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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 361 records · Page 20
All sourcesNASA NTRSDOE OSTI
DOE OSTI2024

Modeling of the metal–insulator transition temperature in alio-valently doped VO 2 through symbolic regression

The correlated semiconductor vanadium dioxide (VO 2 ) exhibits an insulator–metal transition (IMT) near room temperature, which is of interest in various device applications. Precise IMT temperature control is crucial to determine the use cases across technologies such as thermochromic windows, actuators for robots or neuronal oscillators. Doping the cation or anion sites can modulate the IMT by several tens of degrees and control hysteresis. However, modeling the effects of control parameters (e.g., doping concentration, type of dopants) is challenging due to complex experimental procedures and limited data, hindering the use of traditional data-driven machine learning approaches. Symbolic regression (SR) can bridge this gap by identifying nonlinear expressions connecting key input parameters to target properties, even with small data sets. In this work, we develop SR models to capture the IMT trends in VO 2 influenced by different dopant parameters. Using experimental data from the literature, our study reveals a dual nature of the IMT temperature with varying tungsten (W) doping concentrations. The symbolic model captures data trends and accounts for experimental variability, providing a complementary approach to first-principles calculations. Our feature-driven analysis across a broader class of dopants informs selectivity and provides qualitative insights into tuning phase transition properties valuable for neuromorphic computing and thermochromic windows.

36 MATERIALS SCIENCE↗
DOE OSTI2025

LASSO for CALPHAD Model Selection Enables Data-Efficient Thermodynamic Modeling: An Application in Thermochemical Hydrogen Production Materials

Phenomenological CALPHAD (CALculation of PHAse Diagrams) models, widely used for multicomponent materials, often contain a considerable number of parameters and require fitting using data from a relatively small number of experimental measurements or theoretical calculations. Sometimes these parameters are introduced for the purpose of improving model fits but without clear physical justification, which leads to overparametrized models with poor generalization performance. Automated approaches for optimal model selection based on the available data therefore become critical. Here, in this work, a least absolute shrinkage and selection operator (LASSO)-based approach is developed for model selection by leveraging the linearity of the CALPHAD model with respect to its parameters to convert the model selection and fitting to a LASSO minimization problem. We demonstrate its utility for thermodynamic modeling of thermochemical hydrogen (TCH) production materials using lanthanum strontium manganite (LSM) as an example. Various TCH-relevant properties, including oxygen stoichiometry as a function of oxygen partial pressure, enthalpy of reduction, and entropy of reduction, are successfully predicted with reasonable accuracy using a minimal set of model parameters. Importantly, the model selection and fitting involve minimal human decision; it can therefore be applied to high-throughput DFT defect calculations and yield efficient workflows for TCH material modeling and optimization.

CALPHAD↗
NASA NTRS2000

Currents and Flows in Distant Magnetospheres

Space scientists have explored, described, and explained the terrestrial magnetosphere for four decades. Rarely do they point out that the planetary and solar wind parameters controlling the size, shape, and activity of Earth's magnetosphere map out only a small portion of the space of dimensionless parameters that govern magnetospheric properties. With the discovery of Ganymede's magnetosphere, the range of parameters relevant to magnetospheric studies has grown by orders of magnitude. Consider the extremes of Ganymede's and Jupiter's magnetospheres. Jupiter's magnetosphere forms within a plasma flowing at super-Alfvenic speed, whereas Ganymede's forms in a sub-Alfvenic flow. The scale sizes of these magnetospheres, characterized by distances to the magnetopause of order 7x10(exp 6) km and 5x10(exp 3) km, respectively, differ by three orders of magnitude, ranging from 100 to 0.1 times the scale of Earth's magnetosphere. The current systems that control the structure and dynamics of a magnetosphere depend on specific plasma and field properties. Magnetopause currents at Ganymede differ greatly from the forms familiar for Earth and Jupiter, principally because the Mach number of the ambient plasma flow greatly influences the shape of the magnetosphere. A magnetodisk current, present at Jupiter because of its rapid rotation, is absent at Earth and Ganymede. The ring current, extensively investigated at Earth, is probably unimportant at Ganymede because the dynamical variations of the external flow are slow. The ring current is subsumed within the magnetodisk current at Jupiter. This paper describes and contrasts aspects of these and other current systems for the three bodies.

Kivelson, Margaret Galland↗
NASA NTRSDate not supplied

Version 8 of the SMAP Level-4 Soil Moisture Data Assimilation Product

The NASA Soil Moisture Active Passive (SMAP) mission Level-4 Soil Moisture (L4_SM) product provides global, 9-km resolution, 3-hourly surface (0-5 cm) and root-zone (0-100 cm) soil moisture from April 2015 to present with a mean latency of 2.5 days from the time of observation. The product is based on the assimilation of SMAP L-band (1.4 GHz) brightness temperature (Tb) observations into the NASA Catchment land surface model as the model is driven with observations-based precipitation forcing. This presentation discusses the improvements in the forthcoming Version 8 of L4_SM, including updates in the precipitation forcing, the Catchment model parameters, and the L-band microwave radiative transfer model (mwRTM). The precipitation observations used in L4_SM Version 8 outside of North America and the high latitudes are from the latest (Version 7) NASA Integrated Multi-satellitE Retrievals for the Global Precipitation Measurement mission (IMERG) products. Moreover, occasionally excessive precipitation rates in earlier versions of L4_SM along certain longitudes in North America were eliminated by a bug fix in the precipitation corrections algorithm. The Catchment model in L4_SM Version 8 uses climatological snow albedo values based on observations from the Moderate Resolution Imaging Spectroradiometer, replacing the look-up table parameterization of earlier versions. Additionally, corrected soil parameters were implemented for a small region in Argentina that had erroneously been classified as peat because of an error in the ancillary soil data. Finally, the mwRTM in L4_SM Version 8 uses the Mironov soil mixing approach and updated values of the L-band scattering albedo, soil roughness, and vegetation opacity climatology obtained from the latest (Release 19) SMAP Level-2 dual-channel soil moisture retrieval product. During the development of L4_SM Version 8, the change in the mwRTM parameterization resulted in a reduced unbiased RMSE of surface soil moisture when verified against in situ measurements. It also reduced the standard deviation of the Tb observation-minus-forecast residuals by ~0.15 K, highlighting the importance of the mwRTM for successful data assimilation. The bug fixes in the precipitation corrections algorithm and the Catchment model soil parameters in the Argentina region result in locally large improvements of the simulated land surface states. In summary, the ongoing refinements of the L4_SM product continue to improve its science quality and performance for global soil moisture monitoring

Rolf Reichle↗
NASA NTRS2008

Uncertainty Analysis of Air Radiation for Lunar Return Shock Layers

By leveraging a new uncertainty markup technique, two risk analysis methods are used to compute the uncertainty of lunar-return shock layer radiation predicted by the High temperature Aerothermodynamic Radiation Algorithm (HARA). The effects of epistemic uncertainty, or uncertainty due to a lack of knowledge, is considered for the following modeling parameters: atomic line oscillator strengths, atomic line Stark broadening widths, atomic photoionization cross sections, negative ion photodetachment cross sections, molecular bands oscillator strengths, and electron impact excitation rates. First, a simplified shock layer problem consisting of two constant-property equilibrium layers is considered. The results of this simplified problem show that the atomic nitrogen oscillator strengths and Stark broadening widths in both the vacuum ultraviolet and infrared spectral regions, along with the negative ion continuum, are the dominant uncertainty contributors. Next, three variable property stagnation-line shock layer cases are analyzed: a typical lunar return case and two Fire II cases. For the near-equilibrium lunar return and Fire 1643-second cases, the resulting uncertainties are very similar to the simplified case. Conversely, the relatively nonequilibrium 1636-second case shows significantly larger influence from electron impact excitation rates of both atoms and molecules. For all cases, the total uncertainty in radiative heat flux to the wall due to epistemic uncertainty in modeling parameters is 30% as opposed to the erroneously-small uncertainty levels (plus or minus 6%) found when treating model parameter uncertainties as aleatory (due to chance) instead of epistemic (due to lack of knowledge).

Kleb, Bil↗
DOE OSTI2026

Analytical small-signal stability analysis of low-inertia power system frequency response considering secondary frequency regulation

Modern power systems are increasingly vulnerable to frequency instability as inverter-based resources (IBRs) replace synchronous machines and reduce system rotational inertia. Existing small-signal frequency stability assessment methods are either computationally intensive, relying on simulation-driven approaches, or lack analytical stability regions that explicitly account for secondary frequency response (SFR). This paper introduces new analytical frameworks that enable evaluation small-signal frequency stability while explicitly incorporating tunable IBR and SFR parameters. Using Kharitonov’s theorem with an overbounding approach, explicit small-signal stability criteria are derived. In addition, based on Białas’ criterion and Hurwitz matrix, analytical stability regions are established to reveal feasible design spaces for SFR and IBR parameters tuning. Extensive Matlab/Simulink-based simulations validate the accuracy and computational efficiency of the proposed methods, demonstrating that coordinated tuning of SFR and IBR parameters can substantially enhance system resilience. By bridging analytical rigor with practical tunability, this work provides an analytical framework for assessing small-signal frequency stability in low-inertia grids, supporting the real-time, scalable, and resilient operation of sustainable power systems.

14 SOLAR ENERGY↗
DOE OSTI2026

Heavy long-lived dark vector via a gluonic portal

We study a dark gauge boson Z′ that exclusively couples to the QCD gluons through higher dimensional operators. These operators are generated from integrating out of heavy ultraviolet resonances carrying both QCD and dark gauge charges. With SU(3)C gauge invariance, charge and parity symmetries preserved, we find that the leading effective operators are restricted to have the form of Z′GGG and Z′Z′GG at dimension-eight, which can naturally render the Z′ particle long-lived, and serve as a viable dark matter candidate. We investigate the phenomenology of these operators with both collider experiments and cosmological observation, without and with the assumption that this dark gauge boson plays the role of the dominant dark matter component. For an unstable Z′, we show that depending on its lifetime, it can be probed by various observables up to ultraviolet physics scale around 10 9 GeV. For Z′ being dark matter, we find that $m_{Z'}$ ≳ 1 TeV is consistent with the thermal freeze-out scenario. In contrast, in the freeze-in scenario, the extremely small couplings leave the relevant parameter space largely unconstrained by current experiments.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2025

Uncertainty estimation of bifurcated solutions in the Rayleigh–Bénard problem for advanced nuclear reactors applications

Multiphysics models of nuclear reactors frequently comprise nonlinear systems of equations. The nonlinear nature of these models could lead to solution bifurcations, where a small change in a certain parameter, e.g., the thermophysical properties of the coolant, can lead to a sudden change in the system’s behavior. At the point in parameter space where this happens, called a critical point, the Jacobian matrix of the model’s nonlinear operator becomes singular potentially permitting multiple solutions to coexist. In this paper, we perform uncertainty estimation (UE) in a parameter range that includes bifurcated solutions within the context of Rayleigh–Bénard problem. We perform this analysis assuming uncertain temperature difference, and tilt angle for the iterative solution algorithm with a unit Prandtl number (Pr = 1). Also, we perform this analysis under uncertain thermophysical properties for both FLiBe molten salt and liquid sodium as working fluid. We deploy two approaches to compute statistical moments for the resulting distributions of selected flow-field variables. The first approach is the blind computation of the mean and the standard deviation without any consideration of solution bifurcation, while the second approach utilizes k-means clustering to cluster each branch’s solutions together and compute separate statistical moments for each branch. The statistical distributions are obtained by perturbing the selected parameters about nominal values that correspond to a solution on one of the valid branches, and that solution is used as initial guess for the iterative solution algorithm. We found that perturbation of any parameter when its nominal value is close to its critical point always leads to branch jumping, i.e., the iterations converge to a solution on a branch different from the branch of the initial guess. This produces a statistical ensemble comprised of fundamentally different solutions leading to wrong mean values and uncertainty estimates, whereas clustering provides an efficient way to deal with this type of computation. This work is important for developing Gen IV nuclear systems because many of these systems rely on natural convection for cooling especially in accident conditions.

97 - MATHEMATICS AND COMPUTING↗
DOE OSTI2025

Suppression of ferromagnetic correlations in hole-doped SrCo 2 As 2

We report the growth of high-quality single crystals of hole-doped composition Sr 0.95 K 0.05 Co 2 As 2 and present an investigation of its structural, electronic, thermal, and magnetic properties. Our results show that hole doping leads to a substantial suppression of ferromagnetic (FM) correlations present in SrCo 2 As 2 leading to nearly isotropic magnetic susceptibilities χ ab,c (T) of Sr 0.95 K 0.05 Co 2 As 2 . The presence of FM fluctuations is considered one of the detrimental reasons why SrCo 2 As 2 does not achieve a superconducting ground state despite having a precursor for it in the form of stripe-like antiferromagnetic fluctuations. The suppression of FM fluctuations leads to qualitative similarities between the properties of hole-doped SrCo 2 As 2 and the end member of superconducting 122 iron-arsenide family KFe 2 As 2 . Our results also infer the presence of strongly correlated electronic states in Sr 0.95 K 0.05 Co 2 As 2 . Further, they show that the electronic structure of SrCo 2 As 2 as well as this hole-doped composition is exceptionally unstable in the vicinity of Fermi level EF for small alterations in the structural parameters and sensitively depends upon the details of simulation.

36 MATERIALS SCIENCE↗
DOE OSTI2026

Schwinger-Keldysh effective action for hydrodynamics with approximate symmetries

We study hydrodynamic theories with approximate symmetries in the recently developed effective action approach on the Schwinger-Keldysh contour. We employ the method of spurious symmetry transformation for small explicit symmetry-breaking parameters to systematically constrain symmetry-breaking effects in the nonequilibrium effective action for hydrodynamics. We apply our method to the hydrodynamic theory of chiral symmetry in quantum chromodynamics at finite temperature and density and its explicit breaking by quark masses. We show that the spurious symmetry and the Kubo-Martin-Schwinger relation dictate that the Ward-Takahashi identity for the axial symmetry, i.e., the partial conservation of axial vector current (PCAC) relation, contains a relaxational term proportional to the axial chemical potential, whose kinetic coefficient is at least of the second order in the quark mass. In the phase where the chiral symmetry is spontaneously broken, and the pseudo-Nambu-Goldstone pions appear as hydrodynamic variables, this relaxation effect is subleading compared to the conventional pion mass term in the PCAC relation, which is of the first order in the quark mass. On the other hand, in the chiral symmetry restored phase, we show that our relaxation term, which is of the second order in the quark mass, becomes the leading contribution to the axial charge relaxation. Therefore, the leading axial charge relaxation mechanism is parametrically different in the quark mass across a chiral phase transition.

Goldstone bosons↗
DOE OSTI2024

Approaches for the Simulation of Coupled Processes in Evolving Fractured Porous Media Enabled by Exascale Computing

Models have historically represented fractured porous media with continuum descriptions that characterize the media using bulk parameters. The impact of small-scale features is not captured in these models, although they may be controlling the performance of subsurface applications. Pore-scale models can simulate processes in small-scale features by representing the pore space geometry explicitly but are computationally expensive for large domains. The alternative multiscale approach entails the combination of pore-scale and continuum-scale descriptions in a single framework. We use Chombo-Crunch, a computational capability that discretizes complex geometries with an adaptive, embedded boundary method to contrast these two approaches. Chombo-Crunch takes advantage of recent computational performance and memory bandwidth improvements resulting from the emergence of exascale computing resources. These combined improvements enable the efficient simulation of reactive transport in fractured media with a high degree of fidelity and the ability to capture the control small-scale processes exert on the overall medium evolution.

42 ENGINEERING↗
NASA NTRS1972

Apollo/Saturn 5 postflight lunar impact trajectory - AS-511 S-4B/IU

The postflight trajectory is presented for the Apollo/Saturn V AS-511 spent S-IVB/IU stage from CSM separation to lunar impact. The lunar impact coordinates and conditions are included. Some combinations of small S-IVB/IU stage related forces are hypothesized to account for a significant angular momentum increase and small translational perturbations. Trajectory dependent parameters in geocentric and selenocentric inertial coordinates (PACSS4, reference epoch at mean nearest Besselian year) module separation to lunar impact. Data relating to the tracking residuals (observed minus model calculated (O-C)) are also given for the best-estimate trajectory.

Source record↗
NASA NTRS1976

Large deflections of shallow conical membrane

Large deflections of a shallow elastic conical membrane fixed at the outer edge and loaded by either uniform or hydrostatic pressure are investigated. The overning equations were solved by the method of matched asymptotic expansions and by a finite difference method. Agreement between the two methods was excellent for the small values of the perturbation parameter.

Chang, W. H.↗
NASA NTRS1978

The moon in Heiligenschein

An analysis of 25 photometric digital images of the moon has been carried out to obtain a single image in a new mapping parameter, the Heiligenschein exponent. The data necessarily represent a range of lunar phases, but all are within 10 hours of full moon. The new parameter characterizes the rate at which lunar features brighten as their local phase angles approach zero. Although considerable contrast is present in this parameter, there is only a small corelation with normal albedo. In particular, the large albedo difference between maria and highlands is not simply reflected in Heiligenschein differences, which are larger within each category of terrain than the difference between the Heiligenschein averages of each. A correlation with age may be present in both the maria and the highlands, but its determination will require separation into distinct geochemical provinces.

Wildey, R. L.↗
NASA NTRS1979

Electrical Characterization of the RCA CDP1822SD Random Access Memory, Volume 1, Appendix a

Electrical characteristization tests were performed on 35 RCA CDP1822SD, 256-by-4-bit, CMOS, random access memories. The tests included three functional tests, AC and DC parametric tests, a series of schmoo plots, rise/fall time screening, and a data retention test. All tests were performed on an automated IC test system with temperatures controlled by a thermal airstream unit. All the functional tests, the data retention test, and the AC and DC parametric tests were performed at ambient temperatures of 25 C, -20 C, -55 C, 85 C, and 125 C. The schmoo plots were performed at ambient temperatures of 25 C, -55 C, and 125 C. The data retention test was performed at 25 C. Five devices failed one or more functional tests and four of these devices failed to meet the expected limits of a number of AC parametric tests. Some of the schmoo plots indicated a small degree of interaction between parameters.

Klute, A.↗
NASA NTRS1979

Stability of inner planetary systems

The stability of inner planetary systems with arbitrary mass ratios is studied on the basis of the model of the plane restricted three-body problem. A quantitative stability criterion is obtained in terms of the difference between the critical value of the Jacobi constants (at which bifurcation can occur) and the critical value corresponding to a planetary orbit. An orbit is stable if it cannot leave a region that contains only the larger central body (Hill). For small values of the mass parameter, the maximum dimensionless radius of a Hill-stable orbit is 1 minus 2.4 times the cube root of the mass parameter.

Szebehely, V.↗
NASA NTRS1986

Characteristic recovery times of Forbush-type decreases in the cosmic radiation. I - Observations at earth at different energies

Data on 30 asymmetric Forbush decreases recorded by the IMP spacecraft at 1 AU and the Mt. Washington neutron monitor over the period 1972-84 are examined to characterize the recovery characteristics of cosmic rays after the events. The spacecraft data are concentrated at energies of 1.7 GV, while the terrestrial instruments recorded events at 5 GV. Attention is paid to the relative amplitudes of the recorded transient decreases, the characteristic recovery times, and the energy dependence of the amplitudes and recovery time. The recovery times were found to be equal at both energy levels, supporting a concept of energy independence for the recoveries. Also, no correlations were found between the recovery times and the occurrences of a solar magnetic field reversal or with phase in the solar modulation cycle. A time-dependent, two-dimensional model is defined, which expresses the cosmic ray particle distributions as a function of the decay of the disturbance, with a small dependence on the transport parameters of the cosmic rays.

Lockwood, J. A.↗
NASA NTRS1986

Microcirculatory fluid dynamics in weightlessness and simulated weightlessness

The method of Smith et al. (1985), which makes it possible to simultaneously measure the macrocirculation and microcirculation in an unanesthetized rat, was used to study the effect of acute hypokinesia on the rat microvascular system. The measurements yielded values of the length, diameter, and number of arteriolar and venular vessels; vascular patterns; branching ratios; and the amplitude and frequency of vasomotion. Early effects (30-60 min after the start of the head-down tilt) include a 10 percent increase in the diameter of arterioles, a slight increase of heart rate and mean arterial blood pressure, and an increase in the heart rate-pulse pressure product, with most of the changes returning to normal after 2-3 h. The baroreceptor reflex index was reduced by almost 50 percent for the first 2 h, but rebounded to almost 3 times the control value after 3 h. This indicates that, in spite of relatively small changes in gross hemodynamic parameters, the cardiovascular function is altered significantly during the acute phase of hypokinesia.

Hutchins, P. M.↗