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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 37 records · Page 2
All sourcesNASA NTRSDOE OSTI
DOE OSTI2026

Analytical models of hydrogen transport in graphite

The importance of graphite-hydrogen chemical reactions to fusion, fission, and hydrogen storage applications, combined with the rapidly evolving knowledge on the underlying mechanisms, has led to the development of multiple models to describe hydrogen transport in graphite. Significant differences exist among these models, resulting from discrepancies in the modeling assumptions, intended degree of fidelity, and conditions of applicability. This paper attempts at reconciling these apparent differences by providing a comprehensive description of the constitutive equations governing hydrogen transport in graphite at high-temperature, identifying outstanding gaps in knowledge, illustrating how these different models approach them, and proposing alternative analytical formulations grounded on experimental results from hydrogen-graphite studies. Governing equations, closing relations, and simplifying assumptions are discussed for hydrogen transport at the inter-granular and intra-granular level, accompanied by compiled experimental data and illustrated energy diagrams associated to the proposed transport mechanisms. Analytical formulations are provided to reproduce competing hypotheses on the mechanisms, supporting the development of a range of computational models that can enable resolution of outstanding knowledge gaps through comparative testing against experimental data.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗
DOE OSTI2025

SAM Enhancements for Air-Ingress Event Modeling in HTGRs

The SAM code is under development and supported by DOE-NE’s Nuclear Energy Advanced Modeling and Simulation program as a modern system-level modeling and simulation tool for advanced non-light water reactor safety analyses. These advanced reactor concepts incorporate novel and improved approaches to achieve safety and economic feasibility. This report summarizes recent efforts and progress in addressing the code capability gaps in SAM for the modeling of the air-ingress phenomenon in High-Temperature Gas-Cooled Reactors (HTGRs). The capability enhancements implemented to the code include: a multi-component flow model to capture the air-helium mixture during air ingress, a 0-D graphite oxidation model to capture the reaction of graphite with oxygen in the air, and an isentropic critical flow model to more accurately predict the de-pressurization of the reactor system due to a small break in the primary loop. Verification cases and demonstrations are provided to showcase these capabilities in SAM. Existing gaps in the code’s capability are also identified.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗
NASA NTRS1983

Stiffness Properties for Dynamic Modeling of Composite Graphite-Epoxy Cylindrical Orthotropic Shells

Traditional composite lamination theory was used to predict composite graphite-epoxy laminate stiffnesses for comparison to quasi-experimental stiffnesses developed from cylindrical bottle pressure testing. Stiffness sensitivities were examined for variations in constituent materials and geometric properties. The material component interactions examined were the fiber longitudinal and transverse Young's modulus, the fiber shear modulus and primary Poisson's ratio, the resin Young's modulus, shear modulus, and Poisson's ratio. The geometric variation of the helical winding angle was also examined. Two computer programs were written to generate the data used to demonstrate the stiffness variations.

Tolbert, R. N.↗
NASA NTRS2019

Status of NASA Research on Projectile Shape Effects-Impact Simulations

Numerical evaluation of a Whipple shield has yielded a ballistic model for cylindrical projectiles. A numerical model of a Whipple shield covered with a thermal-blanket that is representative of operational shields has been developed using CTH: The shield model has been evaluated against existing test data; The projectile model has been developed from preexisting models for graphite-epoxy materials. The model has been used to identify projectile characteristics at the ballistic limit for spherical and cylindrical projectiles; Considered normal impacts of the shield at 7 kilometers per second; Varied the angle between the axis-of-symmetry and velocity vector; Varied the length to the diameter ratio over a broad range. The results have been consolidated into a generalized model that can be adapted to existing spherical models

Miller, J.↗
NASA NTRS1989

Scaling effects in the impact response of graphite-epoxy composite beams

In support of crashworthiness studies on composite airframes and substructure, an experimental and analytical study was conducted to characterize size effects in the large deflection response of scale model graphite-epoxy beams subjected to impact. Scale model beams of 1/2, 2/3, 3/4, 5/6, and full scale were constructed of four different laminate stacking sequences including unidirectional, angle ply, cross ply, and quasi-isotropic. The beam specimens were subjected to eccentric axial impact loads which were scaled to provide homologous beam responses. Comparisons of the load and strain time histories between the scale model beams and the prototype should verify the scale law and demonstrate the use of scale model testing for determining impact behavior of composite structures. The nonlinear structural analysis finite element program DYCAST (DYnamic Crash Analysis of STructures) was used to model the beam response. DYCAST analysis predictions of beam strain response are compared to experimental data and the results are presented.

Jackson, Karen E.↗
DOE OSTI2025

Modelling the brittle failure of graphite induced by the controlled impact of runaway electrons in DIII-D

The thermo-mechanical response of an ATJ graphite sample to controlled runaway electron (RE) dissipation, realized in DIII-D, is modelled with a novel work-flow that features the RE orbit code KORC, the Monte Carlo particle transport code Geant4 and the finite element multiphysics software COMSOL. KORC provides the RE striking positions and momenta, Geant4 calculates the volumetric energy deposition and COMSOL simulates the thermoelastic response. Brittle failure is predicted according to the maximum normal stress criterion, which is suitable for ATJ graphite owing to its linear elastic behavior up to fracture and its isotropic mechanical properties. Measurements of the conducted energy, damage topology, explosion timing and blown-off material volume, impose a number of empirical constraints that suffice to distinguish between different RE impact scenarios and to identify RE parameters which provide the best match to the observations.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
NASA NTRS1993

Structural dynamic testing of composite propfan blades for a cruise missile wind tunnel model

The Naval Weapons Center at China Lake, California is currently evaluating a counter rotating propfan system as a means of propulsion for the next generation of cruise missiles. The details and results of a structural dynamic test program are presented for scale model graphite-epoxy composite propfan blades. These blades are intended for use on a cruise missile wind tunnel model. Both dynamic characteristics and strain operating limits of the blades are presented. Complications associated with high strain level fatigue testing methods are also discussed.

Elgin, Stephen D.↗
DOE OSTI2024

Correlated topological flat bands in rhombohedral graphite

Flat bands and nontrivial topological physics are two important topics of condensed matter physics. With a unique stacking configuration analogous to the Su–Schrieffer–Heeger model, rhombohedral graphite (RG) is a potential candidate for realizing both flat bands and nontrivial topological physics. Here, in this study, we report experimental evidence of topological flat bands (TFBs) on the surface of bulk RG, which are topologically protected by bulk helical Dirac nodal lines via the bulk-boundary correspondence. Moreover, upon in situ electron doping, the surface TFBs show a splitting with exotic doping evolution, with an order-of-magnitude increase in the bandwidth of the lower split band, and pinning of the upper band near the Fermi level. These experimental observations together with Hartree–Fock calculations suggest that correlation effects are important in this system. Our results demonstrate RG as a platform for investigating the rich interplay between nontrivial band topology, correlation effects, and interaction-driven symmetry-broken states.

36 MATERIALS SCIENCE↗
DOE OSTI2024

Proton-Coupled Electron Transfer Mechanisms for CO 2 Reduction to Methanol Catalyzed by Surface-Immobilized Cobalt Phthalocyanine

Immobilized cobalt phthalocyanine (CoPc) is a highly promising architecture for the six-proton, six-electron reduction of CO 2 to methanol. This electroreduction process relies on proton-coupled electron transfer (PCET) reactions that can occur by sequential or concerted mechanisms. Immobilization on a conductive support such as carbon nanotubes or graphitic flakes can fundamentally alter the PCET mechanisms. We use density functional theory (DFT) calculations of CoPc adsorbed on an explicit graphitic surface model to investigate intermediates in the electroreduction of CO 2 to methanol. Our calculations show that the alignment of the CoPc and graphitic electronic states influences the reductive chemistry. These calculations also distinguish between charging the graphitic surface and reducing the CoPc and adsorbed intermediates as electrons are added to the system. This analysis allows us to identify the chemical transformations that are likely to be concerted PCET, defined for these systems as the mechanism in which protonation of a CO 2 reduction intermediate is accompanied by electron abstraction from the graphitic surface to the adsorbate without thermodynamically stable intermediates. Furthermore, this work establishes a mechanistic pathway for methanol production that is consistent with experimental observations and provides fundamental insight into how immobilization of the CoPc impacts its CO 2 reduction chemistry.

Adsorption↗
NASA NTRS1992

The anomalous extinction curve in the direction of Rho Ophiuchi from 950 to 1180 A

We report the interstellar extinction from 950 to 1180 A in the direction of Rho Oph. These data were obtained with a moderate-resolution sounding rocket observation of Ro Oph, and two lightly reddened B stars of identical spectral type. Unlike Voyager observations in this wavelength region, our spectral resolution is sufficient to directly measure the contribution of molecular hydrogen along the line of sight and unambiguously identify the dust contribution. The derived curves compare favorably with the extrapolation of functional fits to the Rho Oph derived from longer wavelengths. In addition, we have fitted a model of dust extinction to the derived curve and find that the best fits indicate that the line of sight exhibits a larger than average grain size and a preferential concentration of graphite relative to silicates. The sharp rise seen at the shortest wavelengths (below 1000 A) cannot be explained by standard silicate-graphite dust models and may be indicative of a nonstandard grain shape or a missing component in the extinction models.

Green, James C.↗
NASA NTRS2003

Finite-Rate Ablation Boundary Conditions for Carbon-Phenolic Heat-Shield

A formulation of finite-rate ablation surface boundary conditions, including oxidation, nitridation, and sublimation of carbonaceous material with pyrolysis gas injection, has been developed based on surface species mass conservation. These surface boundary conditions are discretized and integrated with a Navier-Stokes solver. This numerical procedure can predict aerothermal heating, chemical species concentration, and carbonaceous material ablation rate over the heatshield surface of re-entry space vehicles. In this study, the gas-gas and gas-surface interactions are established for air flow over a carbon-phenolic heatshield. Two finite-rate gas-surface interaction models are considered in the present study. The first model is based on the work of Park, and the second model includes the kinetics suggested by Zhluktov and Abe. Nineteen gas phase chemical reactions and four gas-surface interactions are considered in the present model. There is a total of fourteen gas phase chemical species, including five species for air and nine species for ablation products. Three test cases are studied in this paper. The first case is a graphite test model in the arc-jet stream; the second is a light weight Phenolic Impregnated Carbon Ablator at the Stardust re-entry peak heating conditions, and the third is a fully dense carbon-phenolic heatshield at the peak heating point of a proposed Mars Sample Return Earth Entry Vehicle. Predictions based on both finite-rate gas- surface interaction models are compared with those obtained using B' tables, which were created based on the chemical equilibrium assumption. Stagnation point convective heat fluxes predicted using Park's finite-rate model are far below those obtained from chemical equilibrium B' tables and Zhluktov's model. Recession predictions from Zhluktov's model are generally lower than those obtained from Park's model and chemical equilibrium B' tables. The effect of species mass diffusion on predicted ablation rate is also examined.

Chen, Y.-K.↗
NASA NTRS2002

Graphite Ablation and Thermal Response Simulation Under Arc-Jet Flow Conditions

The Two-dimensional Implicit Thermal Response and Ablation program, TITAN, was developed and integrated with a Navier-Stokes solver, GIANTS, for multidimensional ablation and shape change simulation of thermal protection systems in hypersonic flow environments. The governing equations in both codes are demoralized using the same finite-volume approximation with a general body-fitted coordinate system. Time-dependent solutions are achieved by an implicit time marching technique using Gauess-Siedel line relaxation with alternating sweeps. As the first part of a code validation study, this paper compares TITAN-GIANTS predictions with thermal response and recession data obtained from arc-jet tests recently conducted in the Interaction Heating Facility (IHF) at NASA Ames Research Center. The test models are graphite sphere-cones. Graphite was selected as a test material to minimize the uncertainties from material properties. Recession and thermal response data were obtained from two separate arc-jet test series. The first series was at a heat flux where graphite ablation is mainly due to sublimation, and the second series was at a relatively low heat flux where recession is the result of diffusion-controlled oxidation. Ablation and thermal response solutions for both sets of conditions, as calculated by TITAN-GIANTS, are presented and discussed in detail. Predicted shape change and temperature histories generally agree well with the data obtained from the arc-jet tests.

Chen, Y.-K.↗
NASA NTRS1992

Interstellar dust from the Milky Way to the Magellanic Clouds

Interstellar dust in the Magellanic Clouds, with a weak or nearly absent 2175 A extinction feature, may be of interest in studies of galaxies in early stages of chemical evolution. To this inquiry, we extend the graphite-silicate grain model, introduced by Mathis, Rumpl, and Nordsieck and developed by Draine and Lee (1984) from the Milky Way to the Magellanic Clouds. We find that the empirical extinction curves in the Large and Small Magellanic Clouds can be reproduced by adjusting only the relative abundances of graphite and silicate grains, while leaving all other model properties fixed to those appropriate for the Galactic extinction curve. Using the graphite-silicate models, we calculate the absorption and scattering optical depths, the mass-density ratio of interstellar dust to neutral hydrogen, and the Kramers-Kronig relation for all three galaxies. We also present a fitting function for the three extinction curves, valid not only over the observed range of wavelengths but also over the full range as predicted by the models. All the quantities we derived here are independent of the dust-to-gas ratios in the Milky Way and the Magellanic Clouds, and can be applied to other galaxies if they contain Galactic or Magellanic-type dust.

Pei, Yichuan C.↗