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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 829 records · Page 46
All sourcesNASA NTRSDOE OSTI
DOE OSTI2019

Droplet Imbibition Enables Nonequilibrium Interfacial Reactions in Charged Microdroplets

A droplet imbibition experiment is proposed to study interfacial effects, which appears to be the main factor influencing reaction acceleration in charged microdroplets produced by electrospray ionization (ESI). One reagent is deposited onto the surface of rapidly moving microdroplets containing the second reagent to be reacted. In this manner, reactions are hindered from reaching equilibrium and monitored in real time by mass spectrometry. We demonstrated this phenomenon using Katritzky chemistry, which is known to proceed either by the solvent-stabilized 2H-pyran intermediate or via the surface-active pseudobase intermediate. Additionally, comparisons with reactions performed using ESI show obvious surface effects in favor of the droplet imbibition experiment. By keeping reactant mole ratio constant, it was demonstrated that similar interfacial effects observed in the droplet imbibition experiment can be reached by allowing ESI microdroplets containing premixed reagents to traverse a distance >16 mm. At such spray distance, molecular diffusion and droplet lifetime become comparable allowing reactants to be enriched at droplet surface. Reactions were also conducted in rapid mixing, theta capillary-based droplets, which showed markedly reduced yields compared with the interfacial droplet imbibition experiment.

36 MATERIALS SCIENCE↗
NASA NTRS1972

LEED structures due to interaction of CO and O2 with /0001/ and /1,0,-1,0/ Re at 20 C to 920 C.

Clean Re surfaces were produced by the Ar(+) ion bombardment technique. Results reported previously by Farnsworth and Zehner (1969) for the adsorption of CO and molecular oxygen on the (0001) Re surface were confirmed. The exposure of a (0001) Re surface to CO at elevated crystal temperatures produced no additional structures. Neither increased surface defect densities nor excitation of the adsorbate enhanced the adsorption characteristics of CO or molecular oxygen on the surfaces studied.

Zehner, D. M.↗
NASA NTRS1979

Coal-shale interface detection

A penetrometer for coal-shale interface detection is presented. It is used with coal cutting equipment consisting of a reciprocating hammer, having an accelerometer mounted thereon to measure the impact of the hammer as it penetrates the ceiling or floor surface of a mine. Additionally, a pair of reflectometers simultaneously view the same surface, and the outputs from the accelerometer and reflectometers are detected and jointly registered to determine when an interface between coal and shale is being cut through.

Broussard, P. H.↗
NASA NTRS1980

Coal-shale interface detector

A coal-shale interface detector for use with coal cutting equipment is described. The detector consists of a reciprocating hammer with an accelerometer to measure the impact of the hammer as it penetrates the ceiling or floor surface of a mine. Additionally, a pair of reflectometers simultaneously view the same surface, and the outputs from the accelerometer and reflectometers are detected and jointly registered to determine when an interface between coal and shale is being cut through.

Reid, H., Jr.↗
NASA NTRS1986

The effect of processing conditions on the GaAs/plasma-grown insulator interface

The effect of processing conditions on the interface state density was evaluated from C-V measurements on metal-oxide-semiconductor capacitors. The optimum processing conditions for the minimum surface state density was found to be related to the postoxidation annealing temperature and time, and was independent of chemical treatments prior to oxidation. Annealing at the optimum condition (i.e., at 350 C for 1 h in either nitrogen or hydrogen gas, with or without an aluminum pattern on the oxide) reduces the fast surface state density by about one order of magnitude. By using a nitrogen/oxygen plasma, the static dielectric constant of the oxide decreased as the N/O ratio was increased, and nitrogen was incorporated into the oxide. In addition, the fast surface state density was reduced as a result of this nitridation process.

Hshieh, F. I.↗
NASA NTRS1997

Scattering by Artificial Wind and Rain Roughened Water Surfaces at Oblique Incidences

Rain affects wind retrievals from scatterometric measurements of the sea surface. To depict the additional roughness caused by rain on a wind driven surface, we use a ring-wave spectral model. This enables us to analyse the rain effect on K(u) band scatterometric observations from two laboratory experiments. Calculations based on the small perturbation method provide good simulation of scattering measurements for the rain-only case, whereas for combined wind and rain cases, the boundary perturbation method is appropriate.

Craeye, C.↗
NASA NTRS2004

Absorption Reveals and Hydrogen Addition Explains New Interstellar Aldehydes: Propenal and Propanal

New interstellar molecules propenal (CH2CHCHO) and propanal (CH3CH2CHO) have been detected largely in absorption toward the star-forming region Sagittarius B2(N) by means of rotational transitions observed with the 100-m Green Bank Telescope (GBT) operating in the range of 18 GHz (lambda approximately 1.7 cm) to 26 GHz (lambda approximately 1.2 cm). The GBT was also used to observe the previously reported interstellar aldehyde propynal (HC2CHO) in Sagittarius B2(N) which is known for large molecules believed to form on interstellar grains. The presence of these three interstellar aldehydes toward Sagittarius B2(N) strongly suggests that simple hydrogen addition on interstellar grains accounts for successively larger molecular species: from propynal to propenal and from propenal to propanal. Energy sources within Sagittarius B2(N) likely permit the hydrogen addition reactions on grain surfaces to proceed. This work demonstrates that successive hydrogen addition is probably an important chemistry route in the formation of a number of complex interstellar molecules. We also searched for but did not detect the three-carbon sugar glyceraldehyde (CH2OHCHOHCHO).

Hollis, J. M.↗
DOE OSTI2022

Analysis of Low RRR SRF Cavities

Recent findings in the superconducting radio-frequency (SRF) community have shown that introducing certain impurities into high-purity niobium can improve quality factors and accelerating gradients. Success has been found in nitrogen-doping, diffusion of the native oxide into the niobium surface, and thin films of alternate superconductors atop a niobium bulk cavity. We question why some impurities improve RF performance while others hinder it. The purpose of this study is to characterize the impurity profile of niobium with a low residual resistance ratio (RRR) and correlate these impurities with the RF performance of low RRR cavities so that the mechanism of recent impurity-based improvements can be better understood and improved upon. Additionally, we performed surface treatments, low temperature baking and nitrogen-doping, on low RRR cavities to evaluate how the intentional addition of more impurities to the RF layer affects performance. We have found that low RRR cavities experience low temperature-dependent BCS resistance behavior more prominently than their high RRR counterparts. The results of this study have the potential to unlock a new understanding on SRF materials.

43 PARTICLE ACCELERATORS↗
NASA NTRSDate not supplied

Towards a More Realistic Representation of Surface Albedo in NASA CERES Satellite Products: A Comparison with MOSAiC Field Campaign

Observing the Arctic from space is one of the most challenging tasks in climate science. Uncertainty in the NASA Clouds and the Earth’s Radiant Energy System (CERES)-derived irradiances is larger over sea ice than any other scene type and comes from several sources. The one-year long MOSAiC expedition in the central Arctic provides a rare opportunity to explore uncertainty in CERES-derived radiative fluxes. First, a systematic and statistically robust assessment of surface shortwave and longwave fluxes has been conducted using in-situ measurements from MOSAiC flux stations. The CERES SYN1deg product overestimates the SW_down flux by 11.40 Wm-2 and underestimates the SW_up flux by −15.70 Wm-2 and LW_down fluxes by −13.30 Wm-2 at the surface during summertime. In addition, large differences are found in the LW_up flux (~320 Wm-2) when the surface reaches melting point (~0℃). The large negative bias in upwelling shortwave flux can be attributed to the underestimation of surface albedo (−0.15) in SYN1deg. In addition to direct comparison, a series of perturbation experiments with a radiative transfer model are performed to estimate the contributions to the differences. By correcting both cloud and albedo inputs, the biases in SW_net flux and LW_net flux can be reduced to less than half of the control run biases to +19.90% and −10.53%, respectively. Furthermore, a compensating effect between underestimation of broadband albedo and overestimation of spectral albedo in visible and mid-infrared bands in SYN1deg datasets is found and contributes to the shortwave flux differences. The difference in CERES broadband albedo (~20 Wm 2) contributes to larger uncertainty in SW_up flux than spectral albedo shape (~3 Wm 2). The results of this study inform the future development of CERES products and will ultimately reduce uncertainties in Arctic surface radiation budget derived from satellite measurements.

Yiyi Huang↗
DOE OSTI2019

Quantitative Review of Olivine Carbonation Kinetics: Reactivity Trends, Mechanistic Insights, and Research Frontiers

Magnesium-dominant olivine (Mg2SiO4) has received considerable attention for geologic and ex situ carbon mineralization due to its reaction potential with CO2 and its abundance in mafic and ultramafic rocks. To enable better predictions and optimization of its carbonation rate, here we compile the results of 15 separate studies into an internally consistent kinetic framework. Time-dependent transformation curves were determined, analyzed, and used to calculate temperature-dependent carbonation rate constants from 50-300 °C. The unified results clearly show that olivine carbonation is optimized at 185-200 °C, and indicate a change in the carbonation reaction mechanism above 90 °C. By comparison with related efforts focused solely on olivine dissolution rates, we demonstrate that the kinetics are controlled by growth of magnesium carbonates. Additional outcomes include the identification of important knowledge gaps and research frontiers for carbon mineralization, including those related to unraveling competitive serpentinization reactions, H2O-saturated supercritical CO2 (wet scCO2) reactivity, and the formation and impacts of secondary surface coatings. In addition to supporting the deployment of carbon storage technologies in a climate-responding world, the findings may help improve understanding of how carbonation and serpentinization processes influence critical geochemical cycles.

Miller, Quin RS↗
NASA NTRS1982

Compositional trends in Apollo 16 soils

Data on the bulk chemical composition of the soils collected at and under the surface of the Apollo 16 landing site are synthesized and reviewed, with emphasis placed on the way in which the compositional trends within the soils relate to the site geology. Two distinct compositional mixing trends are discerned. One involves addition to this surface Cayley component of a material such as that ejected by North Ray Crater. The other is thought to be a segment of a mixing line between the average melt fraction of the local Cayley component and pure or nearly pure anorthosite. Grain size fractions of Apollo 16 soils exhibit a general trend of higher concentrations of large ion lithophile (LIL) elements associated with plagioclase in the finest fraction compared with the coarse fractions. The suite of pristine nonmare rocks (as currently recognized) is found to be insufficient to model the Apollo 16 soils.

Korotev, R. L.↗
DOE OSTI2021

Photoelectrochemically Self Improving Si/GaN Photocathode: Figure 4a Raw Data

Calculated formation energy of (0001 ̅) c-plane GaN surfaces. The density-functional theory (DFT) calculations were performed with the generalized gradient approximation, using the plane-wave pseudopotential quantum-ESPRESSO package. Ultrasoft pseudopotentials were used to describe the interaction between valence electrons and ionic cores, where Ga 3d electrons were explicitly treated as valence electrons. The wave functions and electronic density were expanded in a plane-wave basis set truncated at a cutoff energy of 30 Ry and 240 Ry, respectively. The surface was modeled using a repeated slab geometry using a (2×2) unit cell with a thickness of seven GaN bilayers, where the Ga-terminated bottom side was passivated by pseudo-hydrogen with charge of 1.25e. In addition, the (1010) surface was modeled using 8 GaN atomic layers with a lateral dimension of 9.57 Å x 10.38 Å. A vacuum width of at least 15.0 Å was introduced between consecutive slabs, and a k-point mesh of 5x5x1 and 2x2x1 was used to sample the surface Brillouin zone for the polar and non-polar surfaces, respectively. Calculated formation energy of (0001 ̅) c-plane GaN surfaces with different oxygen configuration within the anion and cation-rich limits: ideal GaN surfaces of c-plane and m-plane; configurations with 100% replacement of nitrogen by oxygen on the surface c-plane and m-plane; 100% replacement of nitrogen by oxygen in the subsurface bilayer c-plane and m-plane; and configurations with 50% replacement of nitrogen of the surface and subsurface bilayers by oxygens c-plane and m-plane. In both cases, the ideal surface is chosen as the reference.

photocathode↗
DOE OSTI2021

Photoelectrochemically Self Improving Si/GaN Photocathode: Figure 4b Raw Data

Calculated formation energy of (1010 ̅) m-plane GaN surfaces. The density-functional theory (DFT) calculations were performed with the generalized gradient approximation, using the plane-wave pseudopotential quantum-ESPRESSO package. Ultrasoft pseudopotentials were used to describe the interaction between valence electrons and ionic cores, where Ga 3d electrons were explicitly treated as valence electrons. The wave functions and electronic density were expanded in a plane-wave basis set truncated at a cutoff energy of 30 Ry and 240 Ry, respectively. The surface was modeled using a repeated slab geometry using a (2×2) unit cell with a thickness of seven GaN bilayers, where the Ga-terminated bottom side was passivated by pseudo-hydrogen with charge of 1.25e. In addition, the (1010) surface was modeled using 8 GaN atomic layers with a lateral dimension of 9.57 Å x 10.38 Å. A vacuum width of at least 15.0 Å was introduced between consecutive slabs, and a k-point mesh of 5x5x1 and 2x2x1 was used to sample the surface Brillouin zone for the polar and non-polar surfaces, respectively. Calculated formation energy of (1010 ̅) m-plane GaN surfaces with different oxygen configuration within the anion and cation-rich limits: ideal GaN surfaces of c-plane and m-plane; configurations with 100% replacement of nitrogen by oxygen on the surface c-plane and m-plane; 100% replacement of nitrogen by oxygen in the subsurface bilayer c-plane and m-plane; and configurations with 50% replacement of nitrogen of the surface and subsurface bilayers by oxygens c-plane and m-plane. In both cases, the ideal surface is chosen as the reference.

photocathode↗
NASA NTRS2012

Magnetic Interface for Segmented Mirror Assembly

Newly developed magnetic devices are used to create an interface between adjacent mirror segments so that once assembled, aligned, and phased, the multiple segments will behave functionally equivalent to a monolithic aperture mirror. One embodiment might be a kinematic interface that is reversible so that any number of segments can be pre-assembled, aligned, and phased to facilitate fabrication operations, and then disassembled and reassembled, aligned, and phased in space for operation. The interface mechanism has sufficient stiffness, force, and stability to maintain phasing. The key to producing an interface is the correlated magnetic surface. While conventional magnets are only constrained in one direction -- the direction defined by their point of contact (they are in contact and cannot get any closer) -- correlated magnets can be designed to have constraints in multiple degrees of freedom. Additionally, correlated magnetic surfaces can be designed to have a limited range of action.

Stahl, H.↗
DOE OSTI2022

The Fe 2 O 3 (0001) Surface Under Electroreduction Conditions: A DFT Study of L-Cysteine Adsorption

Local catalyst surface structure and environment can play a significant role towards catalytic activity and selectivity. Surface functionalization using organic additives, such as amino acid chains or peptides, can alter surface properties. Density Functional Theory calculations are used to evaluate the potential dependent surface stability of different terminations of the Fe 2 O 3 (0001) surface. Adsorption of L-Cysteine in different redox states and through different binding modes (carboxylic: O-Fe, amine: N-Fe and thiol: S-Fe) is evaluated. At moderate electrochemical reducing conditions, Fe 2 O 3 (0001) exposes a partially reduced termination with both surface H atoms and undercoordinated Fe atoms in the outermost layer. L-Cysteine adsorption occurs most preferentially through carboxylic acid, O-Fe, binding and does not significantly alter the relative surface stability of different surface terminations. A partially reduced surface with L-Cysteine functionalization will be stable under electroreduction conditions. As a result, stable functionalization of an oxide material through amino acid chains or peptide adsorption may provide an additional design lever to develop improved catalytic systems.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2025

Process intensification approach to enhancing heat and mass transfer: Radio frequency (RF) assisted drying of paper and board

Conventional multi-cylinder drying of paper and board typically relies on both conductive drying from steam-heated cylinders and convective drying, where heated air flows over the paper web surface. Conduction primarily contributes to heat transfer, while convection is the main driver of mass transfer. However, conventional drying systems are heavily dependent on steam, usually powered by fossil fuels, and are often energy-inefficient with high levels of waste. Additionally, these surface-driven processes result in a lower percentage of energy absorption compared to the energy supplied, leading to significant energy losses. To improve this long-standing process, an experimental system was developed to investigate a process intensification approach involving the integration of Radio Frequency (RF) heating, a volumetric electromagnetic technology, alongside traditional conduction and convection drying methods. This study also emphasizes the use of sensors to continuously monitor key parameters such as moisture content, supply system temperatures, sample temperatures, air flows, and drying rates in real-time. The effect of RF as an auxiliary energy source in localized environments at varying moisture levels was explored to optimize industrial drying systems, quantify potential improvements, and provide insights for future studies. Experimental results from trials combining RF with convection and with the base case alternating conduction-convection drying processes are presented. It is shown that RF is a viable process intensification approach for paper drying improving the drying rate and energy intensity at higher moisture contents. These findings offer valuable insights for process intensification and contribute to the process development, modeling, and simulation of advanced paper drying techniques.

42 ENGINEERING↗
DOE OSTI2023

Experimental electronic structure of the electrically switchable antiferromagnet CuMnAs

Tetragonal CuMnAs is a room temperature antiferromagnet with an electrically reorientable Néel vector and a Dirac semimetal candidate. Direct measurements of the electronic structure of single-crystalline thin films of tetragonal CuMnAs using angle-resolved photoemission spectroscopy (ARPES) are reported, including Fermi surfaces (FS) and energy-wavevector dispersions. After correcting for a chemical potential shift of ≈ – 390 meV (hole doping), there is excellent agreement of FS, orbital character of bands, and Fermi velocities between the experiment and density functional theory calculations. In addition, 2×1 surface reconstructions are found in the low energy electron diffraction (LEED) and ARPES. This work underscores the need to control the chemical potential in tetragonal CuMnAs to enable the exploration and exploitation of the Dirac fermions with tunable masses, which are predicted to be above the chemical potential in the present samples.

36 MATERIALS SCIENCE↗