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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 55 records · Page 3
All sourcesNASA NTRSDOE OSTI
DOE OSTI2026

Microstructure, Transport, and Mechanics of Compacted Clay Simulated at the 0.1 μm Scale (1400 Smectite Clay Particles) Using a Coarse-Grained Model with Explicit Counterions

Clay-rich geomaterials play a critical role in many subsurface systems. The macroscale properties of these materials (low permeability, high ionic conductivity, high swelling pressure, etc.) are sensitive to molecular-level adsorption and hydration interactions at clay−water interfaces. Efforts to develop multiscale simulation approaches to predict these properties reveal a scale gap between atomistic simulations (typically limited to systems smaller than 10 nm) and continuum-scale models (which use computational grid elements with dimensions ≳ 10 μm). In this study, we present a coarse-grained (CG) framework that partly bridges this gap by simulating compacted smectite clay assemblages with dimensions of 0.1 μm containing 1,400 clay particles across a range of dry densities (1,050 to 1,850 kg·m −3 ) and Na/Ca counterion compositions (Na fraction ranging from 0.2 to 1). The simulated systems, along with their reconstructed binary three-dimensional pore networks, are used to evaluate the microstructure, pore size distribution, tortuosity, ion diffusivity, and swelling pressure of compacted smectite clay. Results show that our approach captures important features of the mesoscale heterogeneity of compacted clays, including tactoid formation, hierarchical porosity, and anisotropic pore networks. Results also reveal how compaction and counterion composition govern emergent behaviors, including dominant pore sizes, directional transport, and electrochemical response. This work highlights the potential of CG simulations to bridge molecular and continuum scales and to advance geotechnical and environmental applications involving clay-rich materials as well as related nanoporous media such as geopolymers and calcium-silicate-hydrate. However, the results also suggest that accurate prediction of certain microstructural and mechanical properties (e.g., swelling pressure) may require even larger-scale systems on the order of 1 μm.

02 PETROLEUM↗
NASA NTRS2023

Interrogating Solar Flare Loop Models with IRIS Observations 2: Plasma Properties, Energy Transport, and Future Directions

During solar flares a tremendous amount of magnetic energy is released and transported through the Sun’s atmosphere and out into the heliosphere. Despite over a century of study, many unresolved questions surrounding solar flares are still present. Among those are how does the solar plasma respond to flare energy deposition, and what are the important physical processes that transport that energy from the release site in the corona through the transition region and chromosphere? Attacking these questions requires the concert of advanced numerical simulations and high spatial-, temporal-, and spectral-resolution observations. While flares are 3D phenomenon, simulating the NLTE flaring chromosphere in 3D and performing parameter studies of 3D models is largely outwith our current computational capabilities. We instead rely on state-of-the-art 1D field-aligned simulations to study the physical processes that govern flares. Over the last decade, data from the Interface Region Imaging Spectrograph (IRIS) have provided the crucial observations with which we can critically interrogate the predictions of those flare loop models. Here in Paper 2 of a two-part review of IRIS and flare loop models, I discuss how forward modelling flares can help us understand the observations from IRIS, and how IRIS can reveal where our models do well and where we are likely missing important processes, focussing in particular on the plasma properties, energy transport mechanisms, and future directions of flare modelling.

solar flares↗
DOE OSTI2025

Multi-material ALE remap with interface sharpening using high-order matrix-free finite element methods

The arbitrary Lagrangian-Eulerian (ALE) technique involves remapping field quantities from a Lagrangian mesh to an optimized mesh in a conservative, accurate and bounds-preserving manner. For methods based on arbitrary order finite elements, as described in a reference, material volume fractions are advected in pseudo-time using flux-corrected transport (FCT) without any form of interface reconstruction. In practice, this can lead to excessive propagation of small volume fractions throughout the domain. In addition, this method requires assembly of a global advection matrix to compute the bounds-preserving low-order FCT solution. In this work, we introduce a new approach for ALE remap using a high-order matrix-free technique which incorporates a flux modification to sharpen material interfaces in a conservative manner. Our approach begins with computing a bounds-preserving low-order solution to the ALE remap equations at the element level. We then compute a sharp interface solution (not guaranteed to be bounds-preserving) which comes from solving an augmented version of the ALE remap equations with a conservative flux modification which acts to sharpen material volume fractions based on their gradients and transport directions. Using the sharp interface solution, we make global corrections to the bounds-preserving solution while maintaining preservation of bounds. By blending with the sharpened solution at the global level we are able to globally conserve mass without hindering the remap pseudo-time step. This new interface-aware ALE remap method is based entirely on partial assembly techniques where globally assembled matrix operators are no longer needed, resulting in a globally matrix-free FCT method for multi-material, multi-field ALE remap with high performance on GPU architectures. We present results of our new remap method on 1D, 2D and 3D benchmarks and describe the algorithmic tailoring for GPU architectures that was developed.

Vargas, Arturo [Lawrence Livermore National Labora↗
DOE OSTI2021

All-day fresh water harvesting by microstructured hydrogel membranes

Abstract Solar steam water purification and fog collection are two independent processes that could enable abundant fresh water generation. We developed a hydrogel membrane that contains hierarchical three-dimensional microstructures with high surface area that combines both functions and serves as an all-day fresh water harvester. At night, the hydrogel membrane efficiently captures fog droplets and directionally transports them to a storage vessel. During the daytime, it acts as an interfacial solar steam generator and achieves a high evaporation rate of 3.64 kg m −2 h −1 under 1 sun enabled by improved thermal/vapor flow management. With a homemade rooftop water harvesting system, this hydrogel membrane can produce fresh water with a daily yield of ~34 L m −2 in an outdoor test, which demonstrates its potential for global water scarcity relief.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2025

Single-molecule live-cell RNA imaging with CRISPR–Csm

Abstract Understanding the diverse dynamic behaviors of individual RNA molecules in single cells requires visualizing them at high resolution in real time. However, single-molecule live-cell imaging of unmodified endogenous RNA has not yet been achieved in a generalizable manner. Here, we present single-molecule live-cell fluorescence in situ hybridization (smLiveFISH), a robust approach that combines the programmable RNA-guided, RNA-targeting CRISPR–Csm complex with multiplexed guide RNAs for direct and efficient visualization of single RNA molecules in a range of cell types, including primary cells. Using smLiveFISH, we track individual nativeNOTCH2andMAP1Btranscripts in living cells and identify two distinct localization mechanisms including the cotranslational translocation ofNOTCH2mRNA at the endoplasmic reticulum and directional transport ofMAP1BmRNA toward the cell periphery. This method has the potential to unlock principles governing the spatiotemporal organization of native transcripts in health and disease.

Biotechnology & Applied Microbiology↗
DOE OSTI2022

Revealing uncommon transport in the previously unascertained very low cation clathrate-I Eu 2 Ga 11 Sn 35

In this study, high occupancy of cation sites is typical for clathrate-I compositions allowing limited tunability of the electrical properties beyond doping and elemental substitution. Herein, we report on the structure and electrical transport of single-crystal Eu 2 Ga 11 Sn 35 , the sole example of a very low (25%) cation concentration clathrate-I material with atypical transport directly attributable to the structure and stoichiometry.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2026

Data-based filtered dissipation rate modelling for multi-modal turbulent combustion: evaluating a priori model generalizability

Manifold-based models offer a computationally efficient alternative to directly transporting the thermochemical state in computational simulations of turbulent reacting flows, projecting the high-dimensional thermochemical state-space onto a low-dimensional manifold. Recent efforts have yielded a manifold-based model applicable to multi-modal combustion, enabling reconstruction of the thermochemical state from solutions to two-dimensional manifold equations in mixture fraction and generalized progress variable that are parameterised by three scalar dissipation rates. In coarse-grained simulations such as Large Eddy Simulation (LES), closure of the multi-modal manifold equations and subfilter variances/covariance requires closure of three filtered scalar dissipation rates. Here, the present work adopts a data-based approach, providing closure for the three filtered scalar dissipation rates via deep neural networks (DNNs). High-fidelity datasets corresponding to an autoigniting n-dodecane jet flame and a bluff body swirl-stabilized confined lifted spray flame of two aviation fuels (Jet-A and C1) with different ignition propensities are leveraged to generate training data that spans a diverse range of thermodynamic conditions and combustion modes, including low- and high-temperature ignition regimes in addition to premixed and nonpremixed behaviour. A final DNN model is trained to enforce inherent physical constraints by learning nonlinear functional transformations of the three filtered scalar dissipation rates. The generalizability of this constrained DNN model is demonstrated a priori via conditional statistics evaluated on the lifted spray flame with C1–a configuration that had not been included in the training data. Excellent DNN agreement with conditional DNS statistics is observed, and integrated gradients are computed to identify the most sensitive input variables. The similarity of the marginal PDFs of the most informative input variables and outputs across configurations are quantified via the Wasserstein metric, demonstrating that data-based models may successfully generalize to unseen parametric conditions so long as the most informative input variables share similar distributions across training and testing datasets.

Data-based modelling↗
DOE OSTI2025

Integration and commissioning plan of Full Flow Purifier at Muon Campus

The Full Flow Purifier for Fermilab’s Muon Campus uses a charcoal bed surrounded by a liquid nitrogen jacket to purify up to 240 g/s of helium gas. Fabrication by Ability Engineering Technology Inc. has been completed and the purifier delivered to Fermilab. It is the largest purifier to be used at Fermilab based on both capacity and size. A previous paper discussed the design of purifier for various operational conditions and horizontal shipping. The purifier is designed to withstand 5g force in vertical and 2g force in lateral and longitudinal directions. Transportation experience from vendor to Fermilab and within site is discussed. Integration of the purifier involved design and fabrication of a liquid nitrogen transfer line, regeneration system, and helium piping to connect it to Muon Campus cryogenic system. It also involved establishing electrical, instrumentation and controls connections to the system. Integration of the purifier is discussed in detail. The purifier is to be commissioned using up to 4 MYCOM helium compressors to supply helium and liquid nitrogen supplied by a 15,000 -gallon tank. Actual effectiveness of the 3-stream heat exchanger is to be estimated based on measured temperatures and flow rate. Impurity levels shall be monitored at inlet and outlet of the purifier. Theoretical adsorption capacity of the purifier is calculated based on the measured temperatures and flowrates and is compared to actual adsorption capacity over time.

Subedi, Jeewan [Fermilab]↗
DOE OSTI2022

Dehalogenation reactions between halide salts and phosphate compounds

Reactions between phosphoric acid [H 3 PO 4 ] or ammonium hydrogen phosphates [i.e., NH 4 H 2 PO 4 , (NH 4 ) 2 HPO 4 ] and halide salts can be used to dehalogenate (remove halides from) salt-based waste streams, where the process of removing halides yields products that have more efficient disposal pathways for repository storage. In this context, the term efficiency is defined as higher waste loadings and simplified immobilization processes with potential for recycle of certain salt components (e.g., 37 Cl as H 37 Cl or NH 4 37 Cl). The main streams identified for these processes are nuclear wastes generated during electrochemical reprocessing of used nuclear fuel as well as used halide salts from molten salt reactor operation. The potential byproducts of these reactions are fairly consistent across the range of halide species (i.e., F, Cl, Br, I) where the most common are hydrogen halides [e.g., HCl (g) ] or ammonium halides (e.g., NH 4 Cl). However, trihalide compounds (e.g., NCl 3 ), nitrogen triiodide ammine adducts [NI 3 ·(NH 3 ) x ], and ammonium triiodide (NH 4 I 3 ) are also possible. Several of these byproducts (i.e., NCl 3 , NBr 3 , NI 3 , and NH 4 I 3 ) are shock-sensitive contact explosives so their production in these processes must be tracked and carefully controlled, which includes methods of immediate neutralization upon production such as direct transport to a caustic scrubber for dissolution. Several benefits arise from utilizing H 3 PO 4 as the phosphate additive during dehalogenation reactions for making iron phosphate waste forms including more oxidized iron (higher Fe 3+ :Fe 2+ ratios), higher chemical durabilities, and the avoidance of trihalides, but the byproducts are hydrogen halides, which are corrosive and require special handling.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2022

Multiscale water drop contact angles at selected silica surfaces

In this paper, multiscale advancing contact angles for glycerol/water drops at silica surfaces are reported for millidrops, submicron-drops, and nanodrops. Selected silica surfaces were muscovite, silicon, and talc. The contact angles for millidrops (1–2 mm) were determined by the traditional sessile drop technique. For submicron-drops (0.1–1.0 μm), a hollow tip Atomic Force Microscope (AFM) procedure was used. The contact angles for nanodrops (~7 nm) were examined from Molecular Dynamics (MD) simulation. The results were compared to evaluate the effect of drop size on the contact angle. In the case of the hydrophobic talc surface, the 75° advancing contact angle did not vary significantly with drop size. For the hydrophilic muscovite surface, the water drop wet the surface and an advancing contact angle of about 10° was found for the millidrops and submicron-drops. However, for the MD simulated nanodrops, attachment and spreading of the ~7 nm drop created a 2D film of molecular dimensions, the contact angle of which was difficult to define and varied from 0° to 17°. Perhaps of equal interest from the MD simulation results was that the spreading of the glycerol/water nanodrop at the muscovite surface resulted in crystallographic directional transport of water molecules to the extremities of the 2D film. Such separation and segregation left the center of the film with an increased concentration of glycerol. Based on these results, the line tension, which has been found in other investigations to account for contact angle decrease with a decrease in drop size, does not seem to be a significant factor in this study.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
NASA NTRS1976

Airframe technology for energy efficient transport aircraft

NASA has initiated a comprehensive Aircraft Energy Efficiency Program which is concerned with the development of approaches for reducing fuel consumption in new aircraft of the 1980-2000 time period. A review is presented of the airframe technologies selected for emphasis in the NASA program, taking into account an evaluation of their potential for reducing transport direct operating costs through fuel efficiency. Attention is given to the importance of fuel efficiency, the impact of advanced technology, advanced composite structures, the NASA composite primary structures program, advanced aerodynamics and active controls, supercritical wing geometry, active load and flutter control, and aspects of laminar flow control.

Leonard, R. W.↗
NASA NTRS1980

Installation and checkout of the DOE/NASA Mod-1 2000-kW wind turbine generator

The Mod-1 machine was assembled without the blades, tested, and sent to the site at Boone, North Carolina for erection. The blades were transported directly to the site. A series of checkout tests were then conducted to evaluate performance and loads. The results of these tests compared well with the design data.

Puthoff, R. L.↗
NASA NTRS1979

Thermal energy storage for the Stirling engine powered automobile

A thermal energy storage (TES) system developed for use with the Stirling engine as an automotive power system has gravimetric and volumetric storage densities which are competitive with electric battery storage systems, meets all operational requirements for a practical vehicle, and can be packaged in compact sized automobiles with minimum impact on passenger and freight volume. The TES/Stirling system is the only storage approach for direct use of combustion heat from fuel sources not suitable for direct transport and use on the vehicle. The particular concept described is also useful for a dual mode TES/liquid fuel system in which the TES (recharged from an external energy source) is used for short duration trips (approximately 10 miles or less) and liquid fuel carried on board the vehicle used for long duration trips. The dual mode approach offers the potential of 50 percent savings in the consumption of premium liquid fuels for automotive propulsion in the United States.

Morgan, D. T.↗
NASA NTRS1981

Numerical modeling of diffusive physical vapor transport in cylindrical ampoules

Diffusion limited physical vapor transport in closed cylindrical ampoules of aspect ratio (length/radius) between 0.5 and 10 was studied numerically. The transport of a crystal forming component A through an inert component B, which undergoes zero net transport, was considered. A case in which the partial pressure of B is comparable to that of A, as well as systems with very low partial pressures of B (impurity cases) were treated. Concentrations and velocity distributions were obtained from the coupled transport equations for momentum, mass and components. It was found that the interdiffusion of components in viscous interaction with the container walls leads to (1) recirculation of component B, even in the absence of gravity; (2) concentration gradients normal to the main transport direction in the vapor space; and (3) non-uniform interfacial concentration gradients and, hence, non-uniform crystal growth rates.

Greenwell, D. W.↗
NASA NTRS1979

Convective and morphological instability in vapor crystal growth

Theoretical and experimental work on the fluid dynamics of physical vapor transport is reported. It is shown that diffusion in viscous interaction with container walls leads to concentration gradients normal to the main transport direction. Consequently any convection threshold is removed. This coupling with convective instabilities makes the theoretical interpretation of earthbound (anisotropic) morphological stability studies on vapor-solid interfaces intractable. Hence low-gravity experiments are suggested that will allow for the establishment of morphological stability criteria under diffusion controlled conditions.

Rosenberger, F.↗
NASA NTRS1987

Regional sources and sinks of dust on Mars: Viking observations of Cerberus, Solis Planum and Syrtis Major

A study of seasonal variations of albedo features in the Cerberus, Solis Planum, and Syrtis Major regions was based on Viking Orbiter data obtained over more than one complete Martian year. Contour maps of Lambert albedo and single-point thermal inertia were constructed from the Infrared Thermal Mapper (IRTM) experiment data, and Orbiter images were used to determine the pattern and variability of regional winds (inferred from wind streak orientations). Coupled with ground-based radar data, these data allow the regional sediment transport direction, surface properties (texture, morphology, and roughness), and the implications of the observed seasonal and longer term dust redistribution to be investigated. Results are outlined.

Lee, Steven W.↗
NASA NTRS1988

Influence of the structure of inlet free-stream turbulence on diffuser performance

The pressure recovery coefficient of a two-dimensional diffuser (Cp) was found to be significantly affected by the intensity and structure of the inlet free-stream turbulence. Significantly larger values of Cp occurred for the case of highly anisotropic inlet free-stream turbulence with the plane of rotation of the eddies parallel to the free-stream flow and perpendicular to the diverging walls of the diffuser, as compared to the values of Cp for the case of grid-generated near-isotropic inlet conditions. The relatively high values of Cp for the case of the highly anisotropic inlet free-stream turbulence conditions can be attributed to highly effective mixing, where the plane of rotation of the eddies facilitates a direct transport of momentum from the free-stream to the boundary layers along the diverging walls of the diffuser, as compared to the mixing that occurs with grid-generated highly unorganized eddies.

Hoffmann, Jon A.↗
NASA NTRS1987

Regional sources and sinks of dust on Mars: Viking observations of Cerberus, Solis Planum, and Syrtis Major

A study of seasonal variation of albedo features in the Cerberus, Solis Planum, and Syrtis Major regions was based on Viking Orbiter data obtained over more than one complete Martian year. Contour maps of Lambert albedo and single point thermal inertia were constructed from the Infrared Thermal Mapper experiment data, and Orbiter images were used to determine the pattern and variability of regional winds (inferred from wind streak orientations). Coupled with ground based radar data, these data allow the regional sediment transport direction, surface properties (texture, morphology, and roughness), and the implications of the observed seasonal and longer term dust redistribution to be investigated. Results are outlined.

Lee, Steven W.↗