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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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All sourcesNASA NTRSDOE OSTI
NASA NTRS1996

Prop Rotor Acoustics for Conceptual Design

The report describes a methodology for the simple prediction of noise generated by a tilt-rotor aircraft in hover and forward flight. In order to avoid the computational penalties associated with exact noise calculations, simplifications to the loading noise calculation and the blade-vortex interaction noise calculation have been introduced. The loading noise computation utilizes a constant chordwise loading assumption, while the BVI noise level is estimated through use of a dimensionless parameter, here termed 'BVI number.' The acoustic computation code, designed as a module for use with VASCOMP, has two modes of operation, one as a quick estimator of acoustic amplitude produced by a tilt rotor with a typical rotor design and the other as a tool for rotor parametric design studies.

Wells, Valana L.↗
NASA NTRS2007

ISRU System Model Tool: From Excavation to Oxygen Production

In the late 80's, conceptual designs for an in situ oxygen production plant were documented in a study by Eagle Engineering [1]. In the "Summary of Findings" of this study, it is clearly pointed out that: "reported process mass and power estimates lack a consistent basis to allow comparison." The study goes on to say: "A study to produce a set of process mass, power, and volume requirements on a consistent basis is recommended." Today, approximately twenty years later, as humans plan to return to the moon and venture beyond, the need for flexible up-to-date models of the oxygen extraction production process has become even more clear. Multiple processes for the production of oxygen from lunar regolith are being investigated by NASA, academia, and industry. Three processes that have shown technical merit are molten regolith electrolysis, hydrogen reduction, and carbothermal reduction. These processes have been selected by NASA as the basis for the development of the ISRU System Model Tool (ISMT). In working to develop up-to-date system models for these processes NASA hopes to accomplish the following: (1) help in the evaluation process to select the most cost-effective and efficient process for further prototype development, (2) identify key parameters, (3) optimize the excavation and oxygen production processes, and (4) provide estimates on energy and power requirements, mass and volume of the system, oxygen production rate, mass of regolith required, mass of consumables, and other important parameters. Also, as confidence and high fidelity is achieved with each component's model, new techniques and processes can be introduced and analyzed at a fraction of the cost of traditional hardware development and test approaches. A first generation ISRU System Model Tool has been used to provide inputs to the Lunar Architecture Team studies.

Santiago-Maldonado, Edgardo↗
NASA NTRS1999

Sonic Boom Prediction and Minimization of the Douglas Reference OPT5 Configuration

Conventional CFD methods and grids do not yield adequate resolution of the complex shock flow pattern generated by a real aircraft geometry. As a result, a unique grid topology and supersonic flow solver was developed at Northrop Grumman based on the characteristic behavior of supersonic wave patterns emanating from the aircraft. Using this approach, it was possible to compute flow fields with adequate resolution several body lengths below the aircraft. In this region, three-dimensional effects are diminished and conventional two-dimensional modified linear theory (MLT) can be applied to estimate ground pressure signatures or sonic booms. To accommodate real aircraft geometries and alleviate the burdensome grid generation task, an implicit marching multi-block, multi-grid finite-volume Euler code was developed as the basis for the sonic boom prediction methodology. The Thomas two-dimensional extrapolation method is built into the Euler code so that ground signatures can be obtained quickly and efficiently with minimum computational effort suitable to the aircraft design environment. The loudness levels of these signatures can then be determined using a NASA generated noise code. Since the Euler code is a three-dimensional flow field solver, the complete circumferential region below the aircraft is computed. The extrapolation of all this field data from a cylinder of constant radius leads to the definition of the entire boom corridor occurring directly below and off to the side of the aircraft's flight path yielding an estimate for the entire noise "annoyance" corridor in miles as well as its magnitude. An automated multidisciplinary sonic boom design optimization software system was developed during the latter part of HSR Phase 1. Using this system, it was found that sonic boom signatures could be reduced through optimization of a variety of geometric aircraft parameters. This system uses a gradient based nonlinear optimizer as the driver in conjunction with a computationally efficient Euler CFD solver (NIIM3DSB) for computing the three-dimensional near-field characteristics of the aircraft. The intent of the design system is to identify and optimize geometric design variables that have a beneficial impact on the ground sonic boom. The system uses a simple wave drag data format to specify the aircraft geometry. The geometry is internally enhanced and analytic methods are used to generate marching grids suitable for the multi-block Euler solver. The Thomas extrapolation method is integrated into this system, and hence, the aircraft's centerline ground sonic boom signature is also automatically computed for a specified cruise altitude and yields the parameters necessary to evaluate the design function. The entire design system has been automated since the gradient based optimization software requires many flow analyses in order to obtain the required sensitivity derivatives for each design variable in order to converge on an optimal solution. Hence, once the problem is defined which includes defining the objective function and geometric and aerodynamic constraints, the system will automatically regenerate the perturbed geometry, the necessary grids, the Euler solution, and finally the ground sonic boom signature at the request of the optimizer.

Siclari, Michael J.↗
DOE OSTI2018

Localized real-time information on outdoor air quality at kindergartens in Oslo, Norway using low-cost sensor nodes

Highlights: • We show that low-cost sensors can provide an indication of outdoor air quality. • We employed a data fusion method to provide real-time air quality maps. • Localized real-time air quality information can help parents and kindergarten staff. In Norway, children in kindergartens spend significant time outdoors under all weather conditions, and there is thus a natural concern about the quality of outdoor air. It is well known that air pollution is associated with a wide variety of adverse health impacts for children, with greater impact on children with asthma. Especially during winter and spring, kindergartens in Oslo that are situated close to streets with busy traffic, or in areas where wood burning is used for house heating, can experience many days with bad air quality. During these periods, updated information on air quality levels can help the kindergarten teachers to plan appropriate outdoor activities and thus protect children's health. We have installed 17 low-cost air quality nodes in kindergartens in Oslo. These nodes are smaller, cheaper and less complex to use than traditional equipment. Performance evaluation shows that while they are less accurate and suffer from higher uncertainty than reference equipment, they still can provide reliable coarse information about local pollution. The main challenge when using this technology is that calibration parameters might change with time depending on the atmospheric conditions. Thus, even if the sensors are calibrated a priori, once deployed, and especially if they are deployed for a long time, it is not possible to determine if a node is over- or under-estimating the concentration levels. To enhance the data from the sensors, we employed a data fusion technique that allows generating a detailed air quality map merging the data from the sensors and the data from an urban model, thus being able to offer air quality information to any location within Oslo. We arranged a focus group with the participation of local administration, kindergarten staff and parents to understand their opinion and needs related to the air quality information that was provided to the participant kindergartens. They expressed concern about the data quality but agree that having updated information on the air quality in the surroundings of kindergartens can help them to reduce children's exposure to air pollution.

54 ENVIRONMENTAL SCIENCES↗
NASA NTRS1995

Methods for prismatic/tetrahedral grid generation and adaptation

The present work involves generation of hybrid prismatic/tetrahedral grids for complex 3-D geometries including multi-body domains. The prisms cover the region close to each body's surface, while tetrahedra are created elsewhere. Two developments are presented for hybrid grid generation around complex 3-D geometries. The first is a new octree/advancing front type of method for generation of the tetrahedra of the hybrid mesh. The main feature of the present advancing front tetrahedra generator that is different from previous such methods is that it does not require the creation of a background mesh by the user for the determination of the grid-spacing and stretching parameters. These are determined via an automatically generated octree. The second development is a method for treating the narrow gaps in between different bodies in a multiply-connected domain. This method is applied to a two-element wing case. A High Speed Civil Transport (HSCT) type of aircraft geometry is considered. The generated hybrid grid required only 170 K tetrahedra instead of an estimated two million had a tetrahedral mesh been used in the prisms region as well. A solution adaptive scheme for viscous computations on hybrid grids is also presented. A hybrid grid adaptation scheme that employs both h-refinement and redistribution strategies is developed to provide optimum meshes for viscous flow computations. Grid refinement is a dual adaptation scheme that couples 3-D, isotropic division of tetrahedra and 2-D, directional division of prisms.

Kallinderis, Y.↗
NASA NTRS1994

A wall interference assessment/correction system

A Wall Signature method originally developed by Hackett has been selected to be adapted for the Ames 12-ft Wind Tunnel WIAC system in the project. This method uses limited measurements of the static pressure at the wall, in conjunction with the solid wall boundary condition, to determine the strength and distribution of singularities representing the test article. The singularities are used in turn for estimating wall interference at the model location. The development and implementation of a working prototype will be completed, delivered and documented with a software manual. The WIAC code will be validated by conducting numerically simulated experiments rather than actual wind tunnel experiments. The simulations will be used to generate both free-air and confined wind-tunnel flow fields for each of the test articles over a range of test configurations. Specifically, the pressure signature at the test section wall will be computed for the tunnel case to provide the simulated 'measured' data. These data will serve as the input for the WIAC method--Wall Signature method. The performance of the WIAC method then may be evaluated by comparing the corrected parameters with those for the free-air simulation. The following two additional tasks are included: (1) On-line wall interference calculation: The developed wall signature method (modified Hackett's method) for Ames 12-ft Tunnel will be the pre-computed coefficients which facilitate the on-line calculation of wall interference, and (2) Support system effects estimation: The effects on the wall pressure measurements due to the presence of the model support systems will be evaluated.

Lo, C. F.↗
DOE OSTI2018

Project 57 Air Monitoring Report: January 1 through December 31, 2017

On April 24, 1957, the Atomic Energy Commission (AEC) (now the Department of Energy [DOE]) conducted the Project 57 safety experiment in western Emigrant Valley northeast of the Nevada National Security Site (NNSS, formerly the Nevada Test Site) on lands withdrawn by the Department of Defense (DOD) for the Nevada Test and Training Range (NTTR). The test was undertaken to develop (1) a means of estimating plutonium distribution resulting from a non-nuclear detonation; (2) biomedical evaluation techniques for use in plutonium-laden environments; (3) methods of surface decontamination; and (4) instruments and field procedures for prompt estimation of alpha contamination (Shreve, 1958). Although the test did not result in the fission of nuclear materials, it did disseminate plutonium across the land surface. Following the experiment, the AEC fenced the contaminated area and returned control of the surrounding land to the DOD. Various radiological surveys were performed in the area and in 2007, the DOE expanded the demarked Contamination Area (CA) by posting signs 200 to 400 ft (60 to 120 m) outside of the original fence. Plutonium in soil attaches preferentially to smaller particles (Tamura, 1985; Friesen, 1992; Murarik et al., 1992; and Misra et al., 1993). Therefore, redistribution of soil particles by wind (dust) and water are the mechanisms most likely to transport plutonium beyond the boundary of the Project 57 CA. Monitoring was implemented in 2011 by Desert Research Institute (DRI) to determine if radionuclide contamination was detectable in samples of airborne dust and to characterize meteorological and environmental parameters that influence dust transport. Initially, two monitoring stations consisting of radiological, meteorological, and dust sampling equipment were installed near the southeast and northeast corners of the CA. In January 2015, the original monitoring stations were dismantled and moved farther to the west along the CA boundary. This move was made to place the monitoring stations downwind of ground zero and the High Contamination Area (HCA) during the dominant northerly and southerly winds. Samples of particles suspended in the air are collected every two weeks and submitted for laboratory assessments of gross alpha and gross beta radioactivity, and for determinations of gamma-emitting radionuclides. In calendar year (CY) 2017, the mean gross alpha concentration at monitoring station P57-4 was approximately 4.25 times the value at monitoring station P57-3. In CY2015 and CY2016, the difference in mean gross alpha concentration at the two stations was approximately 1.5. The mean gross alpha concentrations at P57-3 and P57-4 were approximately 1.9 and 7.9 times, respectively, the mean gross alpha concentrations at the surrounding Community Environmental Monitoring Program (CEMP) stations. The minimum gross alpha concentrations reported for the Project 57 stations are in the range of the minimum values observed at the CEMP stations. However, maximum gross alpha concentrations are greater than the maximum concentrations observed at the surrounding CEMP stations. Gamma spectroscopy analyses resulted in the detection of seven radionuclides. Except for americium-241 (Am-241), all reported radionuclides occur naturally in the environment. The Am-241 detection by gamma spectroscopy was confirmed by alpha spectroscopy. During each quarter of CY2017, four suspended particulate matter samples were selected for alpha spectroscopy analysis. Two were selected each quarter from the regular biweekly samples collected at each of the two monitoring stations. Of the eight samples from P57-3, one was reported to have plutonium-238 (Pu-238) above the minimum detectable activity (MDA) and five were reported to have plutonium 239/240 (Pu-239/240) above the MDA. Of the eight samples from P57-4, three were reported to have Pu-238 above the MDA and six were reported to have Pu-239/240 above the MDA. Soil material is also transported by saltation, which is a wind driven phenomena that bounces sand-sized soil particles across the land surface because they are too heavy to be suspended in the air. Samples of particles transported by saltation were collected downwind and upwind of the CA at both monitoring stations in May 2017 after a 190-day deployment and again in September 2017 after a 114-day deployment. Mass of the saltation samples was determined after oven drying. The September sample had greater mass than the May sample. The same relationship was observed for the suspended particulate matter samples during periods of saltation sample collection. The difference in the collected mass appears to be because of the amount of soil moisture. Higher soil moisture exerts additional isotopic bonds between soil particles and water molecules, and between water molecules that envelop soil particles, making it more difficult for wind to raise the particles as dust. In general, samples collected from saltation traps facing south contained more material than samples collected from traps facing north. This suggests that although saltation material may have been moving back and forth in conjunction with the two dominant wind directions, there was a net trend for saltation material to be transported toward the north. Radiological analyses of the saltation samples show that the smaller particle size faction (<63 μm) generally produced the highest activity levels of Am-241, Pu-238, and Pu-239/240. In general, the isotope activity levels decreased as the particle size increased. These results are consistent with the expectation that the greatest potential for transport of radiological contamination is with the smaller particles. Thermoluminescent dosimeters (TLDs) indicated that the average annual external radioactivity dose at the monitoring stations is slightly higher than the dose determined at the surrounding CEMP stations, but approximately half of the estimated national average dose received by the general public from exposure to natural sources. The TLDs at the Project 57 monitoring stations are exposed to both natural sources (terrestrial and cosmic) and radioactive releases from the Project 57 CA. Winds in excess of approximately 15 mph (24 km/hr) begin to generate dust movement by saltation or suspension, as determined by the monitoring instruments. Saltated particles, PM10 (i.e., inhalable dust), and PM2.5 (i.e., fine particulate dust) exhibit an approximately exponential increase with increasing wind speed. The greatest concentrations of dust occurred for winds exceeding 20 mph (32 km/hr). When the wind/dust analysis was performed for winds separated into the dominant northerly and southerly wind directions, it was evident that the northerly winds generated the higher PM10 concentrations and had the dominate influence on the PM10 concentration determined for all wind speeds when all wind directions were evaluated together. During the year, winds in excess of 20 mph (32 km/hr) occurred approximately one percent of the time. Although winds sufficient to generate dust occur at the Project 57 site, they are infrequent and of short duration. A preliminary assessment of individual wind events suggests that dust generation in response to specific wind conditions is highly variable. Wind speeds that would be expected to generate noticeable dust may not do so in every instance. Additionally, saltation transport in response to wind conditions was less common than expected. These variations were likely because of the influence of meteorological and environmental parameters other than wind.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2023

A confocal laser-induced fluorescence diagnostic with an annular laser beam

Here, in this work, we report an annular beam confocal laser-induced fluorescence (LIF) configuration, which allows for high spatial resolution measurements of plasma properties in plasma setups and sources with limited optical access. The proposed LIF configuration utilizes the annular laser beam generated by a pair of diffractive axicons. The LIF signal is collected along the main optical axis within the ring region. It is shown experimentally that at a focal distance of 300 mm, a spatial resolution of ~5.3 mm can be achieved. Using geometric optics estimations, we showed that ~1 mm resolution at the same focal distance could potentially be achieved by modifying laser beam parameters. This approaches the localization accuracy of conventional LIF collection methods (with crossing laser beam injection and fluorescence collection optical paths). Measurements of the ion velocity distribution function in an argon plasma using both the confocal LIF with an annular laser beam and conventional LIF demonstrate a satisfactory agreement. The proposed LIF setup has potential applications for diagnostics in various plasma processing equipment and plasma sources, such as hollow cathodes, microplasmas, electric propulsion, etc.

47 OTHER INSTRUMENTATION↗
NASA NTRS1983

Protons from the decay of solar flare neutrons

Fluxes of energetic protons in interplanetary space are observed which are interpreted as the decay products of neutrons generated in a solar flare on 1982 June 3 at 11:42 UT. Because of the particular geometry of this event the spectrum of neutrons escaping from the sun can be constructed with great accuracy in the kinetic energy range 10-100 MeV. The resulting spectrum places stringent constraints on the free parameters used in previously published calculations of neutron production in solar flares. An estimate is made of the diffusion mean free path of charged particles in the interplanetary medium in a new way.

Evenson, P.↗
NASA NTRS1992

A statistical analysis of elevated temperature gravimetric cyclic oxidation data of 36 Ni- and Co-base superalloys based on an oxidation attack parameter

A large body of high temperature cyclic oxidation data generated from tests at NASA Lewis Research Center involving gravimetric/time values for 36 Ni- and Co-base superalloys was reduced to a single attack parameter, K(sub a), for each run. This K(sub a) value was used to rank the cyclic oxidation resistance of each alloy at 1000, 1100, and 1150 C. These K(sub a) values were also used to derive an estimating equation using multiple linear regression involving log(sub 10)K(sub a) as a function of alloy chemistry and test temperature. This estimating equation has a high degree of fit and could be used to predict cyclic oxidation behavior for similar alloys and to design an optimum high strength Ni-base superalloy with maximum high temperature cyclic oxidation resistance. The critical alloy elements found to be beneficial were Al, Cr, and Ta.

Barrett, Charles A.↗
NASA NTRS2018

Predicting the Consequences of MMOD Penetrations on the International Space Station

The threat from micrometeoroid and orbital debris (MMOD) impacts on space vehicles is often quantified in terms of the probability of no penetration (PNP). However, for large spacecraft, especially those with multiple compartments, a penetration may have a number of possible outcomes. The extent of the damage (diameter of hole, crack length or penetration depth), the location of the damage relative to critical equipment or crew, crew response, and even the time of day of the penetration are among the many factors that can affect the outcome. For the International Space Station (ISS), a Monte-Carlo style software code called Manned Spacecraft Crew Survivability (MSCSurv) is used to predict the probability of several outcomes of an MMOD penetration-broadly classified as loss of crew (LOC), crew evacuation (Evac), loss of escape vehicle (LEV), and nominal end of mission (NEOM). By generating large numbers of MMOD impacts (typically in the billions) and tracking the consequences, MSCSurv allows for the inclusion of a large number of parameters and models as well as enabling the consideration of uncertainties in the models and parameters. MSCSurv builds upon the results from NASA's Bumper software (which provides the probability of penetration and critical input data to MSCSurv) to allow analysts to estimate the probability of LOC, Evac, LEV, and NEOM. This paper briefly describes the overall methodology used by NASA to quantify LOC, Evac, LEV, and NEOM with particular emphasis on describing in broad terms how MSCSurv works and its capabilities and most significant models.

Hyde, James↗
NASA NTRS2019

Consequences of MMOD Penetrations on the International Space Station

Risk from micrometeoroid and orbital debris (MMOD) impacts on space vehicles is often quantified in terms of the probability of no penetration (PNP). However, for large spacecraft, especially those with multiple compartments, a penetration may have a number of possible outcomes. The extent of the damage (diameter of hole, crack length or penetration depth), the location of the damage relative to critical equipment or crew, crew response, and even the time of day of the penetration are among the many factors that can affect the outcome. For the International Space Station (ISS), a Monte-Carlo style software code called Manned Spacecraft Crew Survivability (MSCSurv) is used to predict the probability of several outcomes of an MMOD penetration—broadly classified as loss of crew (LOC), crew evacuation (Evac), loss of escape vehicle (LEV), and nominal end of mission (NEOM). By generating large numbers of MMOD impacts (typically in the billions) and tracking the consequences, MSCSurv allows for the inclusion of a large number of parameters and models as well as enabling the consideration of uncertainties in the models and parameters. MSCSurv builds upon the results from NASA’s Bumper software (which provides the probability of penetration and critical input data to MSCSurv) to allow analysts to estimate the probability of LOC, Evac, LEV, and NEOM. This paper provides an overview of the methodology used by NASA to quantify LOC, Evac, LEV, and NEOM with particular emphasis on describing in broad terms how MSCSurv works and its capabilities and most significant models.

Evans, Hilary J.↗
NASA NTRS2020

Sketch-to-Solution: A Case Study in RCS Aerodynamic Interaction

Thanks to recent advances in the fields of anisotropic grid adaptation, error estimation, and geometry modeling, a sketch-to-solution work flow is now possible for viscous computational fluid dynamic (CFD) simulations. With this workflow, a CFD application engineer provides geometry, boundary conditions, and flow parameters; and the sketch-to-solution process yields a CFD simulation through automatic, error-based, grid adaptation. To explore the benefits of this nascent capability, a conventional manual grid generation work flow is compared to this new automatic grid generation work flow for a given engineering question: What are the aerodynamic interactions caused by the reaction control system (RCS) on an entry vehicle? This case study indicates that while the automatic grid generation sketch-to- solution process is not yet mature, it is preferred over a manual grid generation work flow because it greatly reduces manual labor, eliminates many opportunities for human error, and provides grid sensitivity information.

Bill Kleb↗
NASA NTRSDate not supplied

Machine Learning Approach for Aircraft Performance Model Parameter Estimation for Trajectory Prediction Applications

Inaccurate prediction of aircraft trajectory by ground-based decision support tools (DST) is a major concern in air traffic management (ATM). Aircraft trajectory prediction tools rely on a simplified point-mass aircraft performance model (APM) to make their predictions. Even though the performance coefficients and weight of an aircraft are a vital part of the APM’s predictions and accuracy, these coefficients are proprietary in nature and therefore, unavailable to DSTs. Current ATM research focuses on improving the estimate of some APM parameters by freezing all other coefficients. This simplified approach introduces unwanted sources of bias and negatively impacts the accuracy of the performance model. In this paper, we apply machine learning (ML) techniques for the simultaneous prediction of three key APM parameters (two drag coefficients and the initial aircraft weight). To accomplish this, we employ an ordinary differential equation (ODE) fitting approach to generate optimized APM parameter labels customized to each individual flight record. Subsequently, we train ML models to capture the relationship between the historical data and the optimized APM parameters. Two different ML model solutions are applied and APM coefficients are predicted for unseen flights. The results indicate that the ML models are able to capture the relationship between APM parameters and flight-related features with good accuracy.

trajectory prediction, machine learning, aircraft ↗
NASA NTRS2016

Unsteady Aerodynamic Force Sensing from Measured Strain

A simple approach for computing unsteady aerodynamic forces from simulated measured strain data is proposed in this study. First, the deflection and slope of the structure are computed from the unsteady strain using the two-step approach. Velocities and accelerations of the structure are computed using the autoregressive moving average model, on-line parameter estimator, low-pass filter, and a least-squares curve fitting method together with analytical derivatives with respect to time. Finally, aerodynamic forces over the wing are computed using modal aerodynamic influence coefficient matrices, a rational function approximation, and a time-marching algorithm. A cantilevered rectangular wing built and tested at the NASA Langley Research Center (Hampton, Virginia, USA) in 1959 is used to validate the simple approach. Unsteady aerodynamic forces as well as wing deflections, velocities, accelerations, and strains are computed using the CFL3D computational fluid dynamics (CFD) code and an MSC/NASTRAN code (MSC Software Corporation, Newport Beach, California, USA), and these CFL3D-based results are assumed as measured quantities. Based on the measured strains, wing deflections, velocities, accelerations, and aerodynamic forces are computed using the proposed approach. These computed deflections, velocities, accelerations, and unsteady aerodynamic forces are compared with the CFL3D/NASTRAN-based results. In general, computed aerodynamic forces based on the lifting surface theory in subsonic speeds are in good agreement with the target aerodynamic forces generated using CFL3D code with the Euler equation. Excellent aeroelastic responses are obtained even with unsteady strain data under the signal to noise ratio of -9.8dB. The deflections, velocities, and accelerations at each sensor location are independent of structural and aerodynamic models. Therefore, the distributed strain data together with the current proposed approaches can be used as distributed deflection, velocity, and acceleration sensors. This research demonstrates the feasibility of obtaining induced drag and lift forces through the use of distributed sensor technology with measured strain data. An active induced drag control system thus can be designed using the two computed aerodynamic forces, induced drag and lift, to improve the fuel efficiency of an aircraft. Interpolation elements between structural finite element grids and the CFD grids and centroids are successfully incorporated with the unsteady aeroelastic computation scheme. The most critical technology for the success of the proposed approach is the robust on-line parameter estimator, since the least-squares curve fitting method depends heavily on aeroelastic system frequencies and damping factors.

shape sensing↗
DOE OSTI2021

Water transport properties of virtual fractal porous media: Implications for the unsaturated transport properties of cement-based materials

Cement-based materials are more and more recognized as fractal materials. From a practical point of view, fractality means that the pore size distribution can be described using fractal scaling law (i.e. power functions). Here, the simplest scaling law making use of a single fractal dimension was used to generate simple and virtual fractal porous media (based on bundles of parallel cylindrical pores). The capillary curve and permeability (relative and intrinsic) of the virtual porous media were then estimated through theoretical and numerical approaches. The results show that: (1) although bereft of any physical basis, van Genuchten equation bears some fractal information; (2) although highly flexible, van Genuchten equation fails to perfectly fit the capillary curves and can thus generate error in inverse analysis (for intrinsic permeability evaluation) and (3) there seems to be a relation between the intrinsic permeability and van Genuchten pressure parameter.

36 MATERIALS SCIENCE↗
DOE OSTI2018

Using both qualitative and quantitative data in parameter identification for systems biology models

Abstract In systems biology, qualitative data are often generated, but rarely used to parameterize models. We demonstrate an approach in which qualitative and quantitative data can be combined for parameter identification. In this approach, qualitative data are converted into inequality constraints imposed on the outputs of the model. These inequalities are used along with quantitative data points to construct a single scalar objective function that accounts for both datasets. To illustrate the approach, we estimate parameters for a simple model describing Raf activation. We then apply the technique to a more elaborate model characterizing cell cycle regulation in yeast. We incorporate both quantitative time courses (561 data points) and qualitative phenotypes of 119 mutant yeast strains (1647 inequalities) to perform automated identification of 153 model parameters. We quantify parameter uncertainty using a profile likelihood approach. Our results indicate the value of combining qualitative and quantitative data to parameterize systems biology models.

59 BASIC BIOLOGICAL SCIENCES↗
DOE OSTI2020

Reconstruction and uncertainty quantification of lattice Hamiltonian model parameters from observations of microscopic degrees of freedom

The emergence of scanning probe and electron beam imaging techniques has allowed quantitative studies of atomic structure and minute details of electronic and vibrational structure on the level of individual atomic units. These microscopic descriptors, in turn, can be associated with local symmetry breaking phenomena, representing the stochastic manifestation of the underpinning generative physical model. In this work, we explore the reconstruction of exchange integrals in the Hamiltonian for a lattice model with two competing interactions from observations of microscopic degrees of freedom and establish the uncertainties and reliability of such analysis in a broad parameter-temperature space. In contrast to other approaches, we specifically specify a loss function inherent to thermodynamic systems and utilize it to estimate uncertainty in simulated realizations of different models. As an ancillary task, we develop a machine learning approach based on histogram clustering to predict phase diagrams efficiently using a reduced descriptor space. We further demonstrate that reconstruction is possible well above the phase transition and in the regions of parameter space when the macroscopic ground state of the system is poorly defined due to frustrated interactions. This suggests that this approach can be applied to the traditionally complex problems of condensed matter physics such as ferroelectric relaxors and morphotropic phase boundary systems, spin and cluster glasses, and quantum systems once the local descriptors linked to the relevant physical behaviors are known.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗