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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 577 records · Page 32

Global models of Ne and Te at solar maximum based on DE-2 measurements

Newly developed global models of the electron density of (Ne) and (Te) in the F-region at solar maximum, based on Langmuir probe measurements from the Dynamics Explorer-2 satellite, are compared with solar minimum models that were developed earlier from Atmosphere Explorer data. Spherical harmonics are used in both models to describe the variations with geomagnetic latitude and local time, but the solar maximum model also includes longitudinal variations. The solar minimum models were for the fixed altitudes of 300 km and 400 km, while the solar maximum model covers all altitudes between 300 and 1000 km. In this paper, the global patterns of Ne and Te at 400 km at solar maximum and minimum are compared with the IRI model for the corresponding parts of the solar cycle. In most respects, the IRI model describes the empirical models quite well at both solar maximum and solar minimum.

Brace, L. H.↗

Composite Loads Spectra for Select Space Propulsion Structural Components: Probabilistic Load Model Development

This effort is in support of the development of the expert system of computer codes to predict the loads on select structural components of a space propulsion engine. The development will be based primarily on the space shuttle main engine (SSME) test data base. Because of random variations of the many different sources of the loadings on the selected structural components and transients, a probabilistic approach to the problems was adopted. The goal of this task is to characterize all of the individual sources of loads at critical structural locations, such as the turbine blades, the transfer ducts, and liquid oxygen posts, using state-of-the-art probabilistic methods with varying levels of sophistication. The second phase of this work is the development of a composite load model based on a probabilistic synthesis of the individual load model previously developed. This model will be based on the stochastic combination of the load variables and not on the physical process for the combination of the individual loads to the composite load seen by the selected structural components.

Kurth, R.↗

AI-based language models powering drug discovery and development

The discovery and development of new medicines is expensive, time-consuming, and often inefficient, with many failures along the way. Powered by artificial intelligence (AI), language models (LMs) have changed the landscape of natural language processing (NLP), offering possibilities to transform treatment development more effectively. Here, we summarize advances in AI-powered LMs and their potential to aid drug discovery and development. We highlight opportunities for AI-powered LMs in target identification, clinical design, regulatory decision-making, and pharmacovigilance. We specifically emphasize the potential role of AI-powered LMs for developing new treatments for Coronavirus 2019 (COVID-19) strategies, including drug repurposing, which can be extrapolated to other infectious diseases that have the potential to cause pandemics. Finally, we set out the remaining challenges and propose possible solutions for improvement.

60 APPLIED LIFE SCIENCES↗

Multi-reward reinforcement learning based development of inter-atomic potential models for silica

Abstract Silica is an abundant and technologically attractive material. Due to the structural complexities of silica polymorphs coupled with subtle differences in Si–O bonding characteristics, the development of accurate models to predict the structure, energetics and properties of silica polymorphs remain challenging. Current models for silica range from computationally efficient Buckingham formalisms (BKS, CHIK, Soules) to reactive (ReaxFF) and more recent machine-learned potentials that are flexible but computationally costly. Here, we introduce an improved formalism and parameterization of BKS model via a multireward reinforcement learning (RL) using an experimental training dataset. Our model concurrently captures the structure, energetics, density, equation of state, and elastic constants of quartz (equilibrium) as well as 20 other metastable silica polymorphs. We also assess its ability in capturing amorphous properties and highlight the limitations of the BKS-type functional forms in simultaneously capturing crystal and amorphous properties. We demonstrate ways to improve model flexibility and introduce a flexible formalism, machine-learned ML-BKS, that outperforms existing empirical models and is on-par with the recently developed 50 to 100 times more expensive Gaussian approximation potential (GAP) in capturing the experimental structure and properties of silica polymorphs and amorphous silica.

36 MATERIALS SCIENCE↗

An Entropy-Based Test and Development Framework for Uncertainty Modeling in Level-Set Visualizations

We present a simple comparative framework for testing and developing uncertainty modeling in uncertain marching cubes implementations. The selection of a model to represent the probability distribution of uncertain values directly influences the memory use, run time, and accuracy of an uncertainty visualization algorithm. We use an entropy calculation directly on ensemble data to establish an expected result and then compare the entropy from various probability models, including uniform, Gaussian, histogram, and quantile models. Our results verify that models matching the distribution of the ensemble indeed match the entropy. We further show that fewer bins in nonparametric histogram models are more effective whereas large numbers of bins in quantile models approach data accuracy.

Sisneros, Robert↗

A GPU-Accelerated Population Generation, Sorting, and Mutation Kernel for an Optimization-Based Causal Inference Model

We develop a GPU-accelerated machine learning generative adversarial network model that can be used with observational data for the purpose of constructing causal inferences. The theoretical basis of our machine learning model is novel and is conceptualized to be operable and scalable for high performance computing platforms. Our GPU-accelerated code enables large-scale parallelization of the computation within a common and accessible computing environment. This will expand the reach of our model and empower research in new substantive domains while maintaining the underlying theoretical properties.

Cho, Wendy K. Tam↗

Infiltration Time Profiles for E-Area LLWF Intact and Subsidence Scenarios

To support future Unreviewed Disposal Question Evaluations (UDQEs), Special Analyses (SAs) and/or Performance Assessments (PAs) for the E-Area Low-Level Waste Facility (LLWF) at the Savannah River Site (SRS), the Hydrologic Evaluation of Landfill Performance (HELP) model and a newly developed, Python-based, probabilistic model employing a Monte Carlo sampling technique were used together to generate infiltration degradation curves over a 10,000-year simulation period for both intact and subsided slit- and engineered-trench closure-cap scenarios. The results will be used in PORFLOW transport model simulations of the E-Area LLWF trench units.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

Hadron star models

The properties of fully relativistic rotating hadron star models are discussed using models based on recently developed equations of state. All of these stable neutron star models are bound with binding energies as high as about 25%. During hadron star formation, much of this energy will be released. The consequences, resulting from the release of this energy, are examined.

Cohen, J. M.↗

Molecular beam mass spectrometer development

An analytical model, based on the kinetics theory of a drifting Maxwellian gas is used to determine the nonequilibrium molecular density distribution within a hemispherical shell open aft with its axis parallel to its velocity. The concept of a molecular shield in terrestrial orbit above 200 km is also analyzed using the kinetic theory of a drifting Maxwellian gas. Data are presented for the components of the gas density within the shield due to the free stream atmosphere, outgassing from the shield and enclosed experiments, and atmospheric gas scattered off a shield orbiter system. A description is given of a FORTRAN program for computating the three dimensional transition flow regime past the space shuttle orbiter that employs the Monte Carlo simulation method to model real flow by some thousands of simulated molecules.

Brock, F. J.↗

Developing an Aircraft-Based Angular Distribution Model of Solar Reflection from Wildfire Smoke to Aid Satellite-Based Radiative Flux Estimation

This study examines the angular distribution of scattered solar radiation associated with wildfire smoke aerosols observed over boreal forests in Canada during the ARCTAS (Arctic Research of the Composition of the Troposphere from Aircraft and Satellites) campaign. First, it estimates smoke radiative parameters (550 nm optical depth of 3.9 and single scattering albedo of 0.90) using quasi-simultaneous multiangular and multispectral airborne measurements by the Cloud Absorption Radiometer (CAR). Next, the paper estimates the broadband top-of-atmosphere radiances that a satellite instrument such as the Clouds and the Earth’s Radiant Energy System (CERES) could have observed, given the narrowband CAR measurements made from an aircraft circling about a kilometer above the smoke layer. This estimation includes both an atmospheric correction that accounts for the atmosphere above the aircraft and a narrowband-to-broadband conversion. The angular distribution of estimated radiances is found to be substantially different than the angular model used in the operational data processing of CERES observations over the same area. This is because the CERES model is a monthly average model that was constructed using observations taken under smoke-free conditions. Finally, a sensitivity analysis shows that the estimated angular distribution remains accurate for a fairly wide range of smoke and underlying surface parameters. Overall, results from this work suggest that airborne CAR measurements can bring some substantial improvements in the accuracy of satellite-based radiative flux estimates.

Varnai, Tamas↗

Mars 2020 Site-Specific Mission Performance Analysis: 1. Science exploration and sol type modeling

We developed a scenario-based mission performance model for the Mars 2020 Rover to help identify project-wide productivity and operability challenges and opportunities. We have modeled science exploration combining high-fidelity resource modeling, science strategies, and modular science activity scenarios. This is proving to be an effective way of incorporating science activities into an engineering-based performance model.

Ono, Masahiro↗

Active/Passive Remote Sensing of a Mature Soybean Canopy at L-band

This paper reports on development of a scattering model of a soybean canopies at L-band. The scattering model will be used for active and passive remote sensing of soybean plants with an emphasis on mature soybeans where the presence of pods is important to the observed microwave signal. The active problem is treated using the Distorted Born Approximation (DBA) and the passive problem is analyzed using Peake's method. These results are compared with field measurements made in 2012 by the truck-mounted ComRAD system, which is a combined radar and radiometer instrument operating at L-band. Investigation of backscatter from the soybean canopy shows good agreement between the radar measurement data and modeling results. The results also indicate that the L-band radar backscatter can be used to monitor both the soil moisture and the growth of the soybean pods. Past passive modeling efforts have not considered soybeans late in the growing season when pods are important. A new passive radiation model of soybean canopy will be developed based on the backscatter model.

Yiwen Zhou↗