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Results for “hydrogen mass transfer”

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 OSTI2024

Revealing the role of redox reaction selectivity and mass transfer in current–voltage predictions for ensembles of photocatalysts

Photocatalysts are conceptually simple reaction units where nanoscale semiconductors integrated with catalysts drive a pair of redox reactions on illumination. However, the proximity of reaction sites performing cathodic and anodic reactions poses dire challenges to realize large light-to-fuel conversion efficiencies. In this study, a powerful, yet straightforward, equivalent-circuit detail-balance modeling framework is developed and applied to evaluate the performance of photocatalytic systems featuring multiple light absorbers. Specifically, low bandgap iridium-doped strontium titanate is modeled as a Z-scheme photocatalyst to achieve desirable hydrogen evolution and iron-based redox shuttle oxidation reactions. Our model has unique capabilities to simulate competing redox reactions and address mass-transfer limitations. In a significant departure from state-of-the-art circuit models, our study develops tools to perform load-line analyses by incorporating a net electrochemical load curve that includes both desired and competing redox reactions. Consequently, reaction selectivity is predicted from equivalent circuit models for photocatalytic and photoelectrochemical systems. Our investigation into ensembles comprised of multiple, semi-transparent light absorbers reveals their potential to outperform a single, optically thick light absorber, particularly when operated under mass-transfer-limited conditions. However, this outcome hinges on minimizing mass-transfer rates of select redox species to prevent undesired reactions of hydrogen oxidation and/or redox shuttle reduction. Our findings demonstrate that reaction selectivity can be achieved by tuning asymmetry in redox species mass-transfer even with perfectly symmetric electrocatalytic charge-transfer coefficients. The influences of various kinetic, mass-transfer, and thermodynamic parameters are explored to offer crucial insights for synthesis of the next-generation of photocatalysts and selective coatings, and reactor designs.

25 ENERGY STORAGE↗
NASA NTRS1984

A mathematical model for the iron/chromium redox battery

A mathematical model has been developed to describe the isothermal operation of a single anode-separator-cathode unit cell in a redox-flow battery and has been applied to the NASA iron/chromium system. The model, based on porous electrode theory, incorporates redox kinetics, mass transfer, and ohmic effects as well as the parasitic hydrogen reaction which occurs in the chromium electrode. A numerical parameter study was carried out to predict cell performance to aid in the rational design, scale-up, and operation of the flow battery. The calculations demonstrate: (1) an optimum electrode thickness and electrolyte flow rate exist; (2) the amount of hydrogen evolved and, hence, cycle faradaic efficiency, can be affected by cell geometry, flow rate, and charging procedure; (3) countercurrent flow results in enhanced cell performance over cocurrent flow; and (4) elevated temperature operation enhances cell performance.

Fedkiw, P. S.↗
DOE OSTI2026

Impact of Small-Alkane Solvents on Polyolefin Hydrogenolysis over a Ruthenium Catalyst

Selective catalytic hydrogenolysis of polyolefins is a promising route to convert plastic waste into valuable liquid products, such as lubricants, waxes, and surfactants. However, the high viscosity of polymer melts imposes mass transfer limitations on this reaction. Solvents can mitigate these challenges, but their effects on reaction kinetics and product selectivity remain underexplored. Here, we systematically explore the effects of small n-alkanes and cycloalkanes on the hydrogenolysis of polyethylene and polypropylene over a Ru/TiO 2 catalyst. Using kinetic measurements and isotopic labeling, we show that n-octane at high mass fractions alters the mechanism from direct hydrogenation to solvent-mediated hydrogen transfer, reducing the rate of C–C bond cleavage. Longer alkanes further inhibit reactivity due to stronger surface binding. 1,4-Dimethylcyclohexane suppresses methane formation, favoring heavier products, while decalin likely forms surface-bound aromatics that poison the catalyst. Overall, alkane solvents modulate product selectivity and reduce the yield of methane byproduct, allowing for ∼35–40% selectivity to valuable C 20 -C 30 alkane products. This work highlights the complex impact of polymer–alkane mixtures on hydrogenolysis kinetics relevant to the design of commercial-scale plastic waste valorization processes.

Catalysts↗
NASA NTRS1985

Modelling of Laser-Enhanced Chemical Vapor Deposition

Research is directed at development of a detailed model of mass and heat transfer and chemical reaction in the pyrolysis of silane for the growth of thin amorphous silicon substrates incorporating laser heating of the gas phase above the film. The model will be the basis for evaluation of the relative importances of the decomposition of SiH4 in the vapor phase, mass transfer of the intermediate species, e.g., SiH2, and the evolution of hydrogen gas. Plans are also underway for developing a model for homogeneous nucleation of Si in the vapor phase to model the rate limitations observed at high gas-phase temperatures and high partial pressures of silane. Work was concentrated on an almost one-dimensional model for the coupling of the CO2 laser beam for heat transfer of the vapor phase with simple kinetic models for SiH4 decomposition and subsequent absorption of Si vapor on the substrate. Mass transfer in the vapor phase is assumed to be solely by diffusion. The role of convection in the vapor phase caused by the large changes in density in and around the center of the laser beam will be analyzed to evaluate the potential of microgravity experiments for increasing the uniformity of the film and the deposition rate.

Brown, R. A.↗
NASA NTRS1988

Is supernova 1987A a stripped asymptotic-branch giant in a binary system?

It is proposed that the progenitor of supernova 1987A was a previously undetected red star in orbit about a blue supergiant. The progenitor was the remnant of an asymptotic-branch giant that had lost most of its hydrogen-rich envelope to its blue companion by type C mass transfer. A detailed evolutionary model strongly supports the feasibility of this proposition. It is found that the original mass of the supernova precursor was 10-15 solar (unless a large fraction of the mass was ejected from the binary sytem), and its final mass, just before the supernova event, was 3-6 solar. The system remained bound, with a new orbital period of 3-10 yr and an eccentricity of 0.1-0.4. This picture can provide plausible qualitative explanations for several anomalies in the observational properties of this supernova.

Joss, P. C.↗
NASA NTRS1989

COLD-SAT: An orbital cryogenic hydrogen technology experiment

The COLD-SAT spacecraft will perform subcritical liquid hydrogen storage and transfer experiments under low-gravity conditions to provide engineering data for future space transportation missions. Consisting of an experiment module mated to a spacecraft bus, COLD-SAT will be placed in an initial 460 km circular orbit by an Atlas I commercial launch vehicle. After deployment, the three-axis-controlled spacecraft bus will provide electric power, experiment control and data management, communications, and attitude control along with propulsive acceleration levels ranging from 10(-6) to 10(-4)g. These accelerations are an important aspect of some of the experiments, as it is desired to know the effects that low gravity levels might have on the heat and mass transfer processes involved. The experiment module will contain the three liquid hydrogen tanks, valves, pressurization equipment, and instrumentation. At launch all the hydrogen will be in the largest tank, which has helium-purged MLI and is loaded and topped off by the hydrogen tanking system used for the Centaur upper stage of the Atlas. The two smaller tanks will be utilized in orbit for performing some of the experiments. The experiments are grouped into two classes on the basis of their priority, and include six regarded as enabling technology and nine regarded as enhancing technology.

Schuster, J. R.↗
NASA NTRS1989

COLD-SAT - An orbital cryogenic hydrogen technology experiment

The COLD-SAT spacecraft will perform subcritical liquid hydrogen storage and transfer experiments under low-gravity conditions to provide engineering data for future space transportation missions. Consisting of an experiment module mated to a spacecraft bus, COLD-SAT will be placed in an initial 460 km circular orbit by an Atlas I commercial launch vehicle. After deployment, the three-axis-controlled spacecraft bus will provide electric power, experiment control and data management, communications, and attitude control along with propulsive acceleration levels ranging from 10 (-6) to 10(-4) g. These accelerations are an important aspect of some of the experiments, as it is desired to know the effects that low gravity levels might have on the heat and mass transfer processes involved. The experiment module will contain the three liquid hydrogen tanks, valves, pressurization equipment, and instrumentation. At launch all the hydrogen will be in the largest tank, which has helium-purged MLI and is loaded and topped off by the hydrogen tanking system used for the Centaur upper stage of the Atlas. The two smaller tanks will be utilized in orbit for performing some of the experiments. The experiments are grouped into two classes on the basis of their priority, and include six regarded as enabling technology and nine regarded as enhancing technology.

Schuster, J. R.↗
NASA NTRS1986

The evolution of ultrashort period binary systems

A discussion is presented concerning the results of detailed evolutionary calculations in which a very low mass and hydrogen-depleted semiattached binary star containing a collapsed object can reach an exceptionally short orbital period while sustaining a relatively high mass transfer rate. The observed properties of such systems can be understood under the assumption that they contain moderately to severely hydrogen-defficient secondary stars that are neither fully degenerate nor burning He. It is noted that for extremely hydrogen-depleted stars, the assumption of chemical homogeneity becomes untenable. Attention is given to the binary systems 4U 1626-67, 4U 1916-05, and G61-29.

Nelson, L. A.↗
NASA NTRS1971

Hydrogen slush density reference system

A hydrogen slush density reference system was designed for calibration of field-type instruments and/or transfer standards. The device is based on the buoyancy principle of Archimedes. The solids are weighed in a low-mass container so arranged that solids and container are buoyed by triple-point liquid hydrogen during the weighing process. Several types of hydrogen slush density transducers were developed and tested for possible use as transfer standards. The most successful transducers found were those which depend on change in dielectric constant, after which the Clausius-Mossotti function is used to relate dielectric constant and density.

Weitzel, D. H.↗
NASA NTRS1983

On the origin of the 6.1-ms pulsar

A quantitative model is presented to account for the observed features of the binary pulsar PSR1953+53. A lower giant branch star is suggested to have evolved on a nuclear time scale while orbiting a neutron star, with mass transfer to the neutron star commencing when the giant attained its Roche lobe. A radius-core mass relationship was used to examined the processes that occurred after the hydrogen atmosphere was drained off to the neutron star. Tidal dissipation has circularized the orbit of the companion during mass transfer, while the orbit expanded. Accretion torques caused spin-up of the neutron star, which had a magnetic moment of no more than 3 x 10 to the 27th G/cu cm. The drained star became a degenerate dwarf with very faint luminosity, which accounts for no visual companion having been observed to date.

Joss, P. C.↗
NASA NTRSDate not supplied

Validation of a Two-Phase CFD Model for Predicting Tank Self-Pressurization in the Ground-Based K-Site Experiment

A two-phase CFD model for self-pressurization of a cryogenic storage tank partially filled with liquid hydrogen is presented using the Volume-Of-Fluid approach for modeling two-phase flow, as well as interfacial heat, mass and momentum transfer between the liquid and vapor regions. The CFD model is validated against self-pressurization experiment performed using the K-site flightweight hydrogen storage tank at NASA Glenn Research Center 1 . Laminar and turbulent simulations are performed together with conjugate heat transfer analysis. Effects of turbulence, the value of accommodation coefficient used for predicting phase change rates, as well as tank wall geometry are presented and discussed. Predicted tank pressures, fluid and wall temperatures are compared with the experimental data at 49% fill level and two different heat loads for validating this CFD model.

Computational Fluid Dynamics↗
NASA NTRS1973

Determination of hydrogen in milligram quantities of titanium and its alloys

An accurate, versatile, and sensitive method for the determination of hydrogen in milligram-size titanium samples is presented. It involves extraction of hydrogen at 1070 K while a mercury diffusion pump transfers the evolved gases into the inlet of a mass spectrometer. All the evolved gases may then be positively identified and determined. This method can be readily adapted for use with other metals and for the study of the slow evolution of hydrogen. Reduction of interferences due to the evolution of hydrogen by reactions involving vapors such as those of water, acetone, and vacuum grease is discussed.

Otterson, D. A.↗
NASA NTRSDate not supplied

Validation of a Two-Phase CFD Model for Autogenous Pressurization and Expulsion

This paper presents a two-phase computational fluid dynamics (CFD) model for simulating autogenous pressurization and expulsion in a cryogenic liquid hydrogen storage tank, utilizing a volume-of-fluid (VOF) approach combined with the kinetics-based Schrage equation to accurately capture the phase boundary and interfacial heat, mass, and momentum transfer between liquid and vapor phases. The model is validated against experimental data from NASA's K-site tank facility, specifically experimental case 225, which involved pressurization and controlled expulsion of liquid hydrogen. Various turbulence models are evaluated to assess their influence on model accuracy. The CFD simulations successfully replicate key thermodynamic behaviors observed during the experiments, including pressure evolution, temperature profiles, and phase-change dynamics at the vapor-liquid interface. The predicted tank pressures, temperatures, and pressurant requirements agree with experimental data, with pressurant mass predictions within 16\% of observed values. This study highlights the importance of selecting appropriate turbulence models to accurately simulate complex flow and heat transfer phenomena during tank pressurization and expulsion. By enhancing the accuracy and reliability of CFD models for liquid hydrogen under cryogenic conditions, this research contributes to developing efficient cryogenic propellant management strategies for future space missions.

Computational Fluid Dynamics↗
NASA NTRSDate not supplied

Validation of a Two-Phase CFD Model for Predicting Tank Self-Pressurization in the Ground-Based K-Site Experiment

A two-phase CFD model for self-pressurization of a cryogenic storage tank partially filled with liquid hydrogen is presented using the Volume-Of-Fluid approach for representing the phase boundary and the associated interfacial heat, mass and momentum transfer between the liquid and the vapor regions. The CFD model is validated against self-pressurization experiment performed in the K-site flightweight hydrogen storage tank at NASA Glenn Research Center. Laminar and turbulent simulations together with conjugated heat transfer analysis are performed. Effects of turbulence, as well as tank wall conduction are presented and discussed. Predicted tank pressures and fluid temperatures are compared with the experimental data at two different heat loads for validating the CFD model.

phase change↗
NASA NTRSDate not supplied

Validation of a Two-Phase CFD Model for Predicting Tank Self-Pressurization in the Ground-Based K-Site Experiment

A two-phase CFD model for self-pressurization of a cryogenic storage tank partially filled with liquid hydrogen is presented using the Volume-Of-Fluid approach for modeling two-phase flow, as well as interfacial heat, mass and momentum transfer between the liquid and the vapor regions. The CFD model is validated against self-pressurization experiment performed using the K-site flightweight hydrogen storage tank at NASA Glenn Research Center1. Laminar and turbulent simulations are performed together with conjugated heat transfer analysis. Effects of turbulence, the value of accommodation coefficient used for predicting phase change rates, as well as tank wall geometry are presented and discussed. Predicted tank pressures, fluid and wall temperatures are compared with the experimental data at 49% fill level and two different heat loads for validating this CFD model.

Computational Fluid Dynamics↗
NASA NTRS1983

Orbital motion and mass flow in the interacting binary Be star HR 2142

The discovery of an unusual, periodic, two-component shell phase of short duration in the 'classical' Be star HR2142 (HD41335, MWC133) offered convincing evidence that this object is a mass-transfer binary system. A model based solely on the phase-dependent behavior of the hydrogen shell lines in this 80(d).860 binary was developed by Peters and Polidan (1973) and by Peters (1976). The present investigation is concerned with a refinement to the earlier model, taking into account the utilization of an orbital solution obtained from measurements of the wings of the broad photospheric features observed in the rapidly rotating primary. Velocities and equivalent widths from the sharp 'shell' lines, presumably formed in or near the gas stream, provide additional information on the mass flow in the Balmer-line-formation region.

Peters, G. J.↗
NASA NTRSDate not supplied

Validation of a Two-Phase CFD Model for Autogenous Pressurization and Expulsion

This paper presents a two-phase computational fluid dynamics (CFD) model for simulating autogenous pressurization and expulsion in a cryogenic liquid hydrogen storage tank, utilizing a volume-of-fluid (VOF) approach combined with the kinetics-based Schrage equation to accurately capture the phase boundary and interfacial heat, mass, and momentum transfer between vapor and liquid phases. The model is validated against experimental data from NASA's K-site tank facility, specifically experimental case 225, which involved autogenous pressurization and controlled expulsion of liquid hydrogen. Various turbulence models are evaluated to assess their influence on model accuracy. The CFD simulations successfully replicate key thermodynamic behaviors observed during the experiments, including pressure evolution, temperature profiles, and phase-change dynamics at the vapor-liquid interface. The predicted tank pressures and temperatures agree well with experimental data, whereas the pressurant mass predictions are within 16% of observed values. This study emphasizes the importance of selecting appropriate turbulence models to accurately simulate the complex flow and heat transfer phenomena during tank autogenous pressurization and expulsion. By improving the accuracy and reliability of CFD models for these processes, this research contributes to developing efficient cryogenic propellant management strategies for future space missions.

Computational Fluid Dynamics↗