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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 163 records · Page 9
All sourcesNASA NTRSDOE OSTI
NASA NTRS2002

Dynamical Approach Study of Spurious Numerics in Nonlinear Computations

The last two decades have been an era when computation is ahead of analysis and when very large scale practical computations are increasingly used in poorly understood multiscale complex nonlinear physical problems and non-traditional fields. Ensuring a higher level of confidence in the predictability and reliability (PAR) of these numerical simulations could play a major role in furthering the design, understanding, affordability and safety of our next generation air and space transportation systems, and systems for planetary and atmospheric sciences, and in understanding the evolution and origin of life. The need to guarantee PAR becomes acute when computations offer the ONLY way of solving these types of data limited problems. Employing theory from nonlinear dynamical systems, some building blocks to ensure a higher level of confidence in PAR of numerical simulations have been revealed by the author and world expert collaborators in relevant fields. Five building blocks with supporting numerical examples were discussed. The next step is to utilize knowledge gained by including nonlinear dynamics, bifurcation and chaos theories as an integral part of the numerical process. The third step is to design integrated criteria for reliable and accurate algorithms that cater to the different multiscale nonlinear physics. This includes but is not limited to the construction of appropriate adaptive spatial and temporal discretizations that are suitable for the underlying governing equations. In addition, a multiresolution wavelets approach for adaptive numerical dissipation/filter controls for high speed turbulence, acoustics and combustion simulations will be sought. These steps are corner stones for guarding against spurious numerical solutions that are solutions of the discretized counterparts but are not solutions of the underlying governing equations.

Yee, H. C.↗
NASA NTRS1990

Ultra-low-frequency magnetic pulsations in the earth's magnetosphere

Spacecraft observations have shown that geomagnetic pulsations originating in magnetospheric processes, in spite of their small amplitude on the ground, have amplitudes in space relative to the local magnetic field of 5-10 percent and occasionally up to about 50 percent. It is noted that by studying geomagnetic pulsations, a detailed comparison can be made between plasma physics theory and observations that are not possible in laboratory experiments. Also geomagnetic pulsations play a role in magnetospheric dynamics and energy transport, and their study forms an integral part of enhancing the knowledge of the magnetosphere. The importance of spacecraft observations are discussed and attention is given to such topics as waves in the magnetosphere, field-line resonances, the quantitative analysis of a dipole field, plasma instabilities, and energy flow.

Anderson, Brian J.↗
NASA NTRS2010

Loop Shaping Control Design for a Supersonic Propulsion System Model Using Quantitative Feedback Theory (QFT) Specifications and Bounds

This paper covers the propulsion system component modeling and controls development of an integrated mixed compression inlet and turbojet engine that will be used for an overall vehicle Aero-Propulso-Servo-Elastic (APSE) model. Using previously created nonlinear component-level propulsion system models, a linear integrated propulsion system model and loop shaping control design have been developed. The design includes both inlet normal shock position control and jet engine rotor speed control for a potential supersonic commercial transport. A preliminary investigation of the impacts of the aero-elastic effects on the incoming flow field to the propulsion system are discussed, however, the focus here is on developing a methodology for the propulsion controls design that prevents unstart in the inlet and minimizes the thrust oscillation experienced by the vehicle. Quantitative Feedback Theory (QFT) specifications and bounds, and aspects of classical loop shaping are used in the control design process. Model uncertainty is incorporated in the design to address possible error in the system identification mapping of the nonlinear component models into the integrated linear model.

Connolly, Joseph W.↗
DOE OSTI2026

Combination of searches for nonresonant Higgs boson pair production in proton–proton collisions at $\sqrt{s}$ = 13 TeV

This paper presents a combination of searches for the nonresonant production of Higgs boson pairs (HH) in proton–proton collisions at a centre-of-mass energy of 13 TeV. The dataset was collected by the CMS experiment at the LHC from 2016 to 2018 and corresponds to a total integrated luminosity of 138 fb –1 . The observed (expected) upper limit on the inclusive HH production cross-section relative to the standard model (SM) prediction is found to be 3.5 (2.5). Assuming all other Higgs boson couplings are equal to their SM values, the Higgs boson trilinear self-coupling modifier κ λ = λ 3 /λ$^{SM}_{3}$ is constrained in the range –1.35 ≤ κ λ ≤ 6.37 at 95% confidence level (CL). Similarly, for the coupling modifier κ 2V , which governs the interactions between two vector bosons and two Higgs bosons, we have excluded κ 2V = 0 at more than five standard deviations for all values of κ λ . At 95% CL, assuming that the other couplings are equal to their SM values, κ 2V is constrained in the range 0.64 ≤ κ 2V ≤ 1.40. This work also investigates HH production in several new physics scenarios, using the Higgs effective field theory (HEFT) framework. The HEFT framework is further exploited to study various ultraviolet complete models with an extended Higgs sector and set constraints on specific parameters. An extrapolation of the results in the expected integrated luminosity following the high-luminosity upgrade of the LHC is also reported.

BSM↗
NASA NTRS1972

Theoretical prediction of interference loading on aircraft stores. Part 1: Subsonic speeds

A method is developed for theoretically predicting the loading on pylon-mounted stores in subsonic compressible flow. Linear theory is used, without two-dimensional or slender body assumptions, to predict the flow field produced by the aircraft wing, nose, inlet, and pylons. The interference loading is integrated over the store length by considering the local crossflow, its axial and radial derivatives, and buoyancy. Store moment calculations under an F-4 aircraft at Mach 8 are compared to wind tunnel data. The method is computerized, and program user information is included.

Danfernandes, F.↗
NASA NTRS2015

Nonlinear Dynamic Modeling of a Supersonic Commercial Transport Turbo-Machinery Propulsion System for Aero-Propulso-Servo-Elasticity Research

This paper covers the development of an integrated nonlinear dynamic model for a variable cycle turbofan engine, supersonic inlet, and convergent-divergent nozzle that can be integrated with an aeroelastic vehicle model to create an overall Aero-Propulso-Servo-Elastic (APSE) modeling tool. The primary focus of this study is to provide a means to capture relevant thrust dynamics of a full supersonic propulsion system by using relatively simple quasi-one dimensional computational fluid dynamics (CFD) methods that will allow for accurate control algorithm development and capture the key aspects of the thrust to feed into an APSE model. Previously, propulsion system component models have been developed and are used for this study of the fully integrated propulsion system. An overview of the methodology is presented for the modeling of each propulsion component, with a focus on its associated coupling for the overall model. To conduct APSE studies the described dynamic propulsion system model is integrated into a high fidelity CFD model of the full vehicle capable of conducting aero-elastic studies. Dynamic thrust analysis for the quasi-one dimensional dynamic propulsion system model is presented along with an initial three dimensional flow field model of the engine integrated into a supersonic commercial transport.

Control Theory↗
NASA NTRS2021

Boundary-layer Instability Measurements on a Cone at Freestream Mach 3.5

An experimental study was conducted in the NASA (National Aeronautics and Space Administration) Langley Supersonic Low-Disturbance Tunnel to investigate naturally-occurring instabilities in a supersonic boundary layer on a 7◦ half-angle cone at nominal freestream conditions: Mach 3.5, total temperature of 299.8K, and unit Reynolds numbers (millions per m) of 9.89, 13.85, 21.77, and 25.73. Instability measurements were acquired under noisy-flow and quiet-flow conditions. Pitot-pressure and calibrated hot-wire measurements were obtained using a model-integrated traverse system to document the model flow field. In noisy-flow conditions, growth rates and mode shapes achieved good agreement between the measured results and linear stability theory (LST). The corresponding N factor at transition from LST is N ≈ 3.9. Under quiet-flow conditions, the most unstable first-mode instabilities as predicted by LST were measured, but this mode was not the dominant instability measured in the boundary layer. Instead, the dominant instabilities were less-amplified, low-frequency disturbances predicted by LST, and grew according to linear theory. These low-frequency unstable disturbances were initiated by freestream acoustic disturbances through a receptivity process believed to occur near the branch I location of the cone. Under quiet-flow conditions, the boundary layer remained laminar up to the last measurement station for the largest unit Reynolds number, implying a transition N factor of N > 8.5.

Boundary Layer↗
DOE OSTI2026

Radiative corrections to superallowed beta decays at $\mathcal{O}\left({\alpha}^2Z\right)$

We compute $\mathcal{O}\left({\alpha}^2Z\right)$ radiative corrections to superallowed β decays with a heavy-particle effective field theory that systematically describes the interactions of low-energy ultrasoft photons with nuclei. We calculate two-loop virtual and one-loop real-virtual amplitudes by reducing the Feynman integrals to a set of master integrals, which we solve analytically using a variety of techniques. These techniques can be applied to other phenomenologically interesting observables. The ultrasoft corrections can then be combined with contributions arising from the exchange of potential photons to obtain the complete $\mathcal{O}\left({\alpha}^2Z\right)$ correction to the decay rate, with resummation of large logarithms of the electron energy times the nuclear radius. We find that $\mathcal{O}\left({\alpha}^2Z\right)$ ultrasoft loops induce a relative correction to the decay rate that ranges from 0.7 ∙ 10 −3 in the decay of 10 C to 3.6 ∙ 10 −3 in the decay of 54 Co, and will thus impact the extraction of V ud at the permille level. We show that the inclusion of these corrections reduces the residual renormalization scale dependence of the decay rate to a negligible level, making missing ultrasoft perturbative corrections a subdominant source of theoretical uncertainty.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
NASA NTRS1999

Crack Turning and Arrest Mechanisms for Integral Structure

In the course of several years of research efforts to predict crack turning and flapping in aircraft fuselage structures and other problems related to crack turning, the 2nd order maximum tangential stress theory has been identified as the theory most capable of predicting the observed test results. This theory requires knowledge of a material specific characteristic length, and also a computation of the stress intensity factors and the T-stress, or second order term in the asymptotic stress field in the vicinity of the crack tip. A characteristic length, r(sub c), is proposed for ductile materials pertaining to the onset of plastic instability, as opposed to the void spacing theories espoused by previous investigators. For the plane stress case, an approximate estimate of r(sub c), is obtained from the asymptotic field for strain hardening materials given by Hutchinson, Rice and Rosengren (HRR). A previous study using of high order finite element methods to calculate T-stresses by contour integrals resulted in extremely high accuracy values obtained for selected test specimen geometries, and a theoretical error estimation parameter was defined. In the present study, it is shown that a large portion of the error in finite element computations of both K and T are systematic, and can be corrected after the initial solution if the finite element implementation utilizes a similar crack tip discretization scheme for all problems. This scheme is applied for two-dimensional problems to a both a p-version finite element code, showing that sufficiently accurate values of both K(sub I) and T can be obtained with fairly low order elements if correction is used. T-stress correction coefficients are also developed for the singular crack tip rosette utilized in the adaptive mesh finite element code FRANC2D, and shown to reduce the error in the computed T-stress significantly. Stress intensity factor correction was not attempted for FRANC2D because it employs a highly accurate quarter-point scheme to obtain stress intensity factors.

Pettit, Richard↗
DOE OSTI2025

Noncollinear ground states of solids with a source-free exchange correlation functional

In this paper, we expand upon the source-free (SF) exchange correlation (XC) functional developed by Sangeeta Sharma and coworkers to plane-wave density functional theory (DFT) based on the projector augmented wave (PAW) method. This constraint is implemented by the current authors within the VASP source code, using a fast Poisson solver that capitalizes on the parallel three-dimensional fast Fourier transforms (FFTs) implemented in VASP. Using this modified XC functional, we explore the improved convergence behavior that results from applying this constraint to the GGA-PBE+U+J functional. In the process, we compare the noncollinear magnetic ground state computed by each functional and their SF counterpart for a select number of magnetic materials in order to provide a metric for comparing with experimentally determined magnetic orderings. We observe significantly improved agreement with experimentally measured magnetic ground-state structures after applying the source-free constraint. Furthermore, we explore the importance of considering probability current densities in spin-polarized systems, even under no applied field. We analyze the XC torque as well, in order to provide theoretical and computational analyses of the net XC magnetic torque induced by the source-free constraint. Along these lines, we highlight the importance of properly considering the real-space integral of the source-free local magnetic XC field. Our analyses on probability currents, net torque, and constant terms draw additional links to the rich body of previous research on spin-current density functional theory (SCDFT), and pave the way for future extensions and corrections to the SF corrected XC functional.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
NASA NTRS1997

Physics of Rotation Powered Pulsars and Their Nebulae

This letter is my progress report for the Astrophysics Theory grant. The first goal of the research supported by this grant is to produce a time dependent theory of the unsteady relativistic collisionless shock wave terminating the relativistic wind from a pulsar, and compare the predicted surface brightness fluctuations to Hubble Space Telescope observations of the wisps in the Crab Nebula. The second goal is to model the production of electron-positron pairs over the polar caps of rotation powered pulsars, and use the results to predict the heating of the surface due to particle trapping and bombardment of the atmosphere at the base of the polar field lines. We have succeeded in creating a one dimensional hybrid code, in which the electron-positron pairs incident on the shock structure are modeled as a relativistic, adiabatic, ideal MHD fluid, while the heavy ions are treated as particles using a particle-in-cell algorithm. The electromagnetic fields are evaluated from the currents and charge densities in the pairs and the ions, while the particles and the fluid accelerate in response to the computed self-consistent electromagnetic fields. The results are promising, in that the underlying ion cyclotron instability generates finite amplitude, propagating magnetosonic waves in the pairs, whose wavelengths and frequencies, when translated into physical units, are comparable to the observed running waves of brightness observed by HST near the Crab pulsar. The code is undergoing a number of tests, to assure us that this preliminary correspondence is not an artifact. In the coming year, the observational appearance of the models will be computed and compared to the HST observations of the Crab now in hand, and used to predict the HST results which will be obtained the year after next. WE also developed a one dimensional cascade theory for pair creation over pulsars' polar caps. A linear integral equation describing the synchrotron cascade has been derived and solved by iterative techniques, in the case when a high energy electron moving parallel to a star centered dipole magnetic field initiates the cascade through curvature gamma ray emission.

Arons, Jonathan↗
NASA NTRS1974

Subsonic potential aerodynamics for complex configurations - A general theory

A general theory of subsonic potential aerodynamic flow around a lifting body having arbitrary shape and motion is presented. By using the Green function method, an integral representation for the velocity potential is obtained for both supersonic and subsonic flow. Under the small perturbation assumption, the potential at any point in the field depends only upon the values of the potential and its normal derivative on the surface of the body. On the surface of the body, this representation reduces to an integro-differential equation relating the potential and its normal derivative (which is known from the boundary conditions) on the surface. The theory is applied to finite-thickness wings in subsonic steady and oscillatory flows.

Morino, L.↗
DOE OSTI2025

High entropy powering green energy: hydrogen, batteries, electronics, and catalysis

A reformation in energy is underway to replace fossil fuels with renewable sources, driven by the development of new, robust, and multi-functional materials. High-entropy materials (HEMs) have emerged as promising candidates for various green energy applications, having unusual chemistries that give rise to remarkable functionalities. This review examines recent innovations in HEMs, focusing on hydrogen generation/storage, fuel cells, batteries, semiconductors/electronics, and catalysis—where HEMs have demonstrated the ability to outperform state-of-the-art materials. We present new master plots that illustrate the superior performance of HEMs compared to conventional systems for hydrogen generation/storage and heat-to-electricity conversion. We highlight the role of computational methods, such as density functional theory and machine learning, in accelerating the discovery and optimization of HEMs. The review also presents current challenges and proposes future directions for the field. We emphasize the need for continued integration of modeling, data, and experiments to investigate and leverage the underlying mechanisms of the HEMs that are powering progress in sustainable energy.

batteries↗
NASA NTRS2020

GPU Supported Simulation of Transition-edge Sensor Arrays

We present numerical simulations of full transition-edge sensor (TES) arrays utilizing graphical processing units (GPUs). With the support of GPUs, it is possible to perform simulations of large pixel arrays to assist detector development. Comparisons with TES small-signal and noise theory confirm the representativity of the simulated data. In order to demonstrate the capabilities of this approach, we present its implementation in xifusim, a simulator for the X-ray Integral Field Unit, a cryogenic X-ray spectrometer on board the future Athena X-ray observatory.

M Lorenz↗
NASA NTRS2015

Nonlinear Dynamic Modeling of a Supersonic Commercial Transport Turbo-Machinery Propulsion System for Aero-Propulso-Servo-Elasticity Research

This paper covers the development of an integrated nonlinear dynamic model for a variable cycle turbofan engine, supersonic inlet, and convergent-divergent nozzle that can be integrated with an aeroelastic vehicle model to create an overall Aero-Propulso-Servo-Elastic (APSE) modeling tool. The primary focus of this study is to provide a means to capture relevant thrust dynamics of a full supersonic propulsion system by using relatively simple quasi-one dimensional computational fluid dynamics (CFD) methods that will allow for accurate control algorithm development and capture the key aspects of the thrust to feed into an APSE model. Previously, propulsion system component models have been developed and are used for this study of the fully integrated propulsion system. An overview of the methodology is presented for the modeling of each propulsion component, with a focus on its associated coupling for the overall model. To conduct APSE studies the de- scribed dynamic propulsion system model is integrated into a high fidelity CFD model of the full vehicle capable of conducting aero-elastic studies. Dynamic thrust analysis for the quasi-one dimensional dynamic propulsion system model is presented along with an initial three dimensional flow field model of the engine integrated into a supersonic commercial transport.

Propulsion↗
DOE OSTI2024

Test of CP-invariance of the Higgs boson in vector-boson fusion production and in its decay into four leptons

A search for CP violation in the decay kinematics and vector-boson fusion production of the Higgs boson is performed in the H → ZZ * → 4 ℓ ( ℓ = e, μ ) decay channel. The results are based on proton-proton collision data produced at the LHC at a centre-of-mass energy of 13 TeV and recorded by the ATLAS detector from 2015 to 2018, corresponding to an integrated luminosity of 139 fb –1 . Matrix element-based optimal observables are used to constrain CP-odd couplings beyond the Standard Model in the framework of Standard Model effective field theory expressed in the Warsaw and Higgs bases. Differential fiducial cross-section measurements of the optimal observables are also performed, and a new fiducial cross-section measurement for vector-boson-fusion production is provided. All measurements are in agreement with the Standard Model prediction of a CP-even Higgs boson.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2025

Cartesian equivariant representations for learning and understanding molecular orbitals

Qualitative and quantitative orbital properties such as bonding/antibonding character, localization, and orbital energies are critical to how chemists understand reactivity, catalysis, and excited-state behavior. Despite this, representations of orbitals in deep learning models have been very underdeveloped relative to representations of molecular geometries and Hamiltonians. Here, we apply state-of-the-art equivariant deep learning architectures to the task of assigning global labels to orbitals, namely energies characterizations, given the molecular coefficients from Hartree–Fock or density functional theory. The architecture we have developed, the Cartesian Equivariant Orbital Network (CEONET), shows how molecular orbital coefficients are readily featurized as equivariant node features common to all graph-based machine-learned potentials. We find that CEONET performs well at predicting difficult quantitative labels such as the orbital energy and orbital entropy. Furthermore, we find that the CEONET representation provides an intuitive latent space for differentiating orbital character for the qualitative assignment of e.g. bonding or antibonding character. In addition to providing a useful representation for further integrating deep learning with electronic structure theory, we expect CEONET to be useful for automatizing and interpreting the results of advanced electronic structure methods such as complete active space self-consistent field theory. In particular, the ability of CEONET to infer multireference character via the orbital entropy paves the way toward the machine-learned selection of active spaces.

chemical reactions↗
DOE OSTI2025

Gravitational Wave Scattering via the Born Series: Scalar Tidal Matching to 𝒪⁡(𝐺 7 ) and Beyond

We introduce a novel method to compute gravitational wave amplitudes within the framework of effective field theory. By reinterpreting the Feynman diagram expansion as a Born series, our method offers several key advantages. It directly yields partial wave amplitudes, streamlining the matching with black hole perturbation theory. Long-distance gravitational interactions are unambiguously factorized from short-distance tidal effects, including dissipation, which are systematically incorporated via an in-in worldline effective action. Crucially, at every order in perturbation theory, integrals are expressed in terms of harmonic polylogarithms, enabling an end-to-end computation scalable to arbitrary orders. We illustrate the method with new predictions for scalar black hole Love numbers and their renormalization group equations to 𝒪⁡(𝐺 7 ).

effective field theory↗