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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 OSTI2025

Microscopic Theory of Pair Density Waves in Spin-Orbit Coupled Kondo Lattice

We demonstrate that the discommensuration between the Fermi surfaces of a conduction sea and an underlying spin liquid provides a natural mechanism for the spontaneous formation of pair density waves. Using a recent formulation of the Kondo lattice model that incorporates a Yao Lee spin liquid proposed by the authors, we demonstrate that doping away from half filling induces finite-momentum electron-Majorana pair condensation, resulting in amplitude-modulated pair density waves (PDWs). Our approach provides a precise, analytically tractable pathway for understanding the spontaneous formation of PDWs in higher dimensions and offers a natural mechanism for PDW formation in the absence of Zeeman splitting.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
NASA NTRS1975

Pressure- and buoyancy-driven thermal convection in a rectangular enclosure

Results are presented for unsteady laminar thermal convection in compressible fluids at various reduced levels of gravity in a rectangular enclosure which is heated on one side and cooled on the opposite side. The results were obtained by solving numerically the equations of conservation for a viscous, compressible, heat-conducting, ideal gas in the presence of a gravitational body force. The formulation differs from the Boussinesq simplification in that the effects of variable density are completely retained. A conservative, explicit, time-dependent, finite-difference technique was used and good agreement was found for the limited cases where direct comparison with previous investigations was possible. The solutions show that the thermally induced motion is acoustic in nature at low levels of gravity and that the unsteady-state rate of heat transfer is thereby greatly enhanced relative to pure conduction. The nonlinear variable density profile skews the streamlines towards the cooler walls but is shown to have little effect on the steady-state isotherms.

Spradley, L. W.↗
NASA NTRS1983

Modeling of Fluctuating Mass Flux in Variable Density Flows

The approach solves for both Reynolds and Favre averaged quantities and calculates the scalar pdf. Turbulent models used to close the governing equations are formulated to account for complex mixing and variable density effects. In addition, turbulent mass diffusivities are not assumed to be in constant proportion to turbulent momentum diffusivities. The governing equations are solved by a combination of finite-difference technique and Monte-Carlo simulation. Some preliminary results on simple variable density shear flows are presented. The differences between these results and those obtained using conventional models are discussed.

So, R. M. C.↗
NASA NTRS1982

Quantiles, parametric-select density estimation, and bi-information parameter estimators

A quantile-based approach to statistical analysis and probability modeling of data is presented which formulates statistical inference problems as functional inference problems in which the parameters to be estimated are density functions. Density estimators can be non-parametric (computed independently of model identified) or parametric-select (approximated by finite parametric models that can provide standard models whose fit can be tested). Exponential models and autoregressive models are approximating densities which can be justified as maximum entropy for respectively the entropy of a probability density and the entropy of a quantile density. Applications of these ideas are outlined to the problems of modeling: (1) univariate data; (2) bivariate data and tests for independence; and (3) two samples and likelihood ratios. It is proposed that bi-information estimation of a density function can be developed by analogy to the problem of identification of regression models.

Parzen, E.↗
NASA NTRS1993

DSMC and continuum analyses of low-density nozzle flow

Two different approaches, the direct-simulation Monte Carlo (DSMC) method based on molecular gas dynamics and a finite-volume approximation of the Navier-Stokes equations, which are based on continuum gas dynamics, are employed in the analysis of a low-density gas flow in a small converging-diverging nozzle. The fluid experiences various kinds of flow regimes including continuum, slip, transition, and free-molecular. Results from the two numerical methods are compared with Rothe's experimental dam, in which density and rotational temperature variations along the centerline and at various locations inside a low density nozzle were measured by the electron-beam fluorescence technique. The continuum approach showed good agreement with the experimental data as far as density is concerned. The results from the DSMC method showed good agreement with the experimental data both in the density and the rotational temperature. It is also shown that the simulation parameters, such as the gas/surface interaction model, the energy exchange model between rotational and translational modes, and the viscosity temperature exponent, have substantial effects on the results of the DSMC method.

Chung, Chan-Hong↗
DOE OSTI2021

Thermal fluctuations and carrier localization induced by dynamic disorder in MAPbI 3 described by first-principles based tight-binding model

Halide perovskites are strongly influenced by large amplitude anharmonic lattice fluctuations at room temperature. We develop a tight binding model for dynamically disordered MAPbI$_3$ based on density functional theory (DFT) calculations to calculate electronic structure for finite temperature crystal structures at the length scale of thermal disorder and carrier localization. The model predicts individual Hamiltonian matrix elements and band structures with high accuracy, owing to the inclusion of additional matrix elements and descriptors for non-Coulombic interactions. We apply this model to electronic structure at length and time scales inaccessible to first principles methods, finding an increase in band gap, carrier mass, and the sub-picosecond fluctuations in these quantities with increasing temperature as well as the onset of carrier localization in large supercells induced by thermal disorder at 300 K. Finally, we identify the length scale $L^*= 5$ nm as the onset of localization in the electronic structure, associated with associated with decreasing band edge fluctuations, increasing carrier mass, and Rashba splitting approaching zero.

36 MATERIALS SCIENCE↗
NASA NTRS1991

Multi-cathode unbalanced magnetron sputtering systems

Ion bombardment of a growing film during deposition is necessary in many instances to ensure a fully dense coating, particularly for hard coatings. Until the recent advent of unbalanced magnetron (UBM) cathodes, reactive sputtering had not been able to achieve the same degree of ion bombardment as other physical vapor deposition processes. The amount of ion bombardment of the substrate depends on the plasma density at the substrate, and in a UBM system the amount of bombardment will depend on the degree of unbalance of the cathode. In multi-cathode systems, the magnetic fields between the cathodes must be linked to confine the fast electrons that collide with the gas atoms. Any break in this linkage results in electrons being lost and a low plasma density. Modeling of the magnetic fields in a UBM cathode using a finite element analysis program has provided great insight into the interaction between the magnetic fields in multi-cathode systems. Large multi-cathode systems will require very strong magnets or many cathodes in order to maintain the magnetic field strength needed to achieve a high plasma density. Electromagnets offer the possibility of independent control of the plasma density. Such a system would be a large-scale version of an ion beam enhanced deposition (IBED) system, but, for the UBM system where the plasma would completely surround the substrate, the acronym IBED might now stand for Ion Blanket Enhanced Deposition.

Sproul, William D.↗
NASA NTRS1983

Ponderomotive force in a warm two-fluid plasma

A general expression for the ponderomotive force of electromagnetic field with slowly varying amplitude in a warm plasma is obtained in the collisionless two-fluid model. Compared to the existing expression obtained for a cold and stationary plasma, this result contains two additional terms for the general case. One of them is involved with the density gradient and the wavenumber derivative of the dielectric tensor of a plasma. Thus, for an inhomogeneous plasma, it accounts for the effects of spatial dispersion, hence of finite temperature of the plasma. The other term is proportional to the time derivative of the density and the frequency derivative of the dielectric tensor, and is nonzero unless the plasma is stationary or nondispersive. Inclusion of these new terms in the ponderomotive force will enable self-consistent analysis of the general behavior of nonlinear waves with finite wavelengths in a warm plasma.

Lee, N. C.↗
NASA NTRS1990

Kinetic equilibria of plasma shear layers

The analysis of plasma beam and shear problems in magnetic fields is usually based on a hydromagnetic fluid model. In a low-density collisionless plasma, however, the kinetic effects of the plasma, such as finite Larmor radius effects, are not yet clearly understood. In this paper, the kinetic equilibria of plasma shears in a uniform and fixed magnetic field, with full ion motion, are discussed by solving the Vlasov equation with a given electric field and drift velocity. In this model, the ion density profile through the plasma shear layer is quite different from the one predicted by a hydromagnetic model. As a result of a complicated ion gyromotion through the shear layer, single- and double-humped ion density profiles are obtained. The dependence on the temperature and the strength of the shear will be discussed. The results show a significant difference between positive and negative shears.

Cai, D.↗
DOE OSTI2021

A Global LIS/OTD Climatology of Lightning Flash Extent Density

Previous lightning climatologies derived from Lightning Imaging Sensor (LIS) and Optical Transient Detector (OTD) total lightning measurements have quantified lightning frequency as a Flash Rate Density (FRD). This approach assumes that lightning flashes can be represented as points and quantifies the frequency of lightning centered in each grid cell. However, lightning has a finite extent that can reach hundreds of kilometers. A new climatology based on Flash Extent Density (FED) is constructed for LIS (including ISS-LIS) and OTD that accounts for the horizontal dimension of lightning. The FED climatology documents the frequency that an observer can expect lightning to be visible overhead—regardless of where the flash began or ended. This new FED climatology confirms and elaborates on the previous global LIS/OTD FRD and Americas-only Geostationary Lightning Mapper (GLM) findings. The FED climatology maintains Lake Maracaibo as the global lightning hotspot with an average of 389 flashes/day but designates Karabre in the Democratic Republic of the Congo as the global thunderstorm duty (percent of the total viewtime where lightning is observed) hotspot at 7.29%. Meanwhile, Kuala Lumpur is the national capital city with the most lightning, and its airport (KUL) is the top major airport affected by lightning (in terms of duty). The FED seasonal cycle and month-to-month changes in the “center of lightning” for the three continental chimney regions are also discussed.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2025

Role of the chiral anomaly in polarized deeply inelastic scattering. III. Wess-Zumino-Witten contributions and chiral Ward identities for finite quark mass

We extend our prior results on the worldline computation of the axial vector-vector-vector (AVV) triangle anomaly in polarized deeply inelastic scattering (DIS) to the finite mass case by computing in addition the pseudoscalar-vector-vector (PVV) triangle graph. For the well-studied QED case, we show explicitly how the off-forward AVV pole exactly cancels an identical PVV pole. We then demonstrate the dramatic difference in QCD due to the chiral condensate, which qualitatively modifies anomalous Ward identities. As in the massless case, the anomaly pole in QCD is canceled by the dynamics of a primordial isosinglet pseudoscalar η ¯ -meson, whose Wess-Zumino-Witten coupling to the topological charge density shifts the pole to the physical η ′ mass, with the finite quark mass contribution differing by O ( 10 % ) from the Witten-Veneziano formula. We obtain a compact analytic expression for the finite mass corrections to Shore and Veneziano’s result that the proton’s net quark helicity Δ Σ ∝ χ QCD ′ | m = 0 ( 0 ) , the forward slope of the topological susceptibility in the chiral limit, and show they are of the order of a few percentages. Our prior prediction that the polarized DIS structure function g 1 is quenched by sphaleronlike topological transitions at small x is unaffected by quark mass effects. Our results illustrate how worldline computations of anomalous processes, in synergy with lattice computations and nonet chiral perturbation theory, can uncover novel nonperturbative features of QCD at the Electron-Ion Collider. Published by the American Physical Society 2025

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
NASA NTRS2006

A Mesh Refinement Study on the Impact Response of a Shuttle Leading-Edge Panel Finite Element Simulation

A study was performed to examine the influence of varying mesh density on an LS-DYNA simulation of a rectangular-shaped foam projectile impacting the space shuttle leading edge Panel 6. The shuttle leading-edge panels are fabricated of reinforced carbon-carbon (RCC) material. During the study, nine cases were executed with all possible combinations of coarse, baseline, and fine meshes of the foam and panel. For each simulation, the same material properties and impact conditions were specified and only the mesh density was varied. In the baseline model, the shell elements representing the RCC panel are approximately 0.2-in. on edge, whereas the foam elements are about 0.5-in. on edge. The element nominal edge-length for the baseline panel was halved to create a fine panel (0.1-in. edge length) mesh and doubled to create a coarse panel (0.4-in. edge length) mesh. In addition, the element nominal edge-length of the baseline foam projectile was halved (0.25-in. edge length) to create a fine foam mesh and doubled (1.0-in. edge length) to create a coarse foam mesh. The initial impact velocity of the foam was 775 ft/s. The simulations were executed in LS-DYNA for 6 ms of simulation time. Contour plots of resultant panel displacement and effective stress in the foam were compared at four discrete time intervals. Also, time-history responses of internal and kinetic energy of the panel, kinetic and hourglass energy of the foam, and resultant contact force were plotted to determine the influence of mesh density.

Fasanella, Edwin L.↗
DOE OSTI2023

Topological band gap in intercalated epitaxial graphene

The study of functional manipulation of graphene is a critical subject, both for fundamental research and practical applications. In this study, we present that the intercalation of 5d transition metals into epitaxial graphene on SiC is a promising strategy for the realization of topologically nontrivial phases with a finite band gap in graphene. Employing first-principles calculations, grounded in density functional theory, we demonstrate that Re- and Ta-intercalated graphene evolve into two-dimensional topological insulators. These exhibit linear Dirac cones and quadratic bands with topological band gaps, respectively. The emergence of these topological states is attributed to the strong spin–orbit coupling strength of the intercalants. We show that the corresponding topological edge states persist within the finite bulk band gap, aligning with the bulk-boundary correspondence. Furthermore, we explore the spin splitting of the band structure, brought about by the inversion symmetry breaking and the spin–orbit coupling. Finally, our study underscores that the intercalation of graphene is an effective and a feasible approach for manipulating the band gap and the topological nature of graphene. Such intercalated graphene systems hold potential utility for spintronics and low-dimensional quantum device applications.

36 MATERIALS SCIENCE↗
NASA NTRS1974

The collisional drift mode in a partially ionized plasma

The structure of the drift instability was examined in several density regimes. Let sub e be the total electron mean free path, k sub z the wave-vector component along the magnetic field, and the ratio of perpendicular ion diffusion to parallel electron streaming rates. At low densities (k sub z lambda 1) the drift mode is isothermal and should be treated kineticly. In the finite heat conduction regime square root of m/M k sub z Lambda sub 1) the drift instability threshold is reduced at low densities and increased at high densities as compared to the isothermal threshold. Finally, in the energy transfer limit (k sub z kambda sub e square root of m/M) the drift instability behaves adiabatically in a fully ionized plasma and isothermally in a partially ionized plasma for an ion-neutral to Coulomb collision frequency ratio.

Hudson, M. K.↗
DOE OSTI2021

Topological Doping and Superconductivity in Cuprates: An Experimental Perspective

Hole doping into a correlated antiferromagnet leads to topological stripe correlations, involving charge stripes that separate antiferromagnetic spin stripes of opposite phases. The topological spin stripe order causes the spin degrees of freedom within the charge stripes to feel a geometric frustration with their environment. In the case of cuprates, where the charge stripes have the character of a hole-doped two-leg spin ladder, with corresponding pairing correlations, anti-phase Josephson coupling across the spin stripes can lead to a pair-density-wave order in which the broken translation symmetry of the superconducting wave function is accommodated by pairs with finite momentum. This scenario is now experimentally verified by recently reported measurements on La2−xBaxCuO4 with x=1/8. While pair-density-wave order is not common as a cuprate ground state, it provides a basis for understanding the uniform d-wave order that is more typical in superconducting cuprates.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
NASA NTRS1994

Milestone 5 test report. Task 5, subtask 5.2: Tile to foam strength tests

This report summarizes work that has been performed to date on the strength of a cryotank insulation system using Rohacell foam and TUFI-coated AETB-12 ceramic tiles directly bonded to a simulated graphite-epoxy tank wall. Testing utilized a custom specimen design which consists of a long tensile specimen with eccentric loading to induce curvature similar to the curvature expected due to 'pillowing' of the tank when pressurized. A finite element model was constructed to predict the specific element strains in the test article, and to assist with design of the test specimen to meet the specific goals of curvature and laminate strain. The results indicate that the heat treated 3.25-pcf density Rohacell foam does not provide sufficient strength for the induced stresses due to curvature and stress concentration at the RTV bondline to the TUFI tile. The test was repeated using higher density non-heat treated Rohacell foam (6.9 pcf) without foam failure. The finite element model was shown to predict specimen behavior, and validation of the model was successful. It is pertinent to mention that the analyses described herein accurately predicted the failure of the heat treated foams and based on this analysis method it is expected that the untreated 3.25 pcf Rohacell foam will be successful.

Greenberg, H. S.↗
DOE OSTI2025

Charges on a suspended silicon nitride membrane under a high-energy electron beam

Thin silicon nitride (SiN x ) membranes are widely used in gas and liquid phase transmission electron microscopy (TEM) and as phase plates to enhance imaging contrast. SiN x contains trap sites for both positive and negative charges, which can be manipulated by high-energy electron irradiation, external potential biasing, or light exposure. Charge accumulation on the membrane can significantly affect in situ TEM processes, including chemical and electrochemical reactions, nanoparticle dynamics, and catalytic activity, or introduce unwanted phase shifts when used as a phase plate. Here, in this study, charge accumulation on suspended SiN x membranes was investigated using off-axis electron holography combined with model-free charge analysis, supported by custom finite element analysis (FEA) simulations. An average residual positive charge density of approximately 2.8 × 10 −4 C m −2 was measured. Localized and stable regions of both positive and negative charges were identified on the membrane. The global positive and localized positive/negative charges give rise to strong electric fields and electroosmotic slip velocities at the membrane surface, which are sufficient to induce non-Brownian particle behavior and directional fluid flow, offering a physical explanation for previously observed anomalies in particle dynamics, nucleation, and growth during gas and liquid phase TEM experiments. These results provide a benchmark for understanding charge behavior at SiNx interfaces in gas and liquid phase TEM. Furthermore, the FEA simulations establish a framework for future investigations into charge distribution, electrostatic potentials, and electrical double layers at solid–liquid interfaces, particularly in complex geometries and chemically dynamic environments.

Suspended silicon↗
DOE OSTI2021

Dynamic and weak electric double layers in ultrathin nanopores

The unique properties of aqueous electrolytes in ultrathin nanopores have drawn a great deal of attention in a variety of applications, such as power generation, water desalination, and disease diagnosis. Inside the nanopore, at the interface, properties of ions differ from those predicted by the classical ionic layering models (e.g., Gouy–Chapman electric double layer) when the thickness of the nanopore approaches the size of a single atom (e.g., nanopores in a single-layer graphene membrane). Here, using extensive molecular dynamics simulations, the structure and dynamics of aqueous ions inside nanopores are studied for different thicknesses, diameters, and surface charge densities of carbon-based nanopores [ultrathin graphene and finite-thickness carbon nanotubes (CNTs)]. The ion concentration and diffusion coefficient in ultrathin nanopores show no indication of the formation of a Stern layer (an immobile counter-ionic layer) as the counter-ions and nanopore atoms are weakly correlated in time compared to the strong correlation observed in thick nanopores. The weak correlation observed in ultrathin nanopores is indicative of a weak adsorption of counter-ions onto the surface compared to that of thick pores. The vanishing counter-ion adsorption (ion–wall correlation) in ultrathin nanopores leads to several orders of magnitude shorter ionic residence times (picoseconds) compared to the residence times in thick CNTs (seconds). The results of this study will help better understand the structure and dynamics of aqueous ions in ultrathin nanopores.

2D materials↗