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All sourcesNASA NTRSDOE OSTI
NASA NTRSDate not supplied

Multi-Decadal Nitrogen Dioxide and Derived Products from Satellites (MINDS) Datasets Released by NASA GES DISC and Their Applications for Air Quality

Nitrogen dioxide (NO2), a pervasive air pollutant, comes from vehicles, power plants, industrial emissions, and off-road sources such as construction or lawn and gardening equipment. The NASA Goddard Earth Sciences Data and Information Services Center (GES DISC) curates many remote sensing datasets with NO2 retrievals, which have been utilized for air quality research and applications. The remotely-sensed datasets include those generated by the Ozone Monitoring Instrument (OMI) on the Aura satellite, the TROPOspheric Monitoring Instrument (TROPOMI) onboard the Copernicus Sentinel-5 Precursor (S5P), and the Ozone Mapping and Profiling Suite (OMPS) Nadir-Mapper (NM) instrument on the Suomi National Polar-orbiting Partnership (S- NPP). In collaboration with the NASA Making Earth System Data Records for Use in Research Environments (MEaSUREs) Multi-Decadal Nitrogen Dioxide and Derived Products from Satellites (MINDS) project, the GES DISC recently released MINDS datasets. The NASA MEaSUREs MINDS project aims to develop long-term NO2 global data records by adapting a consistent retrieval algorithm to multiple instrument measurements. Long-term data records will be achieved by applying consistent retrieval approaches to multiple satellite instruments, including OMI (2004 - ); the Global Ozone Monitoring Experiment (GOME, 1995-2011) onboard the second European Remote Sensing satellite (ERS-2); the Scanning Imaging Spectrometer for Atmospheric Cartography (SCIAMACHY, 2002-2012) onboard the ENVIronmental SATellite (ENVISAT); GOME-2 on the Meteorological Operational satellites (MetOp-A and MetOp-B, 2006 - ); and TROPOMI onboard the Copernicus S5P (2017 - ). The long-term record (1995 to present) of MINDS datasets makes them very useful for air quality trend studies. Some MINDS datasets with high spatial resolution of only a few kilometers can be used for air quality research and applications at regional scales. In this presentation, we will introduce all of the MINDS products and services, and demonstrate use cases of MINDS data for studying air quality. We will also present a few other NO2 datasets acquired from NASA’s Health and Air Quality Applied Sciences Team (HAQAST), to be archived and distributed by the GES DISC, and highlight some of their applications for air quality and health.

Feng Ding↗
DOE OSTI2026

Hurricane wind field representation shapes storm surge and building-scale flood hazard estimates

Coastal flood hazard estimates rely on precise hurricane wind forecasts to assess damage and risk. Here, we demonstrate that errors in hurricane wind field representation can lead to significant biases in storm surge and property-level damage estimates. Using Hurricane Ian (2022) as a case study, we compare widely used parametric, reanalysis, and hybrid wind datasets. Improved wind field accuracy reduces storm surge and damage estimate bias by up to 70\%. Our results underscore the importance of accurately predicting hurricane wind structure in hazard assessments.

Coastal Flooding↗
DOE OSTI2025

A machine learning method of modern urban building energy modeling: A case study of Chicago

Urban-scale building energy modeling is vital for urban planning. However, it can be challenging to assimilate reliable non-geometry building data for urban-scale modeling without extensive investment. Here, this study introduces a novel approach to developing modern urban-scale building energy stock data using geographic information systems and machine learning algorithms without necessarily requiring pre-supplied non-geometric metadata. The proposed framework integrates building footprint and height data to estimate gross floor areas, and matches each building to a pool of candidate records from ComStock or ResStock—filtered to the same county and ranked by geometric similarity—demonstrate a proof-of-concept case study in Chicago for predicting energy use intensity (EUI) using scalable datasets. The model achieved a mean bias error (MBE) of 0.08 kWh/m² and root mean square error (RMSE) of 14.84 kWh/m² under full metadata input for EUI prediction. With only location inputs, the model captured 69.2 % of EUI within predicted ranges. These results demonstrate the model’s potential to support early-stage urban planning, identify candidates for energy-efficient retrofits. By removing the dependency on detailed pre-surveys or extensive building metadata, the approach overcomes a key barrier in traditional urban-scale building energy modeling, illustrating a pathway toward broader and more cost-effective application, though further multi-city validation and improved treatment of pre-1925 buildings are needed.

Energy Use Intensity↗
NASA NTRS2005

Urban Landscape Characterization Using Remote Sensing Data For Input into Air Quality Modeling

The urban landscape is inherently complex and this complexity is not adequately captured in air quality models that are used to assess whether urban areas are in attainment of EPA air quality standards, particularly for ground level ozone. This inadequacy of air quality models to sufficiently respond to the heterogeneous nature of the urban landscape can impact how well these models predict ozone pollutant levels over metropolitan areas and ultimately, whether cities exceed EPA ozone air quality standards. We are exploring the utility of high-resolution remote sensing data and urban growth projections as improved inputs to meteorological and air quality models focusing on the Atlanta, Georgia metropolitan area as a case study. The National Land Cover Dataset at 30m resolution is being used as the land use/land cover input and aggregated to the 4km scale for the MM5 mesoscale meteorological model and the Community Multiscale Air Quality (CMAQ) modeling schemes. Use of these data have been found to better characterize low density/suburban development as compared with USGS 1 km land use/land cover data that have traditionally been used in modeling. Air quality prediction for future scenarios to 2030 is being facilitated by land use projections using a spatial growth model. Land use projections were developed using the 2030 Regional Transportation Plan developed by the Atlanta Regional Commission. This allows the State Environmental Protection agency to evaluate how these transportation plans will affect future air quality.

Quattrochi, Dale A.↗
NASA NTRSDate not supplied

The NASA Merra-2 Reanalysis Products: Data and Tools Used for Aerosol and Air Quality Studies

The NASA Modern-Era Retrospective analysis for Research and Applications Version 2 (MERRA-2) is atmospheric reanalysis data spanning 1980 to present. It has been produced by the NASA Global Modeling and Assimilation Office (GMAO) and is distributed by the NASA Goddard Earth Sciences Data and Information Services Center (GES DISC). MERRA-2 data includes 100 collections of Earth system variables, mainly from the atmospheric model, such as aerosol fields and meteorological fields, radiation fields, and aerosol fields, guided by the assimilation of as many as six million observations every six hours. MERRA-2 has been one of the most popular datasets from NASA and is widely used in interdisciplinary research and applications, with increasing numbers of new users. For example, at least 7000 users accessed MERRA-2 data at GES DISC in the year 2021, ~1000 more users than in the year 2020. In this presentation, we will introduce the MERRA-2 datasets associated with aerosol and air quality studies and use a wildfire case study to demonstrate the data tools developed at GES DISC to analyze and visualize MERRA-2 data, such as Giovanni and the level 3 and level 4 subsetter, and Jupyter Python notebook. We will also update the status of cloud migration of the MERRA-2 data to Amazon Web Services (AWS).

Xiaohua Pan↗
DOE OSTI2025

PowerModel-AI: A First On-the-Fly Machine-Learning Predictor for AC Power Flow Solutions

The real-time creation of machine-learning models via active or on-the-fly learning has attracted considerable interest across various scientific and engineering disciplines. These algorithms enable machines to build models autonomously while remaining operational. Through a series of query strategies, the machine can evaluate whether newly encountered data fall outside the scope of the existing training set. In this study, we introduce PowerModel-AI, an end-to-end machine learning software designed to accurately predict AC power flow solutions. We present detailed justifications for our model design choices and demonstrate that selecting the right input features effectively captures load flow decoupling inherent in power flow equations. Our approach incorporates on-the-fly learning, where power flow calculations are initiated only when the machine detects a need to improve the dataset in regions where the model’s suboptimal performance is based on specific criteria. Otherwise, the existing model is used for power flow predictions. This study includes analyses of five Texas A&M synthetic power grid cases, encompassing the 14-, 30-, 37-, 200-, and 500-bus systems. The training and test datasets were generated using PowerModels.jl, an open-source power flow solver/optimizer developed at Los Alamos National Laboratory, NM, USA.

24 POWER TRANSMISSION AND DISTRIBUTION↗
DOE OSTI2022

A Framework to Analyze the Requirements of a Multiport Megawatt-Level Charging Station for Heavy-Duty Electric Vehicles

Widespread adoption of heavy-duty (HD) electric vehicles (EVs) will soon necessitate the use of megawatt (MW)-scale charging stations to charge high-capacity HD EV battery packs. Such a station design needs to anticipate possible station traffic, average and peak power demand, and charging/wait time targets to improve throughput and maximize revenue-generating operations. High-power direct current charging is an attractive candidate for MW-scale charging stations at the time of this study, but there are no precedents for such a station design for HD vehicles. We present a modeling and data analysis framework to elucidate the dependencies of a MW-scale station operation on vehicle traffic data and station design parameters and how that impacts vehicle electrification. This framework integrates an agent-based charging station model with vehicle schedules obtained through real-world vehicle telemetry data analysis to explore the station design and operation space. A case study applies this framework to a Class 8 vehicle telemetry dataset and uses Monte Carlo simulations to explore various design considerations for MW-scale charging stations and EV battery technologies. The results show a direct correlation between optimal charging station placement and major traffic corridors such as cities with ports, e.g., Los Angeles and Oakland. Corresponding parametric sweeps reveal that while good quality of service can be achieved with a mix of 1.2-megawatt and 100-kilowatt chargers, the resultant fast charging time of 35–40 min will need higher charging power to reach parity with refueling times.

33 ADVANCED PROPULSION SYSTEMS↗
NASA NTRS2012

Evaluating the Impacts of NASA/SPoRT Daily Greenness Vegetation Fraction on Land Surface Model and Numerical Weather Forecasts

The NASA Short-term Prediction Research and Transition (SPoRT) Center has developed a Greenness Vegetation Fraction (GVF) dataset, which is updated daily using swaths of Normalized Difference Vegetation Index data from the Moderate Resolution Imaging Spectroradiometer (MODIS) data aboard the NASA EOS Aqua and Terra satellites. NASA SPoRT began generating daily real-time GVF composites at 1-km resolution over the Continental United States (CONUS) on 1 June 2010. The purpose of this study is to compare the National Centers for Environmental Prediction (NCEP) climatology GVF product (currently used in operational weather models) to the SPoRT-MODIS GVF during June to October 2010. The NASA Land Information System (LIS) was employed to study the impacts of the SPoRT-MODIS GVF dataset on a land surface model (LSM) apart from a full numerical weather prediction (NWP) model. For the 2010 warm season, the SPoRT GVF in the western portion of the CONUS was generally higher than the NCEP climatology. The eastern CONUS GVF had variations both above and below the climatology during the period of study. These variations in GVF led to direct impacts on the rates of heating and evaporation from the land surface. In the West, higher latent heat fluxes prevailed, which enhanced the rates of evapotranspiration and soil moisture depletion in the LSM. By late Summer and Autumn, both the average sensible and latent heat fluxes increased in the West as a result of the more rapid soil drying and higher coverage of GVF. The impacts of the SPoRT GVF dataset on NWP was also examined for a single severe weather case study using the Weather Research and Forecasting (WRF) model. Two separate coupled LIS/WRF model simulations were made for the 17 July 2010 severe weather event in the Upper Midwest using the NCEP and SPoRT GVFs, with all other model parameters remaining the same. Based on the sensitivity results, regions with higher GVF in the SPoRT model runs had higher evapotranspiration and lower direct surface heating, which typically resulted in lower (higher) predicted 2-m temperatures (2-m dewpoint temperatures). Portions of the Northern Plains states experienced substantial increases in convective available potential energy as a result of the higher SPoRT/MODIS GVFs. These differences produced subtle yet quantifiable differences in the simulated convective precipitation systems for this event.

Bell, Jordan R.↗
NASA NTRS2022

VESIcal: A Critical Approach to Volatile Solubility Modelling Using the Open-Source Engine Vesical

Accurate models of H(2)O and CO(2) solubility in silicate melts are vital for understanding volcanic plumbing systems. These models are used to estimate the depths of magma storage regions from melt inclusion volatile contents, investigate the role of volatile exsolution as a driver of volcanic eruptions, and track the degassing path followed by a magma ascending to the surface. However, despite the large increase in the number of experimental constraints over the last two decades, many recent studies still utilize an earlier generation of models which were calibrated on experimental datasets with restricted compositional ranges. This may be because many of the available tools for more recent models require large numbers of input parameters to be hand-typed (e.g., temperature, concentrations of H(2)O, CO(2), and 8–14 oxides), making them difficult to implement on large datasets. Here, we use a new open-source Python3 tool, VESIcal, to critically evaluate the behaviors and sensitivities of different solubility models for a range of melt compositions. Using literature datasets of andesitic-dacitic experimental products and melt inclusions as case studies, we illustrate the importance of evaluating the calibration dataset of each model. Finally, we highlight the limitations of particular data presentation methods, such as isobar diagrams, and provide suggestions for alternatives, and best practices regarding the presentation and archiving of data. This review will aid the selection of the most applicable solubility model for different melt compositions, and identifies areas where additional experimental constraints on volatile solubility are required.

magma↗
DOE OSTI2023

Design and Development of a High Fidelity Cyber-Physical Testbed

In order to ensure that future critical infrastructure systems are resilient to various types of such advanced and persistent threats, it is important to develop and integrate tailored solutions that holistically address cyber-attack detection and mitigation in a timely manner such that adverse system impacts that impact a large population are avoided. Further, it is essential to create environments that allow control, protection and communication to exist within a realistic environment to analyze the effects of adverse conditions and system operating modes. This project aims to establish a high-fidelity testbed environment for modeling and simulating a single microgrid all the way up to a network of microgrids along with baseline controls, protection, and associated cyber communication. This is an important activity because accurately modeling and simulating the various power-electronics-based DERs and loads in a microgrid is critical to adequately capturing their behaviors over a wide range of off-normal conditions, as well as to evaluate the resilience of the system using the developed controls. The work presented in this report focuses on the process of building this high-fidelity testbed and the associated experimentation it enables. The model enables the creation of high-fidelity use cases and associated datasets that have been used extensively within the initiative to study resilience and support novel control development and prototyping. The work heavily leverages existing capability that is part of the high-fidelity cyber-physical system experimentation lab to create a power hardware-in-the-loop setup. The report also details the creation of an automated model building platform that can enable high-fidelity real-time models to be built without much effort allowing existing low-fidelity models to be analyzed in higher fidelity. Lastly, the report also discusses efforts center around scaling to large complex power system models to make the experimentation more effective.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2023

Large-scale analysis of structural brain asymmetries in schizophrenia via the ENIGMA consortium

Left–right asymmetry is an important organizing feature of the healthy brain that may be altered in schizophrenia, but most studies have used relatively small samples and heterogeneous approaches, resulting in equivocal findings. We carried out the largest case–control study of structural brain asymmetries in schizophrenia, with MRI data from 5,080 affected individuals and 6,015 controls across 46 datasets, using a single image analysis protocol. Asymmetry indexes were calculated for global and regional cortical thickness, surface area, and subcortical volume measures. Differences of asymmetry were calculated between affected individuals and controls per dataset, and effect sizes were meta-analyzed across datasets. Small average case–control differences were observed for thickness asymmetries of the rostral anterior cingulate and the middle temporal gyrus, both driven by thinner left-hemispheric cortices in schizophrenia. Analyses of these asymmetries with respect to the use of antipsychotic medication and other clinical variables did not show any significant associations. Assessment of age- and sex-specific effects revealed a stronger average leftward asymmetry of pallidum volume between older cases and controls. Case–control differences in a multivariate context were assessed in a subset of the data (N = 2,029), which revealed that 7% of the variance across all structural asymmetries was explained by case–control status. Subtle case–control differences of brain macrostructural asymmetry may reflect differences at the molecular, cytoarchitectonic, or circuit levels that have functional relevance for the disorder. Reduced left middle temporal cortical thickness is consistent with altered left-hemisphere language network organization in schizophrenia.

60 APPLIED LIFE SCIENCES↗
DOE OSTI2022

Enhanced descriptor identification and mechanism understanding for catalytic activity using a data-driven framework: revealing the importance of interactions between elementary steps

We report accurate identification of descriptors for catalytic activities has long been essential to the in-depth understanding of catalysis and recently to set the basis for catalyst screening. However, commonly used methods suffer from low accuracy in predictability. This study reports an enhanced approach to accurately identify the descriptors from a kinetic dataset using a machine learning (ML) surrogate model. CO hydrogenation to methanol over Cu-based catalysts was taken as a case study. Our model captures not only the contribution from individual elementary steps but also the interaction between relevant steps within a reaction network, which was found to be essential for high accuracy. As a result, six effective descriptors are identified, which are accurate enough to ensure the trained gradient boosted regression (GBR) model for good prediction of the methanol turnover frequency (TOF) over metal (M)-doped Cu(111) model surfaces (M = Au, Cu, Pd, Pt, Ni). More importantly, going beyond the purely mathematical ML model, the catalytic role of each identified descriptor can be revealed by using model-agnostic interpretation tools, which enhances the insight into the promoting effect of alloying. The trained GBR model outperforms the conventional derivative-based methods in terms of both the predictability and the mechanism understanding. It opens alternative possibilities toward accurate descriptor-based rational catalyst optimization.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2020

Improvements to CTF Closure Models for Modelling of Two-Phase Flow

This report documents the efforts to improve the CTF prediction of void fraction and two-phase pressure drop by improving two-phase closure models. Previous validation activities have revealed that CTF tends to overpredict void fraction and two-phase pressure drop. In response to this, two approaches were taken to improve CTF’s predictive capabilities. Based on findings that the interfacial drag and subcooled boiling models significantly impact void prediction, alternative closure models for these physical effects were found and implemented into the code. An extensive assessment was performed by using the existing and newly added two-phase experimental data, which showed that void prediction, wall temperature, and two-phase pressure-drop results are improved by using the newly implemented models. A second approach for improving CTF modeling accuracy involved the use of a Bayesian calibration process that uses CTF validation data to optimize selected modeling coefficients and closure model multipliers to achieve a more accurate prediction of experimental results. A similar assessment was performed with calibrated models that improved the void and pressure-drop prediction for test cases that were both included and not included in the calibration dataset. Results of this study will be used to change the models used in CTF to achieve more accurate BWR analyses moving forward. This study also identified opportunities for improving additional closure models and other opportunities to use calibration techniques to improve CTF.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗
DOE OSTI2023

Comprehensive analysis of common polymers using hyphenated TGA-FTIR-GC/MS and Raman spectroscopy towards a database for micro- and nanoplastics identification, characterization, and quantitation

Environmental contamination by micro- and nanoplastics (MNPs) is well documented with potential for their increased accumulation globally. Growing public concern over environmental, ecological, and human exposure to MNPs has led to exponential increase in publications, news articles, and reports. Significant knowledge gap exists in standardized analytical methods for the identification and quantification of MNPs from real world environmental samples. Here, in this study, we report comprehensive datasets utilizing thermogravimetric analyzer (TGA) coupled to a Fourier transformed infrared spectrometer (FTIR) and a gas chromatography/mass spectrometer (GC/MS) with corresponding Raman spectral data for the most common polymers documented to be present in the environment (35 plastics of 12 polymer types), to serve as a base line reference for the identification and quantitation of MNPs. Various parameters for TGA-FTIR-GC/MS data acquisition were optimized. Commercial consumer plastic product compositions were identified using this analytical database. Case studies to showcase the utility of the method for polymer mixtures analysis is included. This dataset would serve towards the development of a collaborative, global, comprehensive, and curated public database for the identification of various MNPs and mixtures.

77 NANOSCIENCE AND NANOTECHNOLOGY↗
DOE OSTI2024

UNNT: A novel Utility for comparing Neural Net and Tree-based models

The use of deep learning (DL) is steadily gaining traction in scientific challenges such as cancer research. Advances in enhanced data generation, machine learning algorithms, and compute infrastructure have led to an acceleration in the use of deep learning in various domains of cancer research such as drug response problems. In our study, we explored tree-based models to improve the accuracy of a single drug response model and demonstrate that tree-based models such as XGBoost (eXtreme Gradient Boosting) have advantages over deep learning models, such as a convolutional neural network (CNN), for single drug response problems. However, comparing models is not a trivial task. To make training and comparing CNNs and XGBoost more accessible to users, we developed an open-source library called UNNT (A novel Utility for comparing Neural Net and Tree-based models). The case studies, in this manuscript, focus on cancer drug response datasets however the application can be used on datasets from other domains, such as chemistry.

59 BASIC BIOLOGICAL SCIENCES↗
DOE OSTI2024

Machine learning-enabled computer vision for plant phenotyping: a primer on AI/ML and a case study on stomatal patterning

Abstract Artificial intelligence and machine learning (AI/ML) can be used to automatically analyze large image datasets. One valuable application of this approach is estimation of plant trait data contained within images. Here we review 39 papers that describe the development and/or application of such models for estimation of stomatal traits from epidermal micrographs. In doing so, we hope to provide plant biologists with a foundational understanding of AI/ML and summarize the current capabilities and limitations of published tools. While most models show human-level performance for stomatal density (SD) quantification at superhuman speed, they are often likely to be limited in how broadly they can be applied across phenotypic diversity associated with genetic, environmental, or developmental variation. Other models can make predictions across greater phenotypic diversity and/or additional stomatal/epidermal traits, but require significantly greater time investment to generate ground-truth data. We discuss the challenges and opportunities presented by AI/ML-enabled computer vision analysis, and make recommendations for future work to advance accelerated stomatal phenotyping.

Plant Sciences↗
DOE OSTI2022

Analysis of Energy Justice and Equity Impacts from Replacing Peaker Plants with Energy Storage

Transitions to low-carbon energy systems are essential to mitigating and adapting to climate change. Energy storage systems are a key component in achieving a viable decarbonized electric grid. However, decarbonization alone does not guarantee a fairer, more inclusive, or socially just energy system. Energy equity and justice should be integrated in energy system transitions to ensure benefits and burdens are shared equitably. In this paper, we discuss the relationship between energy storage and social equity by assessing the use of energy storage to replace natural gas-fired (NG) peaker plants. Peaker plants are disproportionately located near disadvantaged communities and tend to be older and high emitters of health-affecting fine particulate matter and other pollutants. This paper investigates the equity implications of NG peaker plant replacements with battery energy storage in the context of Washington State’s peaker plants to highlight the human-centered values of retiring the plants. The study performed production cost simulations using the latest Western Electric Coordinating Council Anchor Dataset 2030 case and found that total generation cost, locational marginal price, and total annual emissions were reduced with the replacements. These reductions will have equity benefits on local communities including access to clean air, enhanced health outcomes, and energy burden reductions.

Tarekegne, Bethel W.↗
DOE OSTI2026

Re-evaluating probable maximum precipitation estimates: sensitivity to transposition domains and storm rotation using modern datasets

This study examines the sensitivity of Probable Maximum Precipitation (PMP) estimates to key methodological decisions embedded in the legacy approach adopted in the U.S. National Weather Service Hydrometeorological Reports No. 51 and No. 52. Although widely used for infrastructure design and risk regulation, fundamental aspects of PMP estimation—such as storm sample size, transposition domain, maximization procedures, and storm rotation—remain poorly constrained and lack formal guidance. Using the Red Rock watershed in Iowa as a case study, and leveraging the 2002–2023 NOAA Analysis of Record for Calibration (AORC) precipitation dataset, we systematically evaluate how each methodological choice, individually and in combination, influences PMP estimates. Our findings demonstrate that PMP is not a fixed physical upper bound but rather a modeling construct shaped heavily by user-defined assumptions. Notably, PMP values derived from modern gridded rainfall datasets can be substantially higher than the legacy estimate used in the original spillway design for Red Rock Dam. Decisions regarding storm sample size, domain extent, climatological window, and particularly storm rotation all contributed to higher PMP estimates. Storm rotation alone—a loosely constrained element in the current PMP practice—can amplify PMP by more than 25%. These results reveal the lack of standardized bounds in current PMP workflows and the need for systematic sensitivity and uncertainty analysis. As PMP estimation shifts toward probabilistic approaches, incorporating physically meaningful storm attributes will be key to developing more transparent, defensible methods for dam safety and climate-resilient infrastructure.

Probable maximum precipitation↗