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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 343 records · Page 19
All sourcesNASA NTRSDOE OSTI
DOE OSTI2022

Methods for carbon dioxide hydrogenation

A method of carbon dioxide hydrogenation comprises introducing gaseous water to a positive electrode of an electrolysis cell comprising the positive electrode, a negative electrode, and a proton-conducting membrane between the positive electrode and the negative electrode. The proton-conducting membrane comprises an electrolyte material having an ionic conductivity greater than or equal to about 10-2 S/cm at one or more temperatures within a range of from about 150° C. to about 650° C. Carbon dioxide is introduced to the negative electrode of the electrolysis cell. A potential difference is applied between the positive electrode and the negative electrode of the electrolysis cell to generate hydrogen ions from the gaseous water that diffuses through the proton-conducting membrane and hydrogenates the carbon dioxide at the negative electrode. A carbon dioxide hydrogenation system is also described.

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

Transport Mechanisms of Hydrogen Gas and Ions in Poly(potassium acrylate) Electrolytes

Poly(potassium acrylate) (PAAK) in high concentration KOH solutions is a promising electrolyte for use in alkaline zinc batteries. Atomistic molecular dynamics simulations are used to investigate the transport mechanisms of hydrogen gas and zincate ions through both KOH solutions and PAAK solutions with comparable concentrations of KOH. Hydrogen molecules do not interact with the ions or the polymer, and simply diffuse through the system. Furthermore, their diffusion constant decreases with both increasing KOH concentration and when in the polymer, due to the increased viscosity of the solution. By contrast, zincate ions form long-lived clusters with the PAAK chains which significantly slow their diffusion.

Batteries↗
NASA NTRS1991

The role of particle diffusion in the lower transition region: Revised interpretation of emission measures

Our energy-balance models of the lower transit ion region were presented in a previous paper (New Models of the Chromosphere and Transition Region). Here we show the influence of particle diffusion on the calculated hydrogen and helium number densities for a given temperature-density model (model C in the preceding paper). We have also solved the statistical equilibrium and radiative transfer equations for a 13-level He I atom (22 radiative transitions) and a 6-level He II ion (15 radiative transitions) together with He III. The resulting He I and He II level-1 number densities and He III density are shown as functions of temperature. Diffusion substantially increases eta(sub HeI) for T greater than 35,000 K and decreases eta(sub HeI) (while increasing eta(sub(HeII)) between 9,000 and 25,000 K. Including the effects of diffusion also increases eta(sub HeIII) for T less than 60,000 K.

Avrett, Eugene H.↗
DOE OSTI2022

Creating Functional Oxynitride–Silicon Interfaces and SrNbO 2 N Thin Films for Photoelectrochemical Applications

Photoelectrochemical performance dependence upon absorption length, carrier diffusion length, and surface area of an oxynitride photoabsorber is investigated. How best to fabricate optical-quality thin films of bandgap-tunable oxynitrides is also discussed. We targeted the stoichiometric compound SrNbO 2 N as an optimal wide-bandgap photoabsorber (1.9 eV) for use with silicon (1.1 eV) in a tandem structure photoelectrochemical cell. Preparation of perovskite oxynitrides at high-temperature as isolated powders is often straightforward, but it is difficult to integrate them as thin films in tandem junction devices with low-temperature materials. Here we develop the first method to prepare optical-quality SrNbO 2 N thin-films of tunable thickness and roughness on single-crystal silicon substrate. This achievement required an interfacial layer of ultra-thin TaN to be used as a barrier to reduce the inter-diffusion of silicon and oxygen during oxynitride syn-thesis. We produced a variety of SrNbO 2 N film thicknesses (20-440 nm) on n + -Si(100) surfaces. Roughness factor (0.14-21) scaled with thickness. The intrinsic photoelectrochemical activity of these devices was evaluated using a low-barrier sacrificial electron donor. Photocurrent density and photovoltage revealed a significant (and non-linear) dependence on film thickness and roughness. Furthermore, absorption length, carrier diffusion length, and surface area were each found to play key roles. Balancing these is required for optimally performing devices.

08 HYDROGEN↗
NASA NTRS1985

Use of low energy hydrogen ion implants in high efficiency crystalline silicon solar cells

This program is a study of the use of low energy hydrogen ion implantation for high efficiency crystalline silicon solar cells. The first quarterly report focuses on two tasks of this program: (1) an examination of the effects of low energy hydrogen implants on surface recombination speed; and (2) an examination of the effects of hydrogen on silicon regrowth and diffusion in silicon. The first part of the project focussed on the measurement of surface properties of hydrogen implanted silicon. Low energy hydrogen ions when bombarded on the silicon surface will create structural damage at the surface, deactivate dopants and introduce recombination centers. At the same time the electrically active centers such as dangling bonds will be passivated by these hydrogen ions. Thus hydrogen is expected to alter properties such as the surface recombination velocity, dopant profiles on the emitter, etc. In this report the surface recombination velocity of a hydrogen emplanted emitter was measured.

Fonash, S. J.↗
NASA NTRS1994

Photoevaporation of disks around massive stars and application to ultracompact H II regions

Young massive stars produce sufficient Lyman continuum photon luminosity Phi(sub i) to significantly affect the structure and evolution of the accretion disks surrounding them. A nearly static, ionized, isothermal 10(exp 4) K atmosphere forms above the neutral disk for disk radii r less than r(sub g) = 10(exp 15) M(sub 1) cm, where M(sub *) = 10 solar mass M(sub 1) is the stellar mass. For r approximately greater than r(sub g) the diffuse field created by hydrogen recombinations to the ground state in the photoionized gas above the disk produces a steady evaporation at the surface of the disk, and this H II gas flows freely out to the ISM (the 'disk wind'). The detailed structure depends on the mass-loss rate dot-M(sub w) of the fast, approximately greater than 1000 km/sec, stellar wind from the massive star. A critical mass-loss rate dot-M(sub cr) is defined such that the ram pressure of the stellar wind equals the thermal pressure of the H II atmosphere at r(sub g). In the weak stellar wind solution, dot-M(sub w) less than dot-M(sub cr), the diffuse photons from the atmosphere above r(sub g) produce a photoevaporative mass-loss rate from the disk at r approximately greater than r(sub g) of order 1 x 10(exp -5)(Phi(sub 49))(exp 1/2)(M(sub 1))(exp 1/2) solar mass/year, where Phi(sub i) = 10(exp 49) Phi(sub 49)/sec. The resulting slow (10 to 50 km/sec) ionized outflow, which persists for approximately greater than 10(exp 5) year for disk masses M(sub d) approximately 0.3 M(sub *), may explain the observational characteri stics of unresolved, ultracompact H II regions. In the strong stellar wind solution, dot-M(sub w) greater than dot-M(sub cr), the ram pressure of the stellar wind blows down the atmosphere for r less than r(sub g) and allows the stellar photons to penetrate to greater radii and smaller heights. A slow, ionized outflow produced mainly by diffuse photons is again created for r less than r(sub g); however, it is now dominated by the flow at r(sub w)(greater than r(sub g)), the radius at which the stellar wind ram pressure equals the thermal pressure in the evaporating flow. The mass-loss rate from the disk is of order 6 x 10(exp -5)dot-M(sub w-6) v(sub w8)(Phi (sub 49))(exp -1/2) solar mass/year, where dot-M(sub w-6) = M(sub w)/10(exp -6) solar mass/year and v(sub w8) = v(sub w)/1000 km/sec is the stellar wind velocity. The resulting outflow, which also persists for approximately greater than 10(exp 5) year may explain many of the more extended (r approximately greater than 10(exp 16) cm) ultracompact H II regions. Both the weak-wind and the strong-wind models depend entirely on stellar parameters Phi(sub i), M(sub *), dot-M(sub w)) and are independent of disk parameters as long as an extended r much greater than (r(sub g)), neutral disk exists. We compare both weak-wind and strong-wind model results to the observed radio free-free spectra and luminosities of ultracompact H II regions and to the interesting source MWC 349.

Hollenbach, David↗
DOE OSTI2022

Effect of Commercial Gas Diffusion Layers on Catalyst Durability of Polymer Electrolyte Fuel Cells in Varied Cathode Gas Environment

Gas diffusion layers (GDLs) play a crucial role in heat transfer and water management of cathode catalyst layers in polymer electrolyte fuel cells (PEFCs). Thermal and water gradients can accelerate electrocatalyst degradation and therefore the selection of GDLs can have a major influence on PEFC durability. Currently, the role of GDLs in electrocatalyst degradation is poorly studied. Here, we perform electrocatalyst accelerated stress test studies on membrane electrode assemblies (MEAs) prepared using three most commonly used GDLs. The effect of GDLs on electrocatalyst degradation is evaluated in both nitrogen (non-reactive) and air (reactive) gas environments at 100% relative humidity. In situ electrochemical characterization and extensive physical characterization is performed to understand the subtle differences in electrocatalyst degradation and correlated to the use of different GDLs. Overall, no difference is observed in the electrocatalyst degradation due to GDLs based on polarization curves at the end of life. But interestingly, MEA with a cracked microporous layer (MPL) in the GDL exhibited a higher electrocatalyst loading loss, which resulted in a lower and more heterogeneous increase in the average electrocatalyst nanoparticle size.

25 ENERGY STORAGE↗
DOE OSTI2024

Hydrogen permeation in iron-chromium-aluminum (FeCrAl) alloys and the effects of microstructure and surface oxide

Iron–chromium–aluminum (FeCrAl) class alloys are candidates for use as cladding for accident-tolerant fuels and moderators. In this context, hydrogen isotope permeation in FeCrAl alloys is an important material property. Here, in the present work, the apparent permeability, effective diffusivity, and apparent solubility of hydrogen in the FeCrAl alloys C26M and Kanthal D (KD) were measured with gas-driven hydrogen permeation. Permeation measurements were conducted at temperatures of 400 to 700 °C and at gas-driven pressures from 1 to 100 kPa. In particular, the effect of grain size on hydrogen transport was studied with KD samples with three different microstructures: nanocrystalline (NC), ultra-fine grained (UFG), and coarse-grained (CG). The UFG and NC specimens had higher apparent activation energies (73.4 kJ mol -1 and 65.2 kJ mol -1 , respectively) for hydrogen permeability than the CG sample (46.9 kJ mol -1 ). An aluminum oxide layer formed on the primary- and secondary-side surfaces of all samples subjected to permeation experiments which demonstrated the propensity of FeCrAl alloys to form these innate oxide permeation barriers.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗
DOE OSTI2023

Ab Initio Simulations of Tritium Diffusion in Al-Rich Iron Aluminide Coating Phases

Surface coatings of steels used in extreme conditions and corrosive environments generally aim to provide protection and increased durability. In the case of tritium-producing burnable absorber rods (TPBARs) used in nuclear reactors, a 316 stainless steel has been coated with Al. Scanning transmission electron microscopy (STEM) characterization of the coating found three Al-rich (>60 atom % Al) iron aluminide alloys identified as hexagonal FeNiAl 5 , monoclinic Fe 4 Al 13 , and orthorhombic Fe 2 Al 5 . Density functional theory simulations using nudged elastic band have been performed to investigate the diffusion of interstitial tritium in each Al-rich iron aluminide phase. While FeNiAl 5 and Fe 4 Al 13 can be viewed as the stacking of two layers, the structural peculiarity of Fe 2 Al 5 is that channels of variable Al vacancy content are present along the c-axis. Therefore, three stoichiometries for Fe 2 Al x phase, namely, Fe 2 Al 4 , Fe 2 Al 5 , and Fe 2 Al 6 , have been considered to evaluate the impact of Al vacancy concentration on tritium diffusion behavior. Altogether, we found that at 600 K, tritium diffusion decreases from a faster rate in the channels of Fe 2 Al x phases (D T ≤ 10 –11 m 2 ·s –1 ) to Fe 4 Al 13 (D T ≈ 10–12 m2·s–1), and finally in FeNiAl5 (D T ≈ 10 –13 m 2 ·s –1 ). Here, we also find that interstitial tritium generally diffuses faster in Fe–Al coating phases than in the tritium breeding material γ-LiAlO 2 (D T ≈ 10 –14 m 2 ·s –1 ) but slightly slower than in 316 stainless steel (D T ≈ 10 –10 m 2 ·s –1 ).

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

FLASH-therapy suitable single-pulse proton generation using TiH 2 under nanosecond laser irradiation

We investigated proton emission from titanium hydride (TiH 2 ) targets irradiated in vacuum by a 6-ns, 1064-nm Nd:YAG laser. Time-of-flight measurements with a Faraday cup and an electrostatic ion analyzer resolved distinct proton peaks at high pulse energies, with yields on the order of 10 9 protons per shot. Systematic scans over pulse energy and up to 1000 repeated shots showed that, while the peak amplitude gradually decreased, the integrated proton number remained nearly constant. This behavior is consistent with surface-induced broadening of the plasma expansion while bulk hydrogen is replenished by diffusion and repeated ablation of fresh TiH 2 layers. Using the measured proton numbers and pulse widths, a simple direct-plasma-injection-style scaling indicates peak currents of ∼100 mA and sub-microsecond pulse durations. The pulse structure and yield satisfy key ultra-high-dose-rate criteria and, together with sustained output over 1000 shots, support TiH 2 -based laser ion sources as practical candidates for FLASH-therapy (ultra-high-dose-rate)-oriented studies and injector development using direct plasma injection.

43 PARTICLE ACCELERATORS↗
DOE OSTI2023

Parametric Study of the Vacuum Permeator for the Tritium Extraction eXperiment

Tritium breeding is a critical component of any self-sustaining future fusion reactor. The liquid metal eutectic, PbLi, is of particular interest as a tritium breeder material due to its favorable thermophysical and neutronic properties. One of the several remaining challenges facing PbLi breeder blankets is the need to design and validate a highly efficient tritium extraction system. The vacuum permeator is a promising extraction concept that utilizes tritium permeation through a highly permeable metal membrane. The Tritium Extraction eXperiment (TEX) is a forced-convection PbLi loop constructed to investigate tritium extraction from PbLi with vacuum permeators. Accurate thermal-hydraulic and tritium transport models are required to establish appropriate test matrices, predict experiment outcomes, and analyze data. However, the hydrogen transport properties of PbLi and permeator materials have large uncertainties. A database is collected, and a parametric analysis is conducted on the effect of hydrogen transport material properties: diffusivity of H in PbLi and permeator, solubility of H in PbLi and permeator, and permeator surface recombination constant on the expected tritium extraction efficiency for a vacuum permeator installed in TEX. As a result, we observe solubility of H in PbLi and the permeator and the recombination constant of the permeator have the largest effect on the extraction efficiency.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2021

Molecular dynamics of the early stages of high-temperature corrosion

In this work, we performed molecular dynamics simulations of the high-temperature oxidation of metal alloys composed of Al, Cr, and Fe and compared their behavior with that of pure Fe. The metal alloy elements (Al and Cr) segregated to the surface during oxidation, producing a lower stress gradient at the metal/environment interface compared to pure Fe. We have found that the lowered stress gradients produced in the alloy material appear to play a key role in the development of corrosion. Interfaces with lower stress gradients have reduced rates of H 2 O adsorption, especially for the ferritic (bcc) alloys. The diffusivity of oxygen and hydrogen drops more rapidly for the interfaces with reduced stress gradients. The stress gradient is also diminished when the gas pressure is increased, indicating that the Fe-Cr-Al alloy system is more resistant to oxidation than pure Fe at higher pressures. Therefore, we conclude that the lower stress gradients at the alloy/environment interface reduce the stress concentration and can slow down the rate of the initial oxide scale growth. We also compared bcc and fcc alloys with pure Fe based on our three evaluation criteria (peak stress, stress gradient, and summation of stress in the oxide scale). We found that the alloys have lower values under the three criteria compared to pure Fe. The bcc alloy has the best score under a water rich environment and the fcc alloy is proven to be better for peak stress and summation of stress in the oxide scale under an oxygen rich environment. For surface segregation to occur, we find that a minimum content of Al or Cr in the near-surface region must be achieved. We also learned that the role of Al is more important than that of Cr in terms of corrosion resistant behavior at relatively higher temperatures for the Fe-Cr-Al ternary alloys.

36 MATERIALS SCIENCE↗
NASA NTRS1976

Soft X-rays from the Large Magellanic Cloud - Implications on the origin of the diffuse X-ray background

A total soft X-ray luminosity of approximately 10 to the 38th power ergs/s was observed from the Large Magellanic Cloud (LMC) during pointed rocket observations in November 1973. Simple spectral parameters are derived and discussed. Upper limits at 1 KeV to several known LMC point sources are presented. A diffuse bar source reported previously was not detected. Strong limits are placed on the fraction of halo and extragalactic diffuse X-ray flux observed in the direction of the LMC due to the lack of correlation of the 0.25-KeV diffuse flux with interstellar hydrogen in the Galaxy and in the LMC.

Long, K. S.↗
NASA NTRS1983

Distribution of forbidden neutral carbon emission in the ring nebula (NGC 6720)

The spatial distribution of forbidden C I 9823, 9850 A emission in NGC 6720 is reported. Like forbidden O I, the forbidden C I radiation appears enhanced in the region of the bright filaments. A few percent of the carbon atoms in the filaments are neutral. The neutral fraction is consistent with ionization equilibrium calculations made under the assumption of complete shielding of direct stellar radiation by hydrogen. The observed carbon lines are excited by photoelectrons produced from hydrogen by the nebular diffuse radiation field. The forbidden C I observations confirm that the filaments in NGC 6720 are regions of locally enhanced shielding.

Jewitt, D. C.↗
NASA NTRS1991

Modeling arcjet space thrusters

The UTSI arcjet model is used to compare the performance of a hydrogen and an ammonia arcjet in the same configuration and at the same electrical power. The predicted specific impulse is 50 percent higher for the hydrogen propellant. Numerical studies made of the effect of transport properties on the performance of a hydrogen arcjet indicate that diffusive transport is very significant even in the supersonic part of the flow, and that relatively small changes in transport properties can have a significant effect on performance. These studies also show that nonequilibrium recombination chemistry can have a large effect on the transport coefficients. This leads to the conclusion that finite rate chemical calculations are necessary if accurate arcjet performance is to be calculated.

Rhodes, Robert↗
NASA NTRS1993

Simulations of Multidimensional Burner-stabilized Flames

Detailed numerical simulations have been performed to study the structure and dynamics of downward propagating burner-stabilized flames in lean hydrogen-air mixtures. These simulations include the effects of fluid convection, detailed hydrogen-oxygen chemistry, multispecies diffusion, thermal conduction, viscosity, and heat losses to the burner. One-dimensional calculations have been carried out to investigate burner boundary conditions. Well known features of a burner-stabilized flame have been reproduced. Two-dimensional calculations show the presence of cellular structures at the burner surface. At low inlet velocities, these cellular structures are suppressed by the increased heat loss to the burner. These simulations have been examined in detail to gain understanding of the similarities and differences in structure and stability of freely propagating and burner-stabilized flames.

Patnaik, G.↗
NASA NTRS1992

On non-local transport processes in the solar atmosphere

We review two mechanisms which can lend a non-local character to energy transport in the solar atmosphere, heat flux propagating in the form of collisionless electrons, and non-equilibrium ionization of hydrogen driven by ambipolar diffusion. Application of these processes to modelling of the lower transition region and upper chromosphere is considered.

Macneice, P.↗