings of the EOS and payload adapter configuration yielded 78 total measurements at the interface. The multiple firings were necessary to qualify the newly developed Lockheed Martin six-hardpoint separation system. Because of the unusually large amount of data acquired, Lewis developed a statistical methodology to predict the maximum expected shock levels at the interface between the EOS spacecraft and the launch vehicle. Then, this methodology, which is based on six shear plate accelerometer measurements per test firing at the spacecraft/launch vehicle interface, was used to determine the shock endurance specification for EOS. Each pyroshock separation test of the EOS spacecraft simulator produced its own set of interface accelerometer data. Probability distributions, histograms, the median, and higher order moments (skew and kurtosis) were analyzed. The data were found to be lognormally distributed, which is consistent with NASA pyroshock standards. Each set of lognormally transformed test data produced was analyzed to determine if the data should be combined statistically. Statistical testing of the data's standard deviations and means (F and t testing, respectively) determined if data sets were significantly different at a 95-percent confidence level. If two data sets were found to be significantly different, these families of data were not combined for statistical purposes. This methodology produced three separate statistical data families of shear plate data. For each population, a P99.1/50 (probability/confidence) per-separation-nut firing level was calculated. By using the binomial distribution, Lewis researchers determined that this pernut firing level was equivalent to a P95/50 per-flight confidence level. The overall envelope of the per-flight P95/50 levels led to Lewis' recommended EOS interface shock endurance specification. A similar methodology was used to develop Lewis' recommended EOS mission assurance levels. The available test data for the EOS mission are significantly larger than for a normal mission, thus increasing the confidence level in the calculated expected shock environment. Lewis significantly affected the EOS mission by properly employing statistical analysis to the data. This analysis prevented a costly requalification of the spacecraft's instruments, which otherwise would have been exposed to significantly higher test levels.

McNelis, Anne M.↗
NASA NTRS2006

X-ray Observations of Binary and Single Wolf-Rayet Stars with XMM-Newton and Chandra

We present an overview of recent X-ray observations of Wolf-Rayet (WR) stars with XMM-Newton and Chandra. These observations are aimed at determining the differences in X-ray properties between massive WR + OB binary systems and putatively single WR stars. A new XMM spectrum of the nearby WN8 + OB binary WR 147 shows hard absorbed X-ray emission (including the Fe Ka line complex), characteristic of colliding wind shock sources. In contrast, sensitive observations of four of the closest known single WC (carbon-rich) WR stars have yielded only nondetections. These results tentatively suggest that single WC stars are X-ray quiet. The presence of a companion may thus be an essential factor in elevating the X-ray emission of WC + OB stars to detectable levels.

Skinner, Stephen↗
NASA NTRS2011

Robust and Accurate Shock Capturing Method for High-Order Discontinuous Galerkin Methods

A simple yet robust and accurate approach for capturing shock waves using a high-order discontinuous Galerkin (DG) method is presented. The method uses the physical viscous terms of the Navier-Stokes equations as suggested by others; however, the proposed formulation of the numerical viscosity is continuous and compact by construction, and does not require the solution of an auxiliary diffusion equation. This work also presents two analyses that guided the formulation of the numerical viscosity and certain aspects of the DG implementation. A local eigenvalue analysis of the DG discretization applied to a shock containing element is used to evaluate the robustness of several Riemann flux functions, and to evaluate algorithm choices that exist within the underlying DG discretization. A second analysis examines exact solutions to the DG discretization in a shock containing element, and identifies a "model" instability that will inevitably arise when solving the Euler equations using the DG method. This analysis identifies the minimum viscosity required for stability. The shock capturing method is demonstrated for high-speed flow over an inviscid cylinder and for an unsteady disturbance in a hypersonic boundary layer. Numerical tests are presented that evaluate several aspects of the shock detection terms. The sensitivity of the results to model parameters is examined with grid and order refinement studies.

Atkins, Harold L.↗
NASA NTRS2020

Simulating the Benesov Bolide Flowfield and Spectrum at Altitudes of 47 and 57 km

This paper develops a computational fluid dynamics capability for simulating the radiative emission from a meteor shock-layer and wake to an external observer. The developed capability includes the impact of radiation and ablation on the meteor flowfield, where coupled radiation accounts for the impact of radiation on the flowfield energy equations and coupled ablation accounts for the injection of ablation species from the meteoroid surface into the ow. This capability includes updated flowfield chemistry and nonequilibrium radiation models, which are compiled from the literature. To provide a level of validation for this capability, the Benesov spectral measurements are considered. Although the meteoroid was likely fragmented at the 47 and 57 km altitudes considered, and the measurement uncertainty is roughly ±50%, these measurements represent the best available spectral measurements for a relatively large (meter-class) bolide. To determine the equivalent meteoroid diameter to simulate, the continuum component of the spectrum in the 570 to 610 nm range is considered. This range is dominated by air emission from the high pressure and temperature shock-layer in front of the meteoroid, which is simulated with a relatively small uncertainty (because of the abundance of relevant shock tube measurements) and sensitive to the equivalent meteoroid diameter. This allows an equivalent diameter between 0.62 to 0.9 m to be determined, based on comparisons between measurements and simulations in the 570 to 610 nm range. The range of equivalent diameters is due to the various meteoroid geometries considered, where increasing the bluntness decreases the required diameter. Applying these diameters to simulations at 47 and 57 km results in simulated spectra that compare within 30% of the measured values, considering the wavelength integrated values between 400 and 650 nm. This agreement is well within the estimated measurement uncertainty of ±50%. All major spectral features are captured by the simulations. This agreement provides a level of validation for the developed model that has not been previously available.

Luminous efficiency↗
NASA NTRS1987

A survey of simulation and diagnostic techniques for hypersonic nonequilibrium flows

The possible means of simulating nonequilibrium reacting flows in hypersonic environments, and the required diagnostic techniques, are surveyed in two categories: bulk flow behavior and determination of chemical rate parameters. Flow visualization of shock shapes for validation of computational-fluid dynamic calculations is proposed. The facilities and the operating conditions necessary to produce the required nonequilibrium conditions, the suitable optical techniques, and their sensitivity requirements, are surveyed. Shock-tubes, shock-tunnels, and ballistic ranges in a wide range of sizes and strengths are found to be useful for this purpose, but severe sensitivity requirements are indicated for the optical instruments, which can be met only by using highly-collimated laser sources. Likewise, for the determination of chemical parameters, this paper summarizes the quantities that need to be determined, required facilities and their operating conditions, and the suitable diagnostic techniques and their performance requirements. Shock tubes of various strengths are found to be useful for this purpose. Vacuum ultraviolet absorption and fluorescence spectroscopy and coherent anti-Stokes Raman spectroscopy are found to be the techniques best suited for the measurements of the chemical data.

Sharma, Surendra P.↗
NASA NTRS1986

Observations of Far-Infrared Molecular Emission Lines from the Orion Molecular Cloud

The Orion Nebula was the subject of intensive study for over one hundred years. Recently, several far infrared transitions among the low-lying levels of OH were observed toward IRc2. The OH is thought to be abundant, and plays an important role in the chemical evolution of shock and post-shock regions. The OH emission serves as a sensitive probe of the temperature and density for the shock-processed gas. A rigorous treatment of the radiative transfer of these measured transitions was performed using the escape probability formalism. From this analysis, the temperature of the OH-emitting region was determined to be on the order of 40K. This suggests that the gas is part of the post-shock gas that has cooled sufficiently, most likely by way of radiative cooling by CO. Such cooling from shock temperatures of several degrees can be accomplished in 100 years. A molecular hydrogen density of 3 million/cubic cm and an OH column density of 1.0 x 10 to the 17th /sq cm is found. The beam filling factor is determined to be 36%.

Viscuso, P. J.↗
DOE OSTI2022

Uncertainty Quantification and Sensitivity Analysis for Simulation of Hostile Blast Events [Slides]

A mesh convergence study shows that shock arrival times converge for basic flow shots. Sensitivity study reveals a surprisingly high sensitivity to the placement of the HE package. Bayesian inference tools used on the experimental datasets suggest this is a real effect. Sensitivity analysis of ambient conditions such as temperature and pressure reveal minimal effect. Porting of pressure data from QUINOA simulations to perform structural analysis on the aeroshell geometry was successful, and shows a strong dependence of payload response to the angle of attack.

42 ENGINEERING↗