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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 613 records · Page 34
All sourcesNASA NTRSDOE OSTI
DOE OSTI2025

Direct Deoxygenation of Phenol over Fe-Based Bimetallic Surfaces Using On-the-Fly Surrogate Models

We present an accelerated nudged elastic band (NEB) study of phenol direct deoxygenation (DDO) on Fe-based bimetallic surfaces using a recently developed Gaussian process regression (GPR) calculator. Our test calculations demonstrate that the GPR calculator achieves up to 3 times speedup compared to conventional density functional theory calculations while maintaining high accuracy, with energy barrier errors below 0.015 eV. Using GPR-NEB, we systematically examine the DDO mechanism on pure Fe(110) and surfaces modified with Co and Ni in both top and subsurface layers. Our results show that subsurface Co and Ni substitutions preserve favorable thermodynamics and kinetics for both C–O bond cleavage and C–H bond formation, comparable to those on the pure Fe(110) surface. In contrast, top-layer substitutions generally increase the C–O bond cleavage barrier, render the step endothermic, and result in significantly higher reverse reaction rates, making DDO unfavorable on these surfaces. This work demonstrates the effectiveness of GRR-accelerated transition state searches for complex surface reactions and provides insights into rational design of bimetallic catalysts for selective deoxygenation.

Aromatic compounds↗
NASA NTRS1994

Measurement of a surface heat flux and temperature

The Heat Flux Microsensor is a new sensor which was recently patented by Virginia Tech and is just starting to be marketed by Vatell Corp. The sensor is made using the thin-film microfabrication techniques directly on the material that is to be measured. It consists of several thin-film layers forming a differential thermopile across a thermal resistance layer. The measured heat flux q is proportional to the temperature difference across the resistance layer q= k(sub g)/delta(sub g) x (t(sub 1) - T(sub 2)), where k(sub g) is the thermal conductivity and delta (sub g) is the thickness of the thermal resistance layer. Because the gages are sputter coated directly onto the surface, their total thickness is less than 2 micrometers, which is two orders of magnitude thinner than previous gages. The resulting temperature difference across the thermal resistance layer (delta is less than 1 micrometer) is very small even at high heat fluxes. To generate a measurable signal many thermocouple pairs are put in series to form a differential thermopile. The combination of series thermocouple junctions and thin-film design creates a gage with very attractive characteristics. It is not only physically non-intrusive to the flow, but also causes minimal disruption of the surface temperature. Because it is so thin, the response time is less than 20 microsec. Consequently, the frequency response is flat from 0 to over 50 kHz. Moreover, the signal of the Heat Flux Microsensor is directly proportional to the heat flux. Therefore, it can easily be used in both steady and transient flows, and it measures both the steady and unsteady components of the surface heat flux. A version of the Heat Flux Microsensor has been developed to meet the harsh demands of combustion environments. These gages use platinum and platinum-10 percent rhodium as the thermoelectric materials. The thermal resistance layer is silicon monoxide and a protective coating of Al2O3 is deposited on top of the sensor. The superimposed thin-film pattern of all six layers is presented. The large pads are for connection with pins used to bring the signal out the back of the ceramic. In addition to the heat flux measurement, the surface temperature is measured with a platinum resistance layer (RTS). The resistance of this layer increases with increasing temperature. Therefore, these gages simultaneously measure the surface temperature and heat flux. The demonstrated applications include rocket nozzles, SCRAM jet engines, gas turbine engines, boiling heat transfer, flame experiments, basic fluid heat transfer, hypersonic flight, and shock tube testing. The laboratory involves using one of these sensors in a small combustion flame. The sensor is made on a 2.5 cm diameter piece of aluminum nitride ceramic.

Davis, R. M.↗
DOE OSTI2022

Heat transport and temperature boundary-layer profiles in closed turbulent Rayleigh–Bénard convection with slippery conducting surfaces

Here, we report direct numerical simulations (DNS) of the Nusselt number Nu , the vertical profiles of mean temperature Θ(z) and temperature variance Ω(z) across the thermal boundary layer (BL) in closed turbulent Rayleigh–Bénard convection (RBC) with slippery conducting surfaces ( z is the vertical distance from the bottom surface). The DNS study was conducted in three RBC samples: a three-dimensional cuboid with length L=H and width W=H/4 ( H is the sample height), and two-dimensional rectangles with aspect ratios Γ≡L/H=1 and 10. The slip length b for top and bottom plates varied from 0 to ∞ . The Rayleigh numbers Ra were in the range 10 6 $⩽$Ra$⩽$10 10 and the Prandtl number Pr was fixed at 4.3 . As b increases, the normalised Nu/Nu 0 ( Nu 0 is the global heat transport for b =0 ) from the three samples for different Ra and Γ can be well described by the same function Nu/Nu 0 = N 0 tanh( b /λ 0 )+1 , with N 0 =0.8±0.03 . Here λ 0 ≡ L /(2 Nu 0 ) is the thermal boundary layer thickness for b =0 . Considering the BL fluctuations for Pr >1, one can derive solutions of temperature profiles Θ(z) and Ω(z) near the thermal BL for b $⩾$ 0 . When b =0 , the solutions are equivalent to those reported by Shishkina et al. ( Phys. Rev. Lett. , vol. 114, 2015, 114302) and Wang et al. ( Phys. Rev. Fluids , vol. 1, 2016, 082301(R)), respectively, for no-slip plates. For b >0, the derived solutions are in excellent agreement with our DNS data for slippery plates.

42 ENGINEERING↗
DOE OSTI2020

In situ multimodal imaging for nanoscale visualization of tribofilm formation

A third of the energy from fuel combustion in passenger car gasoline engines is lost due to friction. Carefully designed engine lubricants can recover some of these losses by reducing friction and wear by forming a nanometer-scale chemico-physico tribofilm between surfaces. Accordingly, attention has focused on developing oil formulations that form low-friction tribofilms. However, analyses of resultant tribofilms are typically conducted after tribo-tests with conventional characterization tools and do not offer insights into tribofilm formation and evolution, precluding information critical to tuning tribofilm properties. In this work, we developed a unique multimodal methodology based on Atomic Force Microscopy (AFM) with local probe heating for in situ tribological studies that activates friction modifiers and simultaneously captures the evolution of friction and surface roughness, with nanometer resolution. As a platform to demonstrate the ability of this methodology to visualize dynamics of tribofilm formation in situ, we apply it to molybdenum-based friction modifiers to distinguish key factors in their functionality and correlate nanoscale AFM and Friction Force Microscopy data to bench tribo-tests used in the industry. To decode the formation mechanisms observed in situ and underlying chemistry of tribofilms, we performed ab initio Molecular Dynamics (AIMD) simulations at comparable conditions. AIMD simulations confirmed both nanoscale and bench tribo-test results and showed deviations in molecular organization in tribofilms that are formed from different molybdenum-based friction modifiers that corroborates with surface functionality. With this innovative methodology, we demonstrate proof-of-principle in situ formation of molybdenum-based tribofilms directly on steel surfaces that could be applied generally to studying tribofilm formation.

36 MATERIALS SCIENCE↗
NASA NTRS1978

Self-alining valve poppet and seat

Poppet-and-seat combination is useful in fluid-control system that has to operate at high temperatures with low leak rates. Contaminants in flow stream are removed before they reach sealing surfaces by altering direction of flow several times before it enters poppet-and-seat flow passage. Particles are separated and deposited on surfaces not affecting sealing performance.

Olivas, U. P.↗
NASA NTRS2021

Pneumatic Sampler (P-Sampler) for the Martian Moons Exploration (MMX)

A Pneumatic Sampler (P-SMP)is being provided by Honeybee Robotics with support from NASA Planetary Missions Program Office (PMPO)for JAXA’s Martian Moons eXploration (MMX) mission. The goal of this mission is to closely survey the Martian moons Deimos and Phobos, and then to collect regolith from Phobos and return it to Earth. The P-SMP will be mounted to a leg of the lander and will be responsible for collecting surface regolith alongside the JAXA provide Core Sampler (C-SMP). The Sampling Funnel of the P-SMP utilizes two sets of sampling nozzles: one set of nozzles pointed directly at the surface to kick-up and loft material into the sampling head, and a second set of nozzles to direct the oncoming material into the sample return canister further up the lander leg. A robotic arm mounted underneath the lander will then remove the sample canister and place it inside the sample return capsule for Earth return. Several iterations of the P-Sampler have been designed and tested inside a vacuum chamber with Phobos regolith simulant. In all tests, the P-Sampler successfully acquired the sample, even in an extreme scenario where the sampling head was mounted 10 cm above a surface covered with gravel.

Dylan Van Dyne↗
NASA NTRS1975

Computational procedure for three-dimensional boundary layers on aircraft and aerospace vehicles

An implicit numerical procedure is developed to solve the full three-dimensional laminar, boundary layer equations over realistic aircraft and spacecraft configurations. This procedure utilizes splined functions in the direction normal to the surface and finite differences in the cross flow direction. Calculation of off-pitch plane attachment and detachment lines can be calculated. The solution procedure permits the incorporation of a wide variety of turbulent models and boundary conditions including; entropy layer procedures, specified surface temperatures or heat flux distributions, surface catalysis, mass addition, and the coupling to both three-dimensional inviscid codes and surface ablation codes. In addition, reasonable computing times are obtained.

Kendall, R. M.↗
DOE OSTI2025

Computational insights into hydrogen adsorption energies on medium-entropy oxides

High entropy oxides (HEOs) have emerged as promising catalysts for several important chemical transformations including alkane activation. Hydrogen adsorption energy (HAE) has been used as a key descriptor for many reactions including methane C–H activation and hydrogen evolution reactions. Hence, understanding the relationship between HAEs and the surface chemistry of HEO surfaces could lay the foundation for meaningful correlations among methane C–H activation, HAE, and the complex, local environment of HEO surfaces. Here, we used a medium-entropy oxide as a prototypical system – Mg 0.25 Ni 0.25 Cu 0.25 Zn 0.25 O with a rock-salt structure – to interrogate these relationships. We sampled 2000 different surfaces of its (100) plane and calculated the HAEs at randomly chosen surface O sites using density functional theory (DFT). Our analysis of the 2000 data points reveals that the HAEs at the surface O sites are significantly influenced by the local environment around the adsorption sites, particularly the nature of the metal atom directly below the surface O site where H adsorbs. After comparing several popular graph-neural-network-based machine learning models, we found that the DimeNet++ model performed best achieving satisfactory accuracy in predicting HAEs for both Mg 0.25 Ni 0.25 Cu 0.25 Zn 0.25 O and slightly varied compositions. Our work underscores the promise of such models and the need for further refinement to address the complexity of HEOs.

Song, Haohong [Vanderbilt Univ., Nashville, TN (Un↗
NASA NTRSDate not supplied

On the Interaction Between a Flow Instability and Inertial Particles in Supersonic Jet Plume-Surface Interaction

Extraterrestrial landings often require spacecraft to deploy supersonic jets directed at dusty planetary surfaces to ensure controlled descents. This interaction, termed plume-surface interaction (PSI), critically influences crater formation and the dynamics of ejected particles, which can obscure vision, damage onboard sensors, and impact nearby infrastructure with significant particle velocities. The physics of PSI remain poorly understood due to the complexities in simulating the involved multiphysics and experimentally replicating reduced atmospheric pressure conditions. This article discusses a collaborative effort to investigate PSI in reduced atmospheric pressure environments using a Mach 5.3 jet impinging on a granular bed. The results highlight observations of an azimuthal pattern in the ejecta distribution, characterized by alternating ejecta streaks of varying particle concentrations. This phenomenon suggests the presence of a low Reynolds number instability, a notable discovery given the supersonic nature of the jet.

PSI↗
DOE OSTI2024

Atmospheric pressure plasmas interacting with wet and dry microchannels: reverse surface ionization waves

Atmospheric pressure plasma jets (APPJs) are increasingly being used to functionalize polymers and dielectric materials for biomedical and biotechnology applications. Once such application is microfluidic labs-on-a-chip consisting of dielectric slabs with microchannel grooves hundreds of microns in width and depth. The periodic channels, an example of a complex surface, present challenges in terms of directly and uniformly exposing the surface to the plasma. In this paper, we discuss results from computational and experimental investigations of negative APPJs sustained in Ar/N 2 mixtures flowing into ambient air and incident onto a series of microchannels. Results from two-dimensional plasma hydrodynamics modeling are compared to experimental measurements of electric field and fast-camera imaging. The propagation of the plasma across dry microchannels largely consists of a sequence of surface ionization waves (SIWs) on the top ridges of the channels and bulk ionization waves (IWs) crossing over the channels. The IWs are directed into electric field enhanced vertices of the next ridge. The charging of these ridges produce reverse IWs responsible for the majority of the ionization. The propagation of the plasma across water filled microchannels evolve into hopping SIWs between the leading edges of the water channels, regions of electric enhancement due to polarization of the water. Positive, reverse IWs follow the pre-ionized path of the initial negative waves.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
NASA NTRS1961

Investigation at High Subsonic Speeds of the Use of Low Auxiliary Tail Surfaces having Dihedral to Improve the Longitudinal and Directional Stability of a T-Tail Model at High Lift

An investigation of the use of low auxiliary horizontal-tail surfaces to alleviate the pitch-up tendency at high lift of an airplane configuration having a T - tail has been conducted in the Langley high-speed 7- by 10-foot tunnel. The basic model had a wing with an aspect ratio of 3, a taper ratio of 0.143, and an unswept 80-percent chord line. The Mach number for most of the tests extended from 0.60 to 0.94 and the angle-of-attack range was from -2 deg. to approximately 24 deg. at the lowest test Mach number. A preliminary study of a systematic series of auxiliary tails indicated that the pitch-up tendency at high lift encountered on the basic model could be greatly alleviated by use of a relatively small, very low-aspect-ratio auxiliary horizontal tail. This tail was located radially with respect to the fuselage center line with 30 deg. negative dihedral and therefore provided a significant favorable increment to directional stability of the model throughout most of the test angle-of-attack range.

Sleeman, William C., Jr.↗
NASA NTRS1992

Directional emittance corrections for thermal infrared imaging

A simple measurement technique for measuring the variation of directional emittance of surfaces at various temperatures using commercially available radiometric IR imaging systems was developed and tested. This technique provided the integrated value of directional emittance over the spectral bandwidth of the IR imaging system. The directional emittance of flat black lacquer and red stycast, an epoxy resin, measured using this technique were in good agreement with the predictions of the electromagnetic theory. The data were also in good agreement with directional emittance data inferred from directional reflectance measurements made on a spectrophotometer.

Daryabeigi, Kamran↗
NASA NTRS2015

Strategic Map for Exploring the Ocean-World Enceladus

Among the many "ocean worlds" of our solar system, Enceladus appears unique in its combination of astrobiologically relevant, exploration-worthy attributes: extensive liquid-water ocean with high-temperature hydrothermal activity, containing salts and organics expressed predictably into space. The Enceladus south polar plume allows direct access to telltale molecules, ions, isotopes, and potential cytofragments in space. Plume mass spectroscopy and sample return, in situ investigation of surface fallback deposits, direct vent exploration, and eventually oceanographic exploration can all be envisioned. However, building consensus to fund such ambitious exploration hinges on acquiring key new data. A roadmap is essential. It could start with cost-capped onramps: 1) flythrough analysis of the plume, following up on Cassini measurements with modern instruments; 2) sample return of plume material for analysis on Earth. A methodical mission sequence in which each step depends on emergent results from prior missions would push in situ oceanographic exploration into the second half of this century. Even for this scenario, prioritization by the next planetary Decadal Survey would be pivotal.

Cassini↗
NASA NTRS1995

Method for determining shear direction using liquid crystal coatings

A method is provided for determining shear direction wherein a beam of white light is directed onto the surface of a liquid crystal coating to cause the white light to be dispersed (reflected) from the surface in a spectrum having bands of different colors in a fixed spatial 2 (angular) sequence. The system is calibrated by locating an observer, e.g., a video and movie camera, such that a particular color band (preferably at or near the center of the reflected spectrum) is observed to thereby provide a reference color band. Because the application of shear causes either clockwise or counterclockwise rotation of the reflected spectrum dependent on the direction of the shear, a determination is then made of the reflected color band observed by the observer when the surface of the liquid crystal is subjected to shear to thereby determine the direction of the shear based on the directional (rotation) relation of the observed color band with respect to the reference color band in the spatial sequence of color bands.

Reda, Daniel C.↗
NASA NTRS1991

Thermographic monitoring of materials under simulated reentry conditions

Thermography can be used to measure surface temperature gradients graphically, and can be used under conditions where the direct measurement of temperature at all desired points, using thermocouples or resistance temperature detectors (RTDs), is either difficult or impossible. The use of thermographic monitoring during a series of arc-jet tests is described. Described in this work are the issues that influence interpretation of the thermographic measurements under these conditions, including the calculation of effective emittance and window transmittance from the spectral properties of the materials in order to calculate the temperature distribution of a surface directly from the measured radiance. Comparison of the surface temperatures measured using thermocouples and the temperatures derived from thermographic measurements show good agreement. The data gathered will be used to evaluate important test parameters such as the heating distribution across the surface of a heat shield test model and at steps on the model surface.

White, Susan M.↗
DOE OSTI2021

Impact of Additive Manufacturing on Internal Cooling Channels With Varying Diameters and Build Directions

Abstract The use of additive manufacturing (AM) processes, such as direct metal laser sintering, provides the design freedom required to incorporate complex cooling schemes in gas turbine components. Additively manufactured turbine components have a range of cooling feature sizes and, because of the inherent three-dimensionality, a wide range of build angles. Previous studies have shown that AM built directions influence internal channel surface roughness that, in turn, augment heat transfer and pressure loss. This study investigates the impact of AM on channel feature size and builds direction relative to tolerance, surface roughness, pressure losses, and convective cooling. Multiple AM coupons were built from Inconel 718 consisting of channels with different diameters and a variety of build directions. An experimental rig was used to measure pressure drop to calculate friction factor and was used to impose a constant surface temperature boundary condition to collect Nusselt number over a range of Reynolds numbers. Significant variations in surface roughness and geometric deviations from the design intent were observed for distinct build directions and channel sizes. These differences led to notable impacts in friction factor and Nusselt number augmentations, which were a strong function of build angle.

Engineering↗
DOE OSTI2024

Light scattering by V 4 O 7 film across the metal–insulator transition

The experimental study of the angle-resolved hemispherical light scattering by V 4 O 7 film within a broad temperature range across metal–insulator transition reveals complex structural reorganization of the film deposited on the c-cut sapphire crystal. The bidirectional scattering distribution function and the surface autocorrelation function were obtained from scattering data to visualize statistics of the spatially resolved contributions of optical inhomogeneities in normal and lateral directions to the surface. The measurements reveal an anisotropic surface roughness distribution due to the twinned domain structure, with significant anisotropy changes across the phase transition. The V 4 O 7 film deposited on sapphire leads to a polydomain structure, minimizing elastic strain energy with distinct multiscale distributions of surface domains. Near T c , the material shows the lowest roughness but the highest lateral disorder of the surface.

36 MATERIALS SCIENCE↗