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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
NASA NTRSDate not supplied

An Approach to Shape Parameterization Using Laboratory Hypervelocity Impact Experiments

NASA’s Orbital Debris Program Office relies on laboratory-based impact tests to supplement the measurement data of on-orbit events that defines the orbital debris environment. These experiments provide information that is essential to interpreting the radar and optical measurements of orbital fragmentation events into useful metrics, such as characteristic size of the debris, and to providing a better understanding of the distributions of fragment populations in terms of their masses, material constituents, fragment densities, cross-sectional areas, area-to-mass ratios, shapes, etc. The Satellite Orbital Debris Characterization Impact Test (SOCIT) was a notable laboratory impact experiment conducted in 1992 using a surplus U.S. Navy Transit navigation satellite of the 1960s. The data from this ground-based experiment were combined with on-orbit measurements to develop the NASA Standard Satellite Breakup Model (SSBM). To account for advancements in satellite design and construction since, a new impact test series – DebriSat – was conducted in 2014. This test utilized a high-fidelity mock-up spacecraft that better represents the materials and construction techniques used to design and manufacture modern spacecraft. Together, these tests offer valuable data to model an orbital debris environment composed of legacy and modern spacecraft. This paper presents an overview of the two laboratory impact tests, comparing their fragment parameter distributions with each other and with relevant distributions from the NASA SSBM. The categorization and descriptions of fragment shapes are of significant interest for future work, yet there are marked differences in the definitions of shape categories between each dataset. The categorizations of constituent materials, and the measurement techniques employed to populate these two datasets, are also different. New rubrics simplify and equate the categorizations between datasets to aid comparative analyses and to facilitate the potential use of both datasets in tandem with future environmental debris models. A preferred approach to classifying shape across disparate datasets uses the characteristic-length dimensions, and a simplified shape classification based on physical, solid-body dimensions, to mathematically construct an encapsulating right-circular cylinder that represents the fragment. The ratio of cylinder length-to-diameter (L:D) then provides a single continuum value for shape that is strongly correlated with its designated shape and size. This metric can then be used to further assess the distribution of shape with populations of other fragment characteristics within these datasets. The shape parameterization using the L:D ratios of right-circular cylinders is discussed.

John H. Seago↗
NASA NTRSDate not supplied

A Unified SHOC-MF Boundary Layer Parameterization in the NASA Goddard Earth Observing System Model

We present results from a novel extension of the boundary layer parameterization in the NASA Goddard Earth Observing System (GEOS) model. An Eddy Diffusivity-Mass Flux (EDMF) multi-plume updraft scheme was previously implemented in GEOS. Here we replace the K-profile eddy diffusivity scheme of Lock et. al. (2000) with the Simplified Higher Order Closure (SHOC; Bogenschutz and Krueger, 2013). The scheme prognoses turbulent kinetic energy, and derives buoyancy flux, cloud fraction and condensate from a trivariate double-gaussian joint PDF. The original SHOC scheme is modified in two significant respects: (i) contributions from the EDMF updrafts are included in estimates of all higher order moments used to determine the PDF; and (ii) the second and third moments of total water are made prognostic variables, with source terms associated with EDMF updrafts. The predicted higher order moments as well as updraft and environmental properties are compared with large eddy simulations in several case studies. Results indicate that many higher order moments are underestimated when the mass flux contribution is neglected.

Nathan Arnold↗
NASA NTRSDate not supplied

An Approach to Shape Parameterization Using Laboratory Hypervelocity Impact Experiments

NASA’s Orbital Debris Program Office relies on laboratory-based impact tests to supplement the measurement data of on-orbit events that defines the orbital debris environment. These experiments provide information that is essential to interpreting the radar and optical measurements of orbital fragmentation events into useful metrics, such as characteristic size of the debris, and to providing a better understanding of the distributions of fragment populations in terms of their masses, material constituents, fragment densities, cross-sectional areas, area-to-mass ratios, shapes, etc. The Satellite Orbital Debris Characterization Impact Test (SOCIT) was a notable laboratory impact experiment conducted in 1992 using a surplus U.S. Navy Transit navigation satellite of the 1960s. The data from this ground-based experiment were combined with on-orbit measurements to develop the NASA Standard Satellite Breakup Model (SSBM). To account for advancements in satellite design and construction since, a new impact test series – DebriSat – was conducted in 2014. This test utilized a high-fidelity mock-up spacecraft that better represents the materials and construction techniques used to design and manufacture modern spacecraft. Together, these tests offer valuable data to model an orbital debris environment composed of legacy and modern spacecraft. This paper presents an overview of the two laboratory impact tests, comparing their fragment parameter distributions with each other and with relevant distributions from the NASA SSBM. The categorization and descriptions of fragment shapes are of significant interest for future work, yet there are marked differences in the definitions of shape categories between each dataset. The categorizations of constituent materials, and the measurement techniques employed to populate these two datasets, are also different. New rubrics simplify and equate the categorizations between datasets to aid comparative analyses and to facilitate the potential use of both datasets in tandem with future environmental debris models. A preferred approach to classifying shape across disparate datasets uses the characteristic-length dimensions, and a simplified shape classification based on physical, solid-body dimensions, to mathematically construct an encapsulating right-circular cylinder that represents the fragment. The ratio of cylinder length-to-diameter (L:D) then provides a single continuum value for shape that is strongly correlated with its designated shape and size. This metric can then be used to further assess the distribution of shape with populations of other fragment characteristics within these datasets. The shape parameterization using the L:D ratios of right-circular cylinders is discussed.

John H Seago↗
NASA NTRSDate not supplied

A Unified SHOC-MF Boundary Layer Parameterization in the NASA Goddard Earth Observing System Model

We present results from a novel extension of the boundary layer parameterization in the NASA Goddard Earth Observing System (GEOS) model. An Eddy Diffusivity-Mass Flux (EDMF) multi-plume updraft scheme was previously implemented in GEOS. Here we replace the K-profile eddy diffusivity scheme of Lock et. al. (2000) with the Simplified Higher Order Closure (SHOC; Bogenschutz and Krueger, 2013). The scheme prognoses turbulent kinetic energy, and derives buoyancy flux, cloud fraction and condensate from a trivariate double-gaussian joint PDF. The original SHOC scheme is modified in two significant respects: (i) contributions from the EDMF updrafts are included in estimates of all higher order moments used to determine the PDF; and (ii) the second and third moments of total water are made prognostic variables, with source terms associated with EDMF updrafts. The predicted higher order moments as well as updraft and environmental properties are compared with large eddy simulations in several case studies. Results indicate that many higher order moments are underestimated when the mass flux contribution is neglected.

Nathan Arnold↗
NASA NTRS2024

Parameterizing Spectral Surface Reflectance Relationships for the Dark Target Aerosol Algorithm Applied to A Geostationary Imager

Originally developed for the Moderate Resolution Imaging Spectroradiometer (MODIS) in polar, sun-synchronous low-earth orbit (LEO), the Dark Target (DT) aerosol retrieval algorithm relies on the assumption of a Surface Reflectance Parameterization (SRP) over land surfaces. Specifically for vegetated and dark-soiled surfaces, values of surface reflectance in blue and red visible-wavelength bands are assumed to be nearly linearly related to each other and to the value in a shortwave infrared (SWIR) wavelength band. This SRP also includes dependencies on scattering angle and a normalized difference vegetation index computed from two SWIR bands (NDVISWIR). As the DT retrieval algorithm is being ported to new sensors to continue and expand the aerosol data record, we assess whether the MODIS-assumed SRP can be used for these sensors. Here, we specifically assess SRP for the Advanced Baseline Imager (ABI) aboard, the Geostationary Operational Environmental Satellite (GOES)-16/East (ABIE). First, we find that using MODIS-based SRP leads to higher biases and artificial diurnal signatures in aerosol optical depth (AOD)retrievals from ABIE. The primary reason appears to be that geostationary orbit (GEO) encounters an entirely different set of observation geometry than does LEO, primarily with regards to solar angles coupled with fixed view angles. Therefore, we have developed a new SRP for GEO that draws the angular shape of the surface bidirectional reflectance. We also introduce modifications to the parametrization of both red-SWIR and blue-red spectral relationships to include additional information.The revised Red-SWIR SRP includes solar zenith angle, NDVISWIR, and land-type percentage from an ancillary database. The blue-red SRP adds dependencies on the scattering angle and NDVISWIR. The new SRPs improve the AOD retrieval of ABIE in terms of overall less bias and mitigation of the overestimation around local noon. The average bias of DT AOD compared to AERONET AOD shows a reduction from 0.08 to 0.03, while the bias of local solar noon decreases from 0.12 to 0.03.The agreement between DT and AERONET AOD is established through regression slope of 1.06 and y-intercept of 0.01with correlation coefficient is0.74. By using the new SRP, the percentage of data falling within the expected error range (±0.05 + 15%) is notably risen from 54% to 78%.

Mijin Kim↗
NASA NTRSDate not supplied

Parameterized Study of Heat Load Trends in a Subscale Rotating Detonation Rocket Engine

NASA has developed a subscale rotating detonation rocket engine platform, enabling rapid parameterization of components and their associated performances. A major performance metric of interest for RDREs is the total heat absorbed at a given operating condition and wave mode operation. To investigate this, several sets of hardware were produced to have variation of the contraction ratio, injector geometry, and length. A wide range of total mass flow rates and mixture ratios were also explored using gaseous methane/oxygen. All hardware was produced using laser powder bed fusion GRCop-42, GRX-810, or C-103 alloys depending on the component cooling requirements. Outer and inner body hardware were made from GRCop-42 where heat fluxes were expected to be high and were water cooled through integrated coolant channels. Nozzles were made from C-103 which are radiatively cooled. Finally, the injectors were produced using GRCop-42 or GRX-810 as passive cooling via propellant injection has previously found to be sufficient given the small gap width of exposed injection surface. Total heat load and bulk heat flux measurements to the hot walls are reported. Trends in heat load and heat flux are shown with relation to parameters such as chamber pressure, area ratio, and wave mode. Heat loads between the inner and outer bodies and the chamber and shroud section are compared.

Heat Flux↗
NASA NTRSDate not supplied

Parameterized Study of Heat Load Trends in a Subscale Rotating Detonation Rocket Engine

NASA has developed a subscale rotating detonation rocket engine platform, enabling rapid parameterization of components and their associated performances. A major performance metric of interest for RDREs is the total heat absorbed at a given operating condition and wave mode operation. To investigate this, several sets of hardware were produced to have variation of the contraction ratio, injector geometry, and length. A wide range of total mass flow rates and mixture ratios were also explored using gaseous methane/oxygen. All hardware was produced using laser powder bed fusion GRCop-42, GRX-810, or C-103 alloys depending on the component cooling requirements. Outer and inner body hardware were made from GRCop-42 where heat fluxes were expected to be high and were water cooled through integrated coolant channels. Nozzles were made from C-103 which are radiatively cooled. Finally, the injectors were produced using GRCop-42 or GRX-810 as passive cooling via propellant injection has previously found to be sufficient given the small gap width of exposed injection surface. Total heat load and bulk heat flux measurements to the hot walls are reported. Trends in heat load and heat flux are shown with relation to parameters such as chamber pressure, area ratio, and wave mode. Heat loads between the inner and outer bodies and the chamber and shroud section are compared.

Heat Loads↗
DOE OSTI2025

Reduced basis approximations of parameterized dynamical partial differential equations via neural networks

Projection-based reduced order models are effective at approximating parameter-dependent differential equations that are parametrically separable. When parametric separability is not satisfied, which occurs in both linear and nonlinear problems, projection-based methods fail to adequately reduce the computational complexity. Devising alternative reduced order models is crucial for obtaining efficient and accurate approximations to expensive high-fidelity models. In this work, we develop a timestepping procedure for dynamical parameter-dependent problems, in which a neural-network is trained to propagate the coefficients of a reduced basis expansion. This results in an online stage with a computational cost independent of the size of the underlying problem. Here, we demonstrate our method on several parabolic partial differential equations, including a problem that is not parametrically separable.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2026

A North Sea in Situ Evaluation of the Fitch Wind Farm Parameterization Within the Mellor-Yamada-Nakanishi-Niino and 3D Planetary Boundary Layer Schemes

Wind resource assessments and wind power forecasts that account for wind farm wakes are sensitive to the choice of planetary boundary layer (PBL) scheme. This work compares the one-dimensional Mellor-Yamada-Nakanishi-Niino (MYNN) PBL scheme with a three-dimensional PBL (3DPBL) scheme, evaluating predictions made with both schemes against two sets of North Sea in situ observations of wind farm wakes. The optimal PBL scheme varies based on the observations (FINO1 tower vs. aircraft), the quantity of interest (wind speed vs. turbulence kinetic energy [TKE]), and the error metric (bias, centered root mean square error [cRMSE], R2, and earth mover's distance [EMD]). Whereas 3DPBL wind speeds outperform MYNN wind speeds with respect to the cRMSE at the FINO1 site located at a single point within the turbine rotor layer, 3DPBL TKE bias is larger than MYNN TKE bias when compared to aircraft observations taken 100 m above a wind farm. Wind speeds in the aircraft region are ambiguous with regard to which PBL scheme is optimal. Aircraft MYNN wind speeds outperform 3DPBL wind speeds with respect to R2 and cRMSE but underperform with respect to bias and EMD. Future evaluations across broader temporal and spatial scales may offer further insight into model differences.

17 WIND ENERGY↗
NASA NTRSDate not supplied

Growth Curve Parameterization of Metabolic Activity of Yeast Cells for BioSentinel

The goal of the BioSentinel small satellite payload is to measure the effect of deep space radiation on the growth and metabolic activity of yeast cells. Raw test data is generated by fluidics cards containing yeast cells rehydrated at different periods, with metabolic activity measured by the reduction of alamarBlue. Each card well has a sensor array that measures the amount of red, green, and infrared light transmitted through the yeast culture. This illumination data is then converted to absorbance values, which are further converted into concentrations. The ultimate objective is to convert these concentrations into biologically-relevant metrics that can be compared against one another to determine changes due to differential radiation exposure. Beginning with IR absorbance data (corresponding to cell density) from ground studies, three parameters from a sigmoidal growth curve were extracted and analyzed: 𝜆 (lag phase), 𝜇 (max growth rate), and A (max cell growth). The data was fit to the Gompertz model of microbial growth using non-linear regression (Minitab), as the fit error was reduced compared to the simpler logistic growth curve. Graphs showed that the data contained a discrepancy (drift) in the lag phase that is attributable to a slow, constant loss of moisture. Correcting this discrepancy by fitting the first 25 hours of the data to a power function and subtracting these values from the absorbance readings obtained a better statistical fit to the growth curve in the lag phase. A power fit was selected over a linear fit because it reflected the effects of constant volume loss. This correction to the BioSentinel data analysis pipeline will enable quantitative statistical analysis of the effect of different levels of deep space radiation on yeast cells. Future work includes automation of drift correction and curve modeling to extract these parameters directly from data.

Growth Curve↗
DOE OSTI2024

Implementation and Validation of a Generalized Actuator Disk Parameterization for Wind Turbine Simulations Within the FastEddy Model

ABSTRACT Fast and accurate large‐eddy simulation (LES) of the atmospheric boundary layer plays a crucial role in advancing wind energy research. Long‐duration wind farm studies at turbine‐resolving scales have become increasingly important to understand the intricate interactions between large wind farms and the atmospheric boundary layer. However, the prohibitive computational cost of these turbulence‐ and turbine‐resolving simulations has precluded such modeling to be exercised on a regular basis. To that end, we implement and validate the generalized actuator disk (GAD) model in the computationally efficient, graphics processing unit (GPU)–resident, LES model FastEddy. We perform single‐turbine simulations under three atmospheric stabilities (neutral, unstable, and stable) and compare them against observations from the Scaled Wind Farm Technology (SWiFT) facility and other LES codes from the recent Wakebench turbine wake model benchmark. Our idealized LES results agree well with observed wake velocity deficit and downstream recovery across stability regimes. Turbine response in terms of rotational speed, generated power, torque, and thrust coefficient are well predicted across stability regimes and are consistent with the LES results from the benchmark. The FastEddy simulations are found to be at least two orders of magnitude more efficient than the traditional CPU‐based LES models, opening the door for realistic LES simulations of full wind plants as a viable standard practice.

17 WIND ENERGY↗
DOE OSTI2026

Fantômas unconfined: global QCD fits with Bézier parameterizations

Fantômas is a C++ toolkit for exploring the parametrization dependence of parton distribution functions (PDFs) and other correlator functions in quantum chromodynamics (QCD). Fantômas facilitates the generation of adaptable polynomial parametrizations for PDFs, called metamorphs, to find best-fit PDF solutions and quantify the epistemic uncertainty associated with the parametrizations during their fitting. The method employs Bézier curves as universal approximators for a variety of PDF shapes. Integrated into the xFitter framework for the global QCD analysis, Fantômas provides a foundation for general models of PDFs, while reducing the computational time compared to the approaches utilizing traditional polynomial parametrizations as well as providing an interpretable alternative to neural-network-based models. This paper outlines the structure and practical usage of the Fantômas toolkit, including its inputs, outputs, and implementation within xFitter. It also provides a practical example of using Fantômas for uncertainty quantification as well as the combination of PDF fits into a single ensemble.

Bézier curves↗
DOE OSTI2025

Sensitivity analysis of a parameterization of coagulation in an aqueous transport model

A three-dimensional aqueous transport model, ALGE, was developed at the Savannah River National Laboratory (SRNL) as a tool for emergency response. Recently, coagulation and break-up of sediment and particulate (contaminant adhered to sediment) matter has been added as a new model capability, representing both processes as functions of salinity and turbulence. A sensitivity analysis was performed by comparing time series of sediment and particulate concentrations at various locations when the model’s parameters (particle size and density) are altered. The results show significant differences between experiments in both freshwater and saltwater systems parameters vary (P-values < 0.05). From this sensitivity study, we have concluded the importance of incorporating both salinity and turbulent effects, as they have a large role in the physical process of coagulation and breakup of sediment. By accounting for these physical processes, we have made the ALGE model a more robust tool for emergency response.

Aqueous fate and transport↗
DOE OSTI2025

Direct sensitivity analysis on the parameterization of crystal plasticity models

Various methods for calibrating crystal plasticity finite element (CPFE) models lead to non-unique input parameter values, which subsequently introduce uncertainty in the predicted mechanical response. Sensitivity analysis (SA) conducted on crystal plasticity models is used to identify how variability in these parameters contribute to output uncertainty. Traditional SA on CPFE parameters uses simplified surrogate models to save computational time. However, the accuracy of the surrogate models depends on the quantity of training data used, and any modeling error can propagate into the SA results, potentially affecting their reliability. In this work, the elementary effects test (EET) method, a global SA technique using direct CPFE simulations was employed, and the results obtained were compared with the First Order Second Moment (FOSM) method. ExaConstit, an open-source GPU-enabled CPFE code, was used to perform the simulations and direct SA. The EET method was accurately able to capture the non-linear effects of all the input parameters on the output and is a valuable approach for reliably attributing parameter sensitivities in CPFE models. Based on the results, efficient strategies to perform future parameter calibration and SA are discussed. Additionally, the SA trends observed in different single crystal orientations closely mirrored the activity of the slip systems.

Elementary Effects Test↗
DOE OSTI2024

Efficient Parameterization of Density Functional Tight-Binding for 5 f -Elements: A Th–O Case Study

Density functional tight binding (DFTB) models for f-element species are challenging to parametrize owing to the large number of adjustable parameters. The explicit optimization of the terms entering the semiempirical DFTB Hamiltonian related to f orbitals is crucial to generating a reliable parametrization for f-block elements, because they play import roles in bonding interactions. However, since the number of parameters grows quadratically with the number of orbitals, the computational cost for parameter optimization is much more expensive for the f-elements than for the main group elements. In this work we present a set of efficient approaches for mitigating the hurdle imposed by the large size of the parameter space. A novel group-by-orbital correction functions for two-center bond integrals was developed. With this approach the number of parameters is reduced, and it grows linearly with the number of elements, maintaining the accuracy and the number of parameters, in the case of f elements, by more than 40%. The parameter optimization step was accelerated by means of the mini-batch BFGS method. This method allows parameter optimizations with much larger training sets than other single batch methods. A stochastic optimizer was employed that helped overcome shallow local minima in the objective function. The proposed algorithm was used to parametrize the DFTB Hamiltonian for the Th–O system, which was subsequently applied to the study of ThO 2 nanoparticles. The training set consisted of 6322 unique structures, which is barely feasible with conventional optimization methods. The optimized parameter set, LANL-ThO, displays good agreement with DFT-calculated properties such as energies, forces, and structures for both clusters and bulk ThO 2 . Benefiting from the fewer number of parameters and lower computational costs for objective function evaluations, this new approach shows its potential applications in DFTB parametrization for elements with high angular momentum, which present a challenge to conventional methods.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2025

STEPs-SOL, a Peptoid Force Field Parameterization to Include Solvent Effects

As peptoids (N-substituted glycines) continue to gain popularity as a class of biomimetic polymers, the importance and demand for accurate force fields in molecular simulations also grow. Building on the vacuum-optimized Systematic and Extensible Force Field for Peptoids (STEPs) force field, here we present STEPs-SOL, a novel peptoid force field parametrization that effectively incorporates solvent effects to enhance the accuracy of peptoid simulations. The development of STEPs-SOL is based on the need for precise electrostatic modeling achieved through solvent-specific partial charge optimization. Here, our systematic approach significantly improves agreement with experimental measurements, reducing the mean absolute error in cis/trans ratio predictions (ΔG c/t ) by an average of 38% across multiple peptoid residues and solvent environments. This improved parametrization addresses computational challenges associated with nonbonded energies while maintaining a workflow that relies on high-level quantum mechanical data rather than depending solely on limited experimental equilibrium properties. By evaluating the effects of conformational bias in restrained electrostatic potential (RESP) charge generation and examining their impact on peptoid conformations in various solvents, we enhance our understanding of peptoid structural dynamics while providing a more accurate modeling framework.

force field↗