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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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NASA NTRS1987

Advances in magnetospheric physics by numerical simulations - A critical analysis by an outsider

This is a selective, somewhat editorialized assessment, based on a literature survey, of computer simulation as it exists today in magnetospheric physics. Both large (MHD) and small scale dynamical simulations are described and considered from the perspective of what they are trying to do and with what success. Several specific problem areas where simulations are being carried out are called for commentary: global magnetospheric structure, magnetotail and magnetopause reconnection, Kelvin-Helmholtz instability, hydrodynamic expansion of ionospheric ions, electric double layers, heavy ion heating, and auroral kilometric radiation. It is concluded that simulation is a necessary tool for understanding magnetospheric physics and that significant progress has been made in simulation development. However, results should be evaluated knowing that many factors, some real and physical, others structural, may contribute to such output. A plea is made for greater intercalibration among different simulators working in parallel areas, so that facts can be distinguished from artifacts.

Birmingham, Thomas J.↗

NASA NTRS1998

Numerical Simulations of an Unsteady Rocket Launch from the AH-64D Apache Longbow Helicopter

Rocket and missile firings from attack helicopters can cause main engine compressor stall. Studies of this phenomenon suggest that the main engine ingests either the plume from the rockets or the rocket blast waves. This creates surges at the inlet face, causing a loss of power in the main engine. The objective of this project is to set-up a computational fluid dynamics (CFD) simulation of the AH-64D Apache Longbow helicopter during a rocket launch, in order to qualitatively study the fluid dynamics of the problem. This project presents a progression of three unsteady Navier-Stokes solutions. The first unsteady solution involves only a rocket launch from its launch canister. The second solution is a launch from a canister mounted on the Apache's wing-pylon assembly. The last solution includes the Apache main engine and fuselage. The computations use a series of structured, overset grid systems, which allow for a rocket moving in a prescribed path. The method implements a Roe upwind scheme with LU-SGS (lower-upper factored symmetric Gauss-Seidel). A rotor pressure disk model approximates the helicopter rotor, while the rocket engine exit properties are applied as a prescribed boundary condition. Although the project is only at the half-way point, the first and second CFD simulations suggest the possibility of pressure wave interference. Sudden surges in pressure occur from two sources: at rocket start-up, and as the rocket leaves the canister. Wave patterns set-up by these sources appear to propagate to the location of the engine inlet. However the simplified geometry simulation with the main engine needs to be performed before coming to a conclusion.

Okamoto, Kevin↗

DOE OSTI2025

Sensitive Detection of Structural Differences using a Statistical Framework for Comparative Crystallography

Chemical and conformational changes underlie the functional cycles of proteins. Comparative crystallography can reveal these changes over time, over ligands, and over chemical and physical perturbations in atomic detail. A key difficulty, however, is that the resulting observations must be placed on the same scale by correcting for experimental factors. We recently introduced a Bayesian framework for correcting (scaling) X-ray diffraction data by combining deep learning with statistical priors informed by crystallographic theory. To scale comparative crystallography data, we here combine this framework with a multivariate statistical theory of comparative crystallography. By doing so, we find strong improvements in the detection of protein dynamics, element-specific anomalous signal, and the binding of drug fragments.

Hekstra, Doeke R. [Harvard Univ., Cambridge, MA (U↗

DOE OSTI2020

Dynamics of Hydroxyl Anions Promotes Lithium Ion Conduction in Antiperovskite Li 2 OHCl

Li 2 OHCl is an exemplar of the antiperovskite family of ionic conductors, for which high ionic conductivities have been reported, but in which the atomic-level mechanism of ion migration is unclear. The stable phase is both crystallographically defective and disordered, having similar to 1/3 of the Li sites vacant, while the presence of the OH(- )anion introduces the possibility of rotational disorder that may be coupled to cation migration. In this work, complementary experimental and computational methods are applied to understand the relationship between the crystal chemistry and ionic conductivity in Li 2 OHCl , which undergoes an orthorhombic to cubic phase transition near 311 K (approximate to 38 degrees C) and coincides with the more than a factor of 10 change in ionic conductivity (from 1.2 x 10 -5 mS/cm at 37 degrees C to 1.4 x 10 -3 mS/cm at 39 degrees C). X ray and neutron experiments conducted over the temperature range 20-200 degrees C, including diffraction, quasi-elastic neutron scattering (QENS), the maximum entropy method (MEM) analysis, and ab initio molecular dynamics (AIMD) simulations, together show conclusively that the high lithium ion conductivity of cubic Li2OHCl is correlated to "paddlewheel" rotation of the dynamic OH - anion. The present results suggest that in antiperovskites and derivative structures a high cation vacancy concentration combined with the presence of disordered molecular anions can lead to high cation mobility.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

DOE OSTI2026

Programmed synthesis of mesoporous protein crystals in cellular reactors

Protein crystals are naturally derived mesoporous materials with versatile structures and physicochemical properties. Here we introduce an intracellular synthesis platform that enables controllable and programmable protein crystallization. In live cells, we show that, after initial nucleation, steady protein expression governs crystal growth, yielding predictable, tunable dynamics in live cells. Exploiting this feature, we combined HaloTag and click chemistries to achieve modular, programmable immobilization of diverse guest materials with spatial patterning down to ~100 nm resolution. We further demonstrated the sequential release of immobilized materials in physiologically relevant fluids. As a proof of concept, we programmed particles to carry human fibroblast growth factors in distinct layers, which elicited designed oscillatory Akt signalling patterns in cell culture. Finally, this work outlines a programmable method for producing mesoporous materials, with possible applications in catalysis and biomedicine.

Yang, Hongru [Johns Hopkins Univ., Baltimore, MD (↗

DOE OSTI2021

A novel random forest approach to revealing interactions and controls on chlorophyll concentration and bacterial communities during coastal phytoplankton blooms

Abstract Increasing occurrence of harmful algal blooms across the land–water interface poses significant risks to coastal ecosystem structure and human health. Defining significant drivers and their interactive impacts on blooms allows for more effective analysis and identification of specific conditions supporting phytoplankton growth. A novel iterative Random Forests (iRF) machine-learning model was developed and applied to two example cases along the California coast to identify key stable interactions: (1) phytoplankton abundance in response to various drivers due to coastal conditions and land-sea nutrient fluxes, (2) microbial community structure during algal blooms. In Example 1, watershed derived nutrients were identified as the least significant interacting variable associated with Monterey Bay phytoplankton abundance. In Example 2, through iRF analysis of field-based 16S OTU bacterial community and algae datasets, we independently found stable interactions of prokaryote abundance patterns associated with phytoplankton abundance that have been previously identified in laboratory-based studies. Our study represents the first iRF application to marine algal blooms that helps to identify ocean, microbial, and terrestrial conditions that are considered dominant causal factors on bloom dynamics.

59 BASIC BIOLOGICAL SCIENCES↗

DOE OSTI2021

Effect of insulator surface conditioning on the pinch dynamics and x-ray production of a Ne-filled dense plasma focus

The dense plasma focus (DPF) can be an intense source of x rays, wherein the insulator sleeve strongly dictates the electrical breakdown, which subsequently affects the formation of a plasma sheath and a collapse phase. Experiments on a 25 kJ DPF (operated at 4.4 kJ) are carried out to demonstrate the influence of insulator surface morphology on the pinch structure, dynamics, and x-ray yield using a Ne fill. Two borosilicate insulators are directly compared, one with a smooth finish and the other machined with four circumferential grooves traversing the perimeter of the exterior insulator surface. Comparisons are made through same-shot imaging diagnostics of the evolving plasma sheath during breakdown, rundown, and at the pinch in addition to the time-resolved measurements of emitted x rays via filtered photodiodes. The presence of structures on the insulator sleeve reduces x-ray production across all fill pressures by a factor of 2.8 ± 2.4 on average and reduces the highest x ray producing shots by a factor of 5. ± 1.8. Observations of sheath asymmetry and inhomogeneity at lift-off are observed and correlated with subsequent observations of off-axis radial collapse. Taken together, this suggests that local variations in the insulator surface decrease the spatial uniformity of the sheath, leading to an azimuthally asymmetric focus, reduced electron densities, and, ultimately, degraded x-ray production.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

DOE OSTI2020

Collagen Turnover in Relation to Risk Factors and Hemodynamics in Human Intracranial Aneurysms

Determinants for molecular and structural instability, that is, impending growth or rupture, of intracranial aneurysms (IAs) remain uncertain. To elucidate this, we endeavored to estimate the actual turnover rates of the main molecular constituent in human IA (collagen) on the basis of radiocarbon ( 14 C) birth dating in relation to IA hemodynamics. Collagen turnover rates in excised human IA samples were calculated using mathematical modeling of 14 C birth dating data of collagen in relation to risk factors and histological markers for collagen maturity/turnover in selected IA. Hemodynamics were simulated using image-based computational fluid dynamics. Correlation, logistic regression, and receiver operating characteristic analyses were performed. Collagen turnover rates were estimated in 46 IA (43 patients); computational fluid dynamics could be performed in 20 IA (20 patients). The mean collagen turnover rate (γ) constituted 126% (±1% error) per year. For patients with arterial hypertension, γ was greater than 2600% annually, whereas γ was distinctly lower with 32% (±1% error) per year for patients without risk factors, such as smoking and hypertension. There was a distinct association between histological presence of rather immature collagen in human IA and the presence of modifiable risk factors. Spatial-temporal averaged wall shear stress predicted rapid collagen turnover (odds ratio, 1.6 [95% CI, 1.0–2.7]). Receiver operating characteristic analysis demonstrated a good test accuracy (area under the curve, 0.798 [95% CI, 0.598–0.998]) for average wall shear stress with a threshold ≥4.9 Pa for rapid collagen turnover. Our data indicate that turnover rates and stability of collagen in human IA are strongly associated with the presence of modifiable risk factors and aneurysmal hemodynamics. Finally, these findings underline the importance of strict risk factor modification in patients with unruptured IA. Future should include more detailed risk factor data to establish a more causal understanding of hemodynamics and the rupture risk of individual IA.

60 APPLIED LIFE SCIENCES↗

NASA NTRS1984

A Shuttle free flyer qualification/acceptance program - Galileo

The next U.S. planetary mission, the Galileo Project, is to be launched in late spring 1986. Primary studies to be conducted are related to the chemical composition and physical state of Jupiter's atmosphere, the chemical composition and physical state of the Jovian satellites, and the structure and physical dynamics of the Jovian magnetosphere. The studies are to be performed with the aid of a planetary Orbiter and an atmospheric entry Probe. At launch and during the interplanetary cruise trip to Jupiter, the Orbiter and Probe will form an integrated spacecraft. The Shuttle will be employed in the launch of the spacecraft. A Centaur high energy upper stage is to transfer the spacecraft from the Shuttle parking orbit to the direct earth-to-Jupiter trajectory. Attention is given to Galileo environmental program special characteristics and major influencing factors.

Schlue, J. W.↗

NASA NTRS1986

Report of the Presidential Commission on the Space Shuttle Challenger Accident, Volume 1

The findings of the Commission regarding the circumstances surrounding the Challenger accident are reported and recommendations for corrective action are outlined. All available mission data, subsequent tests, and wreckage analyses were reviewed and specific failure scenarios were developed. The Commission concluded that the cause of the Mission 51-L accident was the failure of the pressure seal in the aft field joint of the right solid rocket motor. The failure was due to a faulty design unacceptably sensitive to a number of factors. These factors were the effects of temperature, physical dimensions, the character of materials, the effects of reuse, processing, and the reaction of the joint to dynamic loading. In addition to analyzing the material causes of the accident, the Commission examined the chain of decisions that culminated in approval of the launch. It concluded that the decision making process was flawed in several ways including (1) failure in communication resulting in a launch decision based on incomplete and misleading information, (2) a conflict between engineering data and management judgements, and (3) a NASA management structure that permitted flight safety problems to bypass key Shuttle managers.

Rogers, W. P.↗

DOE OSTI2023

Deep decarbonization and U.S. biofuels production: a coordinated analysis with a detailed structural model and an integrated multisectoral model

Scenarios for deep decarbonization involve biomass for biofuels, biopower, and bioproducts, and they often include negative emissions via carbon capture and storage or utilization. However, critical questions remain about the feasibility of rapid growth to high levels of biomass utilization, given biomass and land availability as well as historical growth rates of the biofuel industry. We address these questions through a unique coordinated analysis and comparison of carbon pricing effects on biomass utilization growth in the United States using a multisectoral integrated assessment model, the Global Change Analysis Model (GCAM), and a biomass-to-biofuels system dynamics model, the Bioenergy Scenario Model (BSM). We harmonized and varied key factors—such as carbon prices, vehicle electrification, and arable land availability—in the two models. We varied the rate of biorefinery construction, the fungibility of feedstock types across conversion processes, and policy incentives in BSM. The rate of growth in biomass deployment under a carbon price in both models is within the range of current literature. However, the reallocation of land to biomass feedstocks would need to overcome bottlenecks to achieve growth consistent with deep decarbonization scenarios. Investments as a result of near-term policy incentives can develop technology and expand capacity—reducing costs, enabling flexibility in feedstock use, and improving stability—but if biomass demand is high, these investments might not overcome land reallocation bottlenecks. Biomass utilization for deep decarbonization relies on extraordinary growth in biomass availability and industrial capacity. In this paper, we quantify and describe the potential challenges of this rapid change.

09 BIOMASS FUELS↗

NASA NTRS1974

The helium component of solar wind velocity streams

Systematic variations of the properties of the helium constituent of the solar wind in the velocity streams are described. It is found that the helium abundance varies by about a factor of 2 as the stream is crossed. The velocity of the helium differs from that of the hydrogen by a few kilometers per second throughout much of the stream structure. This velocity difference is greatest immediately after the proton density peak passes, the helium velocity being typically 20 km/sec faster than the protons at that position in the stream. A sharp dip in the helium to proton temperature ratio is centered on the proton density peak. Although it appears reasonable that at least the velocity and temperature effects are due to the dynamic interactions of the two streams, it is not yet clear exactly what physical processes are directly involved in producing the effects described here.

Hirshberg, J.↗

NASA NTRS1982

Three-dimensional simulations of cumulus congestus clouds on GATE day 261

Schlesinger's (1978) three-dimensional cumulus model is applied to showering congestus clouds on day 261 of GATE. Model results are compared with each other and with observations to analyze the effects of varying shear and altered sounding. Relationships between shear, mesovortices and dynamic entrainment are examined, as well as the model clouds' impact on the environment as a function of shear. The simulations appear to resemble reality in many important aspects. Altostratus layers observed on day 261 are found to be a by-product of convection in three-dimensional shear. Rapid erosion of cloud base to 3.6 km is related to the ambient thermal structure, with wind shear and initial perturbation playing a secondary role. Some of the apparent conflict regarding lateral versus cloud-top entrainment is clarified, as well as some factors governing convective downdraft structure and intensity.

Simpson, J.↗

NASA NTRS2009

Technology Transfer Challenges: A Case Study of User-Centered Design in NASA's Systems Engineering Culture

The Upper Stage (US) section of the National Aeronautics and Space Administration's (NASA) Ares I rocket will require internal access platforms for maintenance tasks performed by humans inside the vehicle. Tasks will occur during expensive critical path operations at Kennedy Space Center (KSC) including vehicle stacking and launch preparation activities. Platforms must be translated through a small human access hatch, installed in an enclosed worksite environment, support the weight of ground operators and be removed before flight - and their design must minimize additional vehicle mass at attachment points. This paper describes the application of a user-centered conceptual design process and the unique challenges encountered within NASA's systems engineering culture focused on requirements and "heritage hardware". The NASA design team at Marshall Space Flight Center (MSFC) initiated the user-centered design process by studying heritage internal access kits and proposing new design concepts during brainstorming sessions. Simultaneously, they partnered with the Technology Transfer/Innovative Partnerships Program to research inflatable structures and dynamic scaffolding solutions that could enable ground operator access. While this creative, technology-oriented exploration was encouraged by upper management, some design stakeholders consistently opposed ideas utilizing novel, untested equipment. Subsequent collaboration with an engineering consulting firm improved the technical credibility of several options, however, there was continued resistance from team members focused on meeting system requirements with pre-certified hardware. After a six-month idea-generating phase, an intensive six-week effort produced viable design concepts that justified additional vehicle mass while optimizing the human factors of platform installation and use. Although these selected final concepts closely resemble heritage internal access platforms, challenges from the application of the user-centered process provided valuable lessons for improving future collaborative conceptual design efforts.

Quick, Jason↗

NASA NTRS2015

Magnetostrictive Vibration Damper and Energy Harvester for Rotating Machinery

Vibrations generated by machine driveline components can cause excessive noise and structural damage. Magnetostrictive materials, including Galfenol (iron-gallium alloys) and Terfenol-D (terbium-iron-dysprosium alloys), are able to convert mechanical energy to magnetic energy. A magnetostrictive vibration ring is proposed, which generates electrical energy and dampens vibration, when installed in a machine driveline. A 2D axisymmetric finite element (FE) model incorporating magnetic, mechanical, and electrical dynamics is constructed in COMSOL Multiphysics. Based on the model, a parametric study considering magnetostrictive material geometry, pickup coil size, bias magnet strength, flux path design, and electrical load is conducted to maximize loss factor and average electrical output power. By connecting various resistive loads to the pickup coil, the maximum loss factors for Galfenol and Terfenol-D due to electrical energy loss are identified as 0.14 and 0.34, respectively. The maximum average electrical output power for Galfenol and Terfenol-D is 0.21 W and 0.58 W, respectively. The loss factors for Galfenol and Terfenol-D are increased to 0.59 and 1.83, respectively, by using an L-C resonant circuit.

Magnetostrictive↗

NASA NTRSDate not supplied

Recent Progress on Rans-Based Transition Model Verification

The current efforts to assess and improve the Reynolds-averaged Navier-Stokes (RANS)-coupled transition models in the NASA FUN3D and OVERFLOW codes are summarized in this study. The first AIAA Transition Modeling Workshop and the NATO AVT-313 Transition Workshop both emphasized the need for code verification for transport equations based transition models as a top priority. We discuss the methods used for the model verification, the resulting grid families, the flow solutions, and other supporting information collected with at least two established NASA flow solvers, namely, FUN3D and OVERFLOW. These results, which will be uploaded onto the NASA Turbulence Modeling Resource, should assist other members of the computational fluid dynamics (CFD) community in verifying their own implementations of various transition models, such as the Langtry-Menter (LM2009) model, the one-equation γ model, and Coder’s amplification factor transport (AFT) model. Grid convergence is assessed using both global and local flow metrics of interest such as lift and drag as well as local skin-friction coefficients. We also explore the anisotropic unstructured metric-based adaptive mesh refinement library known as refine with the NASA FUN3D solver to determine if this capability can achieve the same accuracy as handcrafted structured grids with a significantly smaller node count and to learn the characteristics of the resulting grid distribution, especially in the vicinity of the transition zone.

Transition↗

NASA NTRSDate not supplied

Recent Progress on RANS-Based Transition Model Verification

RANS↗

DOE OSTI2023

Experimental and Numerical Investigation of Flow Boiling in Additive Manufactured Foam Structures With Vapor Pathways

Abstract The unique properties of metal foams make them potential candidates for a range of applications, including microsystem thermal management. Using additive manufacturing to create foam-type structures can improve upon prior thermal solutions by eliminating thermal interface materials and allowing for customization/local control of parameters. In the present investigation, flow boiling in additive-manufactured metal foams is investigated both experimentally and numerically. Two test samples, one with uniform structure and the other with pathways for vapor removal, are compared both experimentally and numerically. A conjugate computational fluid dynamics and heat transfer (CFD-HT) model utilizing a three-dimensional volume of fluid (VOF) model with accompanying evaporation/condensation model provided in-depth visualization of the boiling flow phenomena. The experiments generated the thermohydraulic performance over a range of heat fluxes, demonstrating that the sample incorporating dedicated vapor pathways performed better in both pressure and heat transfer performance metrics compared to the uniform foam. Additionally, negative system-level effects (i.e., hydraulic oscillations) were shown to be abated using the vapor removal structures. The numerical model yielded further insight into the factors contributing to the improved performance. Results indicated the pathways functioned as vapor removal channels, allowing the generated vapor to vent from the foam structure into the lanes. Further computational investigations demonstrated changes in flow regimes, where the addition of vapor channels caused the flow to change from churn to annular. Bubble behavior unique to the vapor pathway structure was studied, showing stagnant regions that eject vapor into the channel.

Engineering↗