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DOE OSTI2026

FAIRmaterials: Ontology Tools with Data FAIRification in Development

The bilingual FAIRmaterials package simplifies the creation and visualization of materials and data science ontologies. FAIRmaterials, available in the Python and R languages, addresses the complexities associated with traditional ontology editors based on manual user input such as Protege with an intuitive workflow and easy-to-use templates, making it accessible to users both experienced and inexperienced with ontologies. The FAIRmaterials package is its ability to programatically convert simple and structured CSV inputs into rich, well-defined ontologies. This capability is designed to support the findability, accessibility, interoperability, and reusability (FAIR) of research data and serve as a tool in the process of data FAIRification. Its additional features, such as automated ontology merging, static visualizations, and comprehensive documentation for outputs extend its utility, making it a valuable tool for any researcher engaged in knowledge management.

Bradley, Alexander Harding [Case Western Reserve U↗

DOE OSTI2025

ggtaxplot v 0.0.1

ggtaxplot is an R package designed to process and visualize taxonomic data through a taxonomic river plot. This package is ideal for researchers and data scientists who need to visualize taxonomic data. ggtaxplot function processes data and generates a taxonomic river plot, allowing users to visualize the distribution of taxa across different samples.

Coclet, Clement [Lawrence Berkeley National Labora↗

NASA NTRSDate not supplied

NASA POWER: Providing Present and Future Climate Services Based on NASA Data for the Energy, Agricultural, and Sustainable Buildings Communities

NASA’s Prediction of Worldwide Energy Resource (POWER) project facilitates the use of NASA Earth Science data holdings within the renewable energy, agricultural, and building heating/cooling design industries. POWER packages solar and meteorological data at various temporal levels from several NASA projects in a user friendly GIS-enabled web services system (https://power.larc.nasa.gov). Data users can access these data either through an intuitive data viewer, image services fully integrable with GIS analysis, connections in the cloud through an Amazon Web Services S3 Bucket, or fully customizable access through an API. Data provided by POWER has been successfully used by decision makers to support actions that address climate change. For example, POWER data has been used to remotely monitor solar array fields and integrated in a sizing tool for off-grid solar and storage systems. POWER data has also been coupled with key building decision tools to support design and retrofitting of building energy systems for energy efficiency and reduction of greenhouse gases. POWER is now developing climate services to provide time series of the projected future evolution of key quantities that interest our users, such as heating/cooling degree days, temperature, wind speed, and downwelling solar flux. We demonstrate the potential of the new climate services by presenting here a range of possible future changes in these quantities at different NASA centers across the continental United States. These data services are based on downscaled climate model data from the NASA Earth Exchange Global Daily Downscaled Projections (NEX-GDDP) data set. We highlight the important insights that new climate services can provide. Our climate services will help our user communities quantify the impacts of climate change to support their key decisions in planning for the future, both inside and outside the Federal Government, especially for decisions in renewable energy and in building heating and cooling.

Bradley Hegyi↗

NASA NTRS2003

ISIS Processing Tools for Thermal Emission Spectrometer Data

The Integrated Software for Imagers and Spectrometers (ISIS) package is a widely used planetary data processing and cartography software system produced by the Astrogeology program of the USGS in Flagstaff, AZ. Recent additions to the ISIS system provide useful tools for extracting and projecting Thermal Emission Spectrometer (TES) data for use with other ISIS programs to process, analyze, and visualize these data, particularly in comparison with other Mars data sets. A general overview of various programs and tools used for extracting and processing TES data are presented.

K Becker↗

NASA NTRS1992

Multifrequency data analysis software on STARLINK

Although the STARLINK project was set up to provide image processing facilities to UK astronomers, it has grown over the last 12 years to the extent that it now provides most of the data analysis facilities for UK astronomers. One aspect of the growth of the STARLINK network is that it now has to cater for astronomers working in a diverse range of wavelengths. Since a given individual may be working with data obtained in a variety of wavelengths, it is most convenient if the data can be stored in a common format and the programs that analyze the data have a similar 'look and feel'. What is known as 'STARLINK software' is obtained from many sources: STARLINK funded programmers; astronomers; foreign projects such as AIPS; generally available shareware; and commercial sources when this proves cost effective. This means that the ideal situation of a completely integrated system cannot be realized in practice. Nevertheless, many of the major packages written by STARLINK application programmers and by astronomers do use a common data format, based on the Hierarchical Data System, so that interchange of data between packages designed separately from each other is simply a matter of using the same file names. For example, as astronomer might use KAPPA to read some optical spectra off a FITS tape, then use CCDPACK to debias and flat field the data (it is easy to set up an overnight batch job to do this if there is a lot of data), then use KAPPA to have a quick look at the data and then use Figaro to reduce the spectra. It is useful to divide data analysis packages into wavelength specific packages, or even instrument specific packages, and general purpose ones. Once the instrumental signature has been removed from some data, any appropriate general purpose package can be used to analyze te data. For example, the ASTERIX package deals with x-ray data reduction, but after dealing with all of the x-ray specific processing, an astronomer may well want to find the brightness of objects in a given frame. Since ASTERIX uses the standard STARLINK data format, the astronomer can use PHOTOM or DAOPHOT 2 to measure the brightness of the objects. Although DAOPHOT was written with optical astronomy in mind, it is useful for analyzing data from several wavelengths. The ability of DAOPHOT 2 to handle non-standard point spread functions can be especially useful in many areas of astronomy.

Allan, P. M.↗

NASA NTRS1985

MINDS: A microcomputer interactive data system for 8086-based controllers

A microcomputer interactive data system (MINDS) software package for the 8086 family of microcomputers is described. To enhance program understandability and ease of code maintenance, the software is written in PL/M-86, Intel Corporation's high-level system implementation language. The MINDS software is intended to run in residence with real-time digital control software to provide displays of steady-state and transient data. In addition, the MINDS package provides classic monitor capabilities along with extended provisions for debugging an executing control system. The software uses the CP/M-86 operating system developed by Digital Research, Inc., to provide program load capabilities along with a uniform file structure for data and table storage. Finally, a library of input and output subroutines to be used with consoles equipped with PL/M-86 and assembly language is described.

Soeder, J. F.↗

DOE OSTI2024

Identifying Controlling Variables for Mercury Vapors in Alpha-4 at Y-12: Two Year Data Collection Update

Multiple sensor packages were deployed at Alpha-4 by SRNL, in collaboration with United Cleanup Oak Ridge LLC (UCOR), to monitor mercury vapor concentrations and meteorological parameters. These sensors collected data, inside and outside of the legacy-use facility, for approximately two years. Though data gaps still exist, particularly in colder months, several controlling variables were identified that govern mercury vapor concentrations within Alpha-4. Temperature, barometric pressure gradients, humidity, and wind speed have been identified as controlling variables. A strong positive correlation was seen between mercury vapor concentrations and temperature which generally followed diurnal fluctuations. Temperatures below approximately 10 degrees Celsius did not show any spikes above the PEL, indicating more work can be performed at any time during the winter months – more data should be collected to confirm consistency in this finding. Additionally, spikes in mercury vapor concentrations above that of the permissible exposure limit (PEL; 100 µg/m 3 ) occurred primarily in late afternoon or evening/overnight hours (between 3 PM and 6 AM), which suggests D&D operations might be best scheduled during morning or daytime hours prior to the late afternoon. However, a limited number of spikes did occur outside of the identified window, although this may be attributed to disturbances in air flow and mercury vapor release from work activities performed inside of the Alpha-4 building. The analysis conducted allows for a strong predictive capability for estimating mercury vapor concentrations based upon accurate meteorological parameters. Still, additional data collection, particularly in the winter months, could help to strengthen the predictive power and validate the identified data trends. Further, increased temporal resolution could also help to better characterize the incipient stages of the increases and decreases in the mercury vapor concentration. Continued monitoring support by SRNL at Y-12 is underway at Alpha-4 to further close remaining data gaps and support deactivation and decommissioning work. Within a collaborative effort with UCOR, the SRNL team is collecting mercury vapor data to study the efficacy of a novel mercury suppressant, FerroBlack® which was recently deployed at Alpha-4. In addition, modifications to the current monitoring setup to increase measurement resolution is also being investigated.

54 ENVIRONMENTAL SCIENCES↗

NASA NTRS2008

Data Assimilation Cycling for Weather Analysis

This software package runs the atmospheric model MM5 in data assimilation cycling mode to produce an optimized weather analysis, including the ability to insert or adjust a hurricane vortex. The program runs MM5 through a cycle of short forecasts every three hours where the vortex is adjusted to match the observed hurricane location and storm intensity. This technique adjusts the surrounding environment so that the proper steering current and environmental shear are achieved. MM5cycle uses a Cressman analysis to blend observation into model fields to get a more accurate weather analysis. Quality control of observations is also done in every cycle to remove bad data that may contaminate the analysis. This technique can assimilate and propagate data in time from intermittent and infrequent observations while maintaining the atmospheric field in a dynamically balanced state. The software consists of a C-shell script (MM5cycle.driver) and three FORTRAN programs (splitMM5files.F, comRegrid.F, and insert_vortex.F), and are contained in the pre-processor component of MM5 called "Regridder." The model is first initialized with data from a global model such as the Global Forecast System (GFS), which also provides lateral boundary conditions. These data are separated into single-time files using splitMM5.F. The hurricane vortex is then bogussed in the correct location and with the correct wind field using insert_vortex.F. The modified initial and boundary conditions are then recombined into the model fields using comRegrid.F. The model then makes a three-hour forecast. The three-hour forecast data from MM5 now become the analysis for the next short forecast run, where the vortex will again be adjusted. The process repeats itself until the desired time of analysis is achieved. This code can also assimilate observations if desired.

Tran, Nam↗

NASA NTRS1975

Research study of Beta Cephei variable stars using data from OAO-2

Photometric data from the Wisconsin Experiment package on OAO-2 were obtained for six Beta Cephei variable stars. The data were reduced in accordance with the OAO 2/Wisconsin Experiment Package Photometer Users Guide. For delta Cet and gamma Peg, there were enough data points to form reliable composite light curves at seven or eight ultraviolet wavelengths. The light curves are well represented by sine waves in phase with the blue light curve for each star. The amplitude of the light variation increases with shorter wavelengths. For theta Oph, epsilon Cen, eta Sco, and Lambda Sco, mean magnitudes and light ranges were obtained at several ultraviolet wavelengths. No significant differences were found between the mean, de-reddened ultraviolet colors of the observed stars, and the mean values for standard stars computed by Bottemiller. An attempt to derive a temperature scale from a comparison of the observed ultraviolet colors with Kurucz models was unsuccessful.

Lesh, J. R.↗

DOE OSTI2024

UAS remote sensing (Osprey platform): Red-green-blue (RGB) imagery, thermal infrared (TIR) imagery, and canopy reflectance, Seward Peninsula, Alaska, 2017

Airborne remote sensing data collected using the Brookhaven National Laboratory's (BNL) heavy-lift unoccupied aerial system (UAS) octocopter platform - the Osprey - operated by the Terrestrial Ecosystem Science and Technology (TEST) group (https://www.bnl.gov/testgroup). This package includes raw (L0) data from 14 flights flown over the NGEE-Arctic Council Mile Marker 71 (MM71), Kougarok MM64, and Teller MM 27 sites in August, 2017. The Osprey is a multi-sensor UAS platform that simultaneously measures very high spatial resolution optical red/green/blue (RGB) and thermal infrared (TIR) surface "skin" temperature imagery, as well as near-surface surface reflectance at 1 nm intervals in the visible to near-infrared spectral range from ~350-1000 nm measured at regular intervals along each flight path. This package provides the Level 0 (raw, unprocessed) data collected by the Osprey platform. Ancillary aircraft data, flight mission parameters, and general flight conditions provided by the onboard flight and data collection computers are also included. Data and metadata are provided as text (*.txt, *.json), tabular (*.dat, *.csv, *.waypoint), and image (*.jpg) formats. This metadata documents contain flight campaign, platform, sensor, flight and file metadata, along with a description of the L0 data and the file naming scheme. The Next-Generation Ecosystem Experiments: Arctic (NGEE Arctic), was a 15-year research effort (2012-2027) to reduce uncertainty in Earth System Models by developing a predictive understanding of carbon-rich Arctic ecosystems and feedbacks to climate. NGEE Arctic was supported by the Department of Energy's Office of Biological and Environmental Research. The NGEE Arctic project had two field research sites: 1) located within the Arctic polygonal tundra coastal region on the Barrow Environmental Observatory (BEO) and the North Slope near Utqiagvik (Barrow), Alaska and 2) multiple areas on the discontinuous permafrost region of the Seward Peninsula north of Nome, Alaska. Through observations, experiments, and synthesis with existing datasets, NGEE Arctic provided an enhanced knowledge base for multi-scale modeling and contributed to improved process representation at global pan-Arctic scales within the Department of Energy's Earth system Model (the Energy Exascale Earth System Model, or E3SM), and specifically within the E3SM Land Model component (ELM).

54 ENVIRONMENTAL SCIENCES↗

NASA NTRS1991

Data acquisition and analysis on a Macintosh

The introduction of inexpensive analog-to-digital boards for the Macintosh opens the way for its use in areas that have previously been filled by either specialized, dedicated or more expensive mainframe based systems. Two such Macintosh-based systems are the Acoustic Laboratory Data Acquisition System (ALDAS) and the Jet Calibration and Hover Test Facility (JCAHT) data acquisition system. ALDAS provides an inexpensive, transportable means to digitize four channels at up to 50,000 samples per second and analyze this data. The ALDAS software package was written for use with rotorcraft acoustics and performs automatic acoustic calibration of channels, data display, and various types of data analysis. The program can use data obtained either from internal analog-to-digital conversion or discrete external data imported in ASCII format. All aspects of ALDAS can be improved as new hardware becomes available and new features are introduced into the code. The JCAHT data acquisition system was built as not only an analysis program but also to act as the online safety monitoring system. This paper will provide an overview of these systems.

Watts, Michael E.↗

NASA NTRS1992

Interdisciplinary analysis from the spacecraft thermal analyst's viewpoint

Interdisciplinary analyses performed at the Marshall Space Flight Center based on multidiscipline data flows are reviewed. Particular attention is given to global software packages for allowing efficient interdisciplinary data exchange, the use of a number of smaller individual packages, specific software programs utilized by the various interfacing disciplines to perform calculations in terms of interface compatibility, and tasks based on thermal evaluations integral. Recommendations for improvements in the MSFC equipment, software, and organization are proposed.

Humphries, W. R.↗

NASA NTRS1992

Radar Analysis and Visualization Environment (RAVEN): Software for polarimetric radar analysis

Imaging radar data provides information about the geometric and dielectric properties of the Earth's surface. The Jet Propulsion Laboratory (JPL) polarimetric Airborne Synthetic Aperture Radar (AIRSAR) is currently obtaining imaging radar data for use in geologic, vegetation, snow and ice, and ocean studies. In the near future, the Shuttle Imaging Radar C (SIR-C/X-SAR) and the Earth Observing System Synthetic Aperture Radar (EOS SAR) will also collect polarimetric radar data. A need exists for a user-friendly, interactive software package for analysis of these polarimetric radar data sets. Previous software packages, such as JPL's Multiview, while providing some analysis capabilities for these data, did not allow interactive viewing and were tied to specific image display hardware with operating system dependencies. A prototype software system, the 'Radar Analysis and Visualization Environment' (RAVEN) under development at the Center for the Study of Earth from Space (CSES) at the University of Colorado, is designed to deal with data from the JPL AIRSAR instrument and other proposed polarimetric radar instruments. RAVEN is being developed using the Interactive Data Language (IDL). It takes advantage of high speed disk access and fast processors running under the UNIX operating system in an X-windows environment to allow for rapid, interactive visualization of AIRSAR data in both image and graphical ways. It provides a user-friendly interface through the use of menus, sliders, buttons, and display windows.

Kierein-Young, K. S.↗

NASA NTRS1979

Power Extension Package (PEP) system definition extension, orbital service module systems analysis study. Volume 12: PEP data item descriptions

Contractor information requirements necessary to support the power extension package project of the space shuttle program are specified for the following categories of data: project management; configuration management; systems engineering and test; manufacturing; reliability, quality assurance and safety; logistics; training; and operations.

Source record↗

DOE OSTI2021

Emission Inventories from Natural Gas Storage Facilities using Regional Frequency Comb Laser Monitoring and Aircraft Flyovers. Final Report

The project centers around a ground-based regional methane sensor developed by the CU/NIST team members under the DOE ARPA-E MONITOR program, and sophisticated aircraft measurement techniques developed by the UCD/Scientific Aviation team (responsible for a recent Science publication quantifying the Aliso Canyon storage field release). The dual frequency-comb spectrometer is an invisible, eye-safe laser capable of measuring atmospheric methane concentrations along beam paths 1+ miles in length with high precision and stability (<1 ppb methane over 1 mile). The CU/NIST team has developed a unique approach to using a single, central spectrometer to locate and size methane emissions as small as 6 scfh from specific gas field structures within the 1+ mile range of the laser. Deployment involves the stationing of small cubic mirrors at strategic locations across the gas storage site. The mirrors direct light from the spectrometer back to a detector, where methane concentrations are recorded based on light absorption at specific wavelengths. The measurements are coupled with high resolution gas transport models based on meteorological measurements (wind, etc.) to determine the precise location and emission rate of methane sources. The calibration-free and continuous nature of dual frequency-comb spectrometer measurements means that a large area can be monitored continuously for temporal variability of emissions over long periods of time. The aircraft measurements involve spiral flights around storage facilities with a sensitive ethane/methane measurement package. Upwind/downwind concentration comparisons and wind data provide total facility emissions data. During this project, a new micrometeorological package was integrated onto the Scientific Aviation aircraft to provide even greater emissions quantification capability. In this project, the ground-based measurement system was deployed for 11 months (to capture seasonal variability) at a West Coast storage facility, together with a campaign of twice monthly aircraft total facility emissions flights. The data from these two modalities was combined to quantify the methane emissions from the facility with first-of-its-kind temporal and spatial detail. Concurrent with this deployment, the aircraft team performed flights to quantify emissions at a wider array of previously un-surveyed storage sites. The ground-based measurement system was then moved to an additional site of differing total storage and delivery capacity. Aircraft mass balance flights continued, repeatedly surveying (twice monthly) this site, as well as surveying a large number of previously un-assessed sites spanning a variety of size, reservoir type and age. Assessment of ground-based, temporally and spatially detailed methane emissions information alongside aircraft-derived methane total facility emissions information led to an improved understanding of emissions, relevant for inventories of the natural gas storage sector. In particular, this work provided temporal detail (seasonal of emissions and frequency of leaks) to stakeholders and personnel responsible for updates to the EPA’s GHGI. The impact of the proposed work has been a dramatic improvement in the temporal, spatial, and site- and type- specific detail and quantification of emissions inventories for the natural gas storage sector. This work directly benefits the EPA’s GHGI, directly ameliorates the environmental impacts and public health and safety of the natural gas storage sector, and aids policymakers and industry to make sound choices with respect to management and regulation.

03 NATURAL GAS↗

DOE OSTI2024

AmpSuite

Seismic amplitudes offer vital information about explosion source characteristics, including discrimination and yield estimation. To take advantage of this, we developed an interactive Python package to measure, control data quality, generate broad area propagation models and perform discrimination and estimate yield. Propagation models are essential in support of transportable yield and broad area discrimination. The key benefit of this package will be its ability to continuously integrate data and new techniques. The AmpSuite framework will provide standardized, repeatable, and accurate model generation and characterization routines. The capability is crucial for monitoring agencies tasked with rapid and high-quality seismic event characterization. The AmpSuite software includes a series of independent modules to perform: • Direct Phase Amplitude Measurement and Storage • Coda Envelope Measurement and Storage • Data Quality Control • New Propagation Model Developments • Seismic Discrimination and Analysis • Yield Estimation and supporting utility software. The AmpSuite software provides comprehensive solutions for monitoring agencies seeking to optimize model generation and event analysis within a contemporary Python framework. Stakeholders (AFTAC) have begun to move towards the Python language for scientific analysis as a new workforce emerges.

Alfaro, Richard↗

NASA NTRS2020

Availability of previously lost data and metadata from the Apollo Lunar Surface Experiments Package (ALSEP)

Fourteen types of geophysical instruments deployed at the Apollo 12, 14, 15, 16, and 17 sites by the astronauts for long-term observation were collectively called the Apollo Lunar Surface Experiments Package (ALSEP). These instruments were active from the times of their deployment (November 1969–December 1972) to September 1977. At the conclusion of the experiments, the raw instrument data received from the Moon prior to March 1976 were left unarchived. Portions of the data processed by the principal investigators (PIs) of these experiments had been archived at the NASA Space Science Data Coordinated Archive (NSSDCA) in various formats. The unarchived data, residing then on open-reel magnetic tapes, became lost in the decades since, along with much of the metadata (the supporting documents for these data). We have recently recovered 440 of the previously lost tapes, containing raw ALSEP instrument data from April through June of 1975. Here we describe the data extracted from these tapes and summarize the data products generated for archiving at the NASA Planetary Data System (PDS) and NSSDCA, along with their historical narrative. In addition, we have reformatted many of the datasets delivered to NSSDCA by the PIs in the 1970s for archiving at the PDS. Finally, we have compiled an online searchable repository of ALSEP-related documents by optically scanning tens of thousands of pages of them kept at the Lunar and Planetary Institute in Texas.

S. Nagihara↗

DOE OSTI2023

Training material models using gradient descent algorithms

High temperature design requires accurate constitutive models to describe material inelastic deformation and failure behavior. Oftentimes, calibrating accurate models devolves into the problem of fitting the model parameters against experimental test data. Here, we present the pyopmat package, an open source framework for calibrating constitutive models against experiment data subjected to various loading conditions using machine learning techniques. The package calculates the exact gradient of the model response with respect to the parameters using a combination of automatic differentiation and the adjoint method. Given this exact gradient, we compare the performance of several gradient-based optimization techniques in fitting realistic constitutive models against data. Here, we demonstrate the efficiency and accuracy of our package through example problems using both synthetic data, generated using known parameter sets, under monotonic and cyclic loading conditions and also with an example applying the techniques developed here to actual high temperature creep-fatigue test data.

36 MATERIALS SCIENCE↗