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At least 289 records · Page 16

Database of Nonaqueous Proton-Conducting Materials

This work presents the assembly of 48 papers, representing 74 different compounds and blends, into a machine-readable database of nonaqueous proton-conducting materials. SMILES was used to encode the chemical structures of the molecules, and we tabulated the reported proton conductivity, proton diffusion coefficient, and material composition for a total of 3152 data points. The data spans a broad range of temperatures ranging from -70 to 260 °C. To explore this landscape of nonaqueous proton conductors, DFT was used to calculate the proton affinity of 18 unique proton carriers. The results were then compared to the activation energy derived from fitting experimental data to the Arrhenius equation. It was found that while the widely recognized positive correlation between the activation energy and proton affinity may hold among closely related molecules, this correlation does not necessarily apply across a broader range of molecules. This work serves as an example of the potential analyses that can be conducted using literature data combined with emerging research tools in computation and data science to address specific materials design problems.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

A Quantitative Analysis on the Use of Supervised Machine Learning in Earth Science

Recent review papers (Ball et al., 2017; Reichstein et al., 2019) have investigated the opportunities and challenges in applying supervised machine learning (ML) techniques to Earth science problems. A common challenge is the lack of training (or labeled) data. Supervised ML, and especially deep learning (DL), require large training datasets. While there are large, open access Earth science archives, the data typically require preprocessing in preparation for supervised ML, frequently including manual labeling. Our objective is to understand the landscape of supervised ML in the Earth sciences, including which research communities have most rapidly adopted supervised ML, which algorithms are applied, and what data are used to train these algorithms. We conducted a literature survey of Earth science papers published during the last 10 years in journals from the American Geophysical Union (AGU), American Meteorological Society (AMS), the Institute of Electrical and Electronics Engineers(IEEE), and the Society of Photo-Optical Instrumentation Engineers (SPIE). We identified papers containing the terms ML, DL, or the names of individual supervised ML algorithms. "Earth science" is an additional required search term for IEEE and SPIE. We investigate trends in supervised ML usage during the 10-year study period, and manually analyzed AGU papers from 2018-2019 to enable deep-dive statistics.

Katrina S Virts↗

OpenPATH - Leveraging Technology to Measure Travel Behavior

Shifting transportation to more sustainable modes is a key piece of the decarbonization puzzle. However, mobility behavior and travel patterns are difficult to influence because they are difficult to measure. OpenPATH provides a tool to capture longitudinal behaviors through a smartphone application. Agencies interested in gathering data about a population's travel behavior can set up a deployment of the app customized to the needs of their community. Partners can choose between simple mode and purpose labels or surveys for each trip to balance the level of user engagement with the associated burden. The labels, trip surveys, and an initial demographic survey can all be tailored to the specific context of the deployment. The OpenPATH tool is unique in its open-source nature, ability to gather detailed longitudinal travel data, and design allowing direct engagement with travelers. A valuable technological advancement, this tool enables partners to measure the way changes in the transportation landscape impact their community. The suite of tools includes both public and administrator dashboards. The public dashboard supports continuous data analysis through charts presenting trip information updated daily. The administrator dashboard displays geospatial data and supports data export. Example applications have included e-bike programs; gathering valuable metrics on increased access to opportunities and reduction in VMT, and studies aimed at understanding existing mobility behavior to see where advancements such as electric vehicles could fit into these habits. OpenPATH collects travel data in association with an initial demographic survey, enabling detailed insight into the behavior patterns or impact of a certain program on different populations.

ADVANCED PROPULSION SYSTEMS↗

Creating IR-verified Gridded Fire Burn Maps using Public NASA and Satellite Data

Even though fire can be devastating, wildland fire is a natural and integral force on our landscapes, providing value by decreasing fuels at the Wildland Urban Interface (WUI) to promote safe communities. However, uncontained wildfires can devastate communities, threaten our health, and result in substantial economic losses. There has been greater than a $50B increase in wildfire insurance claims from 2017-2021, which has been exacerbated by climate change. Our partners at Kettle reinsurance are focused on building a smarter reinsurance model for protecting today’s globalized world from the catastrophic effects of climate change. Our objective is to develop a high-confidence grid-based wildfire burn product using multiple sources of satellite data to determine whether a ‘conflagration' (fire larger than 999+ acres) has ‘breached’ a grid cell. This product will substantially decrease the time it takes for homeowners to receive payouts, from over a year to a couple months. Working with our partners at Kettle reinsurance, we use VIIRS (Visible Infrared Imaging Radiometer Suite) 375 m fire detections and Sentinel-2 10 m satellite imagery to create a 20-m gridded fire burn product. Our process is based on the level of confidence in the data source and takes into account vegetation change throughout the life of the fire. For example, Sentinel-2 vegetation-change indices have a higher level of confidence when congruent with VIIRS active-fire detection data, rather than VIIRS detections alone. We have also verified our fire burn product against MODIS/ASTER Airborne Simulator (MASTER) Infrared (IR) data from the Fire Influence on Regional to Global Environments Experiment - Air Quality (FIREX-AQ) 2019 campaign, with 88% overall agreement. The first iteration has been developed for responding to wildfires in California, with the possibility to expand nationwide and globally.

Emily Gargulinski↗

Reconstruction of effective potential from statistical analysis of dynamic trajectories

The broad incorporation of microscopic methods is yielding a wealth of information on the atomic and mesoscale dynamics of individual atoms, molecules, and particles on surfaces and in open volumes. Analysis of such data necessitates statistical frameworks to convert observed dynamic behaviors to effective properties of materials. Here, we develop a method for the stochastic reconstruction of effective local potentials solely from observed structural data collected from molecular dynamics simulations (i.e., data analogous to those obtained via atomically resolved microscopies). Using the silicon vacancy defect in graphene as a model, we apply the statistical framework presented herein to reconstruct the free energy landscape from the calculated atomic displacements. Evidence of consistency between the reconstructed local potential and the trajectory data from which it was produced is presented, along with a quantitative assessment of the uncertainty in the inferred parameters.

74 ATOMIC AND MOLECULAR PHYSICS↗

Land use classification in Bolivia

The Bolivian LANDSAT Program is an integrated, multidisciplinary project designed to provide thematic analysis of LANDSAT, Skylab, and other remotely sensed data for natural resource management and development in Bolivia, is discussed. Among the first requirements in the program is the development of a legend, and appropriate methodologies, for the analysis and classification of present land use based on landscape cover. The land use legend for Bolivia consists of approximately 80 categories in a hierarchical organization which may be collapsed for generalization, or expanded for greater detail. The categories, and their definitions, provide for both a graphic and textual description of the complex and diverse landscapes found in Bolivia, and are designed for analysis from LANDSAT and other remotely sensed data at scales of 1:1,000,000 and 1:250,000. Procedures and example products developed are described and illustrated, for the systematic analysis and mapping of present land use for all of Bolivia.

Brockmann, C. E.↗

Conflicts of Greens’ in Renewable Energy Landscapes: Case Studies and a Planning Framework

Reducing greenhouse gas emissions (GHG) through renewable energy deployment is a goal for many cities and nations to mitigate the effects of a rapidly changing climate while securing energy needs. Given national and state level policies on green energy to achieve GHG reduction targets, localities are considering utility-scale renewable energy (USRE) facilities on remote lands, rural areas, oceans, coastal waters and large rivers to meet the energy needs for urban residents and industries. Although these USRE facilities generate much “greener” electricity than fossil fuel power plants, locating them can pose conflicts with wildlife, including endangered, threatened and/or special status species, and the habitats that support wildlife populations (Brunette et al., 2013; Gasparatos et al. 2016; Mulvaney 2017), which lead to a “Conflict of Greens” (Ko et al., 2011). In addition to ecological impacts, conflicts over social and cultural resources in local communities lead to concerns over environmental justice, in this context “energy justice,” where negative environmental, social, and economic impacts of energy projects fall more heavily upon marginalized, vulnerable, or indigenous communities. The Pacific Rim region is a center of major and growing economies, and it has become a battlefield for competing “green” objectives. In addition to progressive renewable energy goals, such as in California, Hawaii, and Taiwan, countries around the Pacific Rim have the majority of the growth in manufacturing of wind and solar energy devices and also some of the highest levels of renewables deployment with China, India, and the US leading the way in wind and solar installations. Developing renewable energy source in the ocean such as offshore wind, tidal, and wave energy, are beginning to add to this mix. Given this challenge, the APRU SCL energy working group provides six case studies that address questions about the “Conflict of Greens” across the Pacific Rim including South Korea, Taiwan, and the United States (California, Hawaii, and Massachusetts). The literature review highlights the emerging ecological, social, and economic aspects of conflicts over siting renewables on the landscape. Using case studies, we examine the trial and errors in least-conflict spatial planning, data collection and analysis, public participation in decision-making, mitigation, social planning for energy transitions, and multi-scalar approaches. Lastly, we recommend interdisciplinary policy, planning, and design actions for sustainable energy landscapes across the Pacific Rim and beyond.

green versus green, renewable energy↗

ROOT RNTuple and EOS: The Next Generation of Event Data I/O

For several years, the ROOT team is developing the new RNTuple I/O subsystem in preparation of the next generation of collider experiments. Both HL-LHC and DUNE are expected to start data taking by the end of this decade. They pose unprecedented challenges to event data I/O in terms of data rates, event sizes, and event complexity. At the same time, the I/O landscape is becoming more diverse. HPC cluster file systems and object stores, NVMe disk cache layers in analysis facilities, and S3 storage on cloud resources are mixing with traditional XRootD-managed spinning disk pools.The ROOT team will finalize a first production version of the RNTuple binary format by the end of 2024. After this point, ROOT will provide backward compatibility for RNTuple data. This contribution provides an overview of the RNTuple feature set, the related R&D activities and the long-term vision for RNTuple. We report on performance, interface design, tooling, robustness, integration with experiment frameworks, and validation results, as well as recent R&D on parallel reading and writing and exploitation of modern hardware and storage systems. We will give an outlook on possible future features after a first production release.Collaboratively, the IT and EP departments at CERN have launched a formal project within the Research and Computing sector to evaluate the novel data format for physics analysis data utilized in LHC experiments and other fields. This part of the project focuses on validating the scalability of the EOS storage backend during the transition from the over 25 years old TTree production format to the newly developed RNTuple format, using both replicated and erasure-coded storage profiles.

Blomer, Jakob [CERN]↗

RCSB protein data Bank: Next‐generation advanced search for exploration of experimental structures and computed structure models

Abstract The Protein Data Bank (PDB), established in 1971, is the primary global, open‐access archive for experimentally determined 3D macromolecular structures (proteins, RNA, DNA). The research‐focused RCSB.org web‐portal provides access to these data alongside more than one million machine‐learning‐predicted structure models, greatly expanding the available structural landscape. Rapid growth of both experimental and computational structures has increased the need for powerful yet accessible search tools that serve a broad and diverse scientific community. Herein, we describe a redesigned RCSB Protein Data Bank RCSB.org Advanced Search capability that supports intuitive discovery of 3D structures through a unified interface. This interface integrates annotation‐, sequence‐, and 3D structure‐based searches, embeds an interactive 3D viewer, and incorporates curated biological knowledge, such as catalytic site definitions from Mechanism and Catalytic Site Atlas and ligand‐guided structural motifs, for constructing geometry‐driven queries. A new Chemical Search tool allows definition of chemical queries via an integrated drawing tool or standard identifiers, seamlessly combining them with annotation filters. By allowing query definition directly within spatial and chemical contexts, these search interfaces reduce the need for detailed knowledge of residue numbering, chain identifiers, or external cheminformatics software. This capability enables efficient exploration of structures, chemical diversity, and structure–function relationships across all life domains. The redesigned interfaces can be accessed directly at rcsb.org/search/advanced for Advanced Search and rcsb.org/search/chemical for Chemical Search.

Rose, Yana [Research Collaboratory for Structural ↗

Raccoon density estimation from camera traps for raccoon rabies management

Abstract Density estimation for unmarked animals is particularly challenging, yet density estimates are often necessary for effective wildlife management. Raccoons ( Procyon lotor ) are the primary terrestrial wildlife reservoir for Lyssavirus rabies within the United States. The raccoon rabies variant (RRVV) is actively managed at landscape scales using oral rabies vaccination (ORV) within the eastern United States. To effectively manage RRVV, it is important to know the density of raccoons to appropriately scale the density of ORV baits distributed on the landscape. We compared methods to estimate raccoon densities from camera‐trap data versus more intensive capture‐mark‐recapture (CMR) estimates across 2 land cover types (upland pine and bottomland hardwood) in the southeastern United States during 2019 and 2020. We evaluated the effect of alternative camera configurations and durations of camera trapping on density estimates and used an N‐mixture model to estimate raccoon densities, including covariates on abundance and detection. We further compared different methods of scaling camera‐based counts, with the maximum number of raccoons seen on any given image within a day best explaining density. Camera‐trap density estimates were moderately correlated with CMR estimates ( r = 0.56). However, densities from camera‐trap data were more reliable when classifying category of density as an index used to inform management (83% correct when compared to CMR estimates), although the densities in our study fell into the 2 lowest density classes only. Using more cameras reduced bias and uncertainty around density estimates; however, if ≤6 camera traps were used at a site, a line transect approach proved less biased than a grid design. Camera trapping should be conducted for at least 3 weeks for more accurate estimates of raccoon population density in our study area (<5% bias). We show that camera‐trap data can be used to assign raccoon densities to management‐relevant density index bins, but more studies are needed to ensure reliability across a greater range of environmental conditions and raccoon densities.

Davis, Amy J.↗

Constructing Self-Labeled Materials Imaging Datasets from Open Access Scientific Journals with EXSCLAIM!

Due to recent improvements in image resolution and acquisition speeds, materials microscopy is experiencing an explosion in imaging data. Yet, despite the volume of images generated, the overall accessibility landscape is highly fragmented, as researchers who do release images to the public, often only do so as snapshots of their larger private dataset in context of scientific journal publications. The effort to automatically consolidate images and descriptive information from web-based platforms has garnered broad attention from the computer vision, language technologies, and chemistry/materials informatics communities. However, these methods are problematic for scientific figures because over 30% of figures are compound in nature, and it is the individual images themselves, paired with relevant context, that are necessary for construction a proper labeled dataset. To this end, we outline in this paper the design of a software pipeline for the automatic EXtraction, Separation, and Caption-based natural Language Annotation of IMages from scientific figures (EXSCLAIM!). Successful consolidation of materials imaging across literature sources will enhance navigation and searchability of materials microscopy images for both novice and experienced researchers, as well as establish the framework necessary for users to search by images, text, or some combination of both.

36 MATERIALS SCIENCE↗

Scaling Individual Tree Transpiration With Thermal Cameras Reveals Interspecies Differences to Drought Vulnerability

Abstract Understanding tree transpiration variability is vital for assessing ecosystem water‐use efficiency and forest health amid climate change, yet most landscape‐level measurements do not differentiate individual trees. Using canopy temperature data from thermal cameras, we estimated the transpiration rates of individual trees at Harvard Forest and Niwot Ridge. PT‐JPL model was used to derive latent heat flux from thermal images at the canopy‐level, showing strong agreement with tower measurements ( R 2 = 0.70–0.96 at Niwot, 0.59–0.78 at Harvard at half‐hourly to monthly scales) and daily RMSE of 33.5 W/m 2 (Niwot) and 52.8 W/m 2 (Harvard). Tree‐level analysis revealed species‐specific responses to drought, with lodgepole pine exhibiting greater tolerance than Engelmann spruce at Niwot and red oak showing heightened resistance than red maple at Harvard. These findings show how ecophysiological differences between species result in varying responses to drought and demonstrate that these responses can be characterized by deriving transpiration from crown temperature measurements.

Javadian, Mostafa↗

Land change, fire, and climate weaken carbon sink in the conterminous United States

The land carbon sink of the conterminous United States was evaluated using a bottom-up modeling framework and 30-meter land change data from 1985 to 2020. This cross-scale, cross-landscape, and cross-system approach tracked fractional land cover changes and applied regional model calibration. Results show average terrestrial and aquatic carbon sinks of +110 ± 37 and +19 ± 0.5 teragrams of carbon per year, respectively. The terrestrial carbon sink, showing no clear trend, peaked in the 1990s, with more years as a carbon source since 2000, contradicting recent national and global studies. Land change had the largest impact (−70 ± 5.5 teragrams of carbon per year), exceeding impacts of climate (−33 ± 48 teragrams of carbon per year), wildfire (−7.7 ± 2.4 teragrams of carbon per year), and erosion transport (−1.9 ± 0.13 teragrams of carbon per year). The positive CO 2 fertilization effect (+69 ± 12 teragrams of carbon per year) was insufficient to maintain the carbon sink strength. Our framework reveals key paths of carbon loss, with implications for carbon budget and energy policies in the United States and beyond.

Liu, Jinxun [US Geological Survey, Reston, VA (Uni↗

Addressing Electric Aviation Infrastructure Cybersecurity Implementation

This technical report evaluates key considerations of cybersecurity systems in preparation for the electrification of both legacy and new aviation services. The objectives are to consider the landscape of components and interconnections, review sensitivities and the criticality of data and operations, and aim to understand the applicability of existing best practices or the need for new ones associated with the cybersecurity of electric charging systems for the aviation sector. Given the early stages of electric aviation deployment, developers have the opportunity to plan and integrate cybersecurity strategies into the complete electric aviation system during the initial stages of design and procurement and will benefit from employing a framework for continuous cybersecurity monitoring. This paper presents initial considerations of key cybersecurity strategies and their application to forthcoming electric aviation systems.

airports↗

Vegetation changes caused by fire in the Florida flatwoods as observed by remote sensing

The nature of the flatwoods and the role that ground fires have played in maintaining them are discussed. Emphasis is placed on the areal and temporal extent of burns as recorded uniformly by remote sensors. Thermal infrared, color infrared, and Ektachrome imagery were obtained from sensors flown by a NASA aircraft at 15,000 feet over a test site in Osceola County, Florida, in March 1968. The overall pattern of burning can be sequenced and mapped uniformly from the imagery. By comparing the various imagery, areal and temporal extent of burned areas can be determined. It was concluded that remote sensed imagery provides more accurate and areally comprehensive media for assessing the impact of ground fires on the landscape of the flatwoods region than are available from any other data source.

Mealor, W. T., Jr.↗

Megafans of the Northern Kalahari Basin

We identify eleven megafans (partial cones of fluvial sediment, >80 km radius) in the northern Kalahari Basin, using several criteria based on VIS and IR remotely sensed data and SRTM-based surface morphology reconstructions. Two other features meet fewer criteria of the form which we class as possible megafans. The northern Kalahari megafans are located in a 1700 km arc around the southern and eastern flanks of the Angola's Bié Plateau, from northern Namibia through northwest Botswana to western Zambia. Three lie in the Owambo subbasin centered on the Etosha Pan, three in the relatively small Okavango rift depression, and five in the Upper Zambezi basin. The population includes the well-known Okavango megafan (150 km), Namibia's Cubango megafan, the largest megafan in the region (350 km long), and the largest nested group (the five major contiguous megafans on the west slopes of the upper Zambezi Valley). We use new, SRTM-based topographic roughness data to discriminate various depositional surfaces within the flat N. Kalahari landscapes. We introduce the concepts of divide megafans, derived megafans, and fan-margin rivers. Conclusions. (i) Eleven megafan cones total an area of ~190,000 sq km. (ii) Different controls on megafan size operate in the three component basins: in the Okavango rift structural controls become the prime constraint on megafan length by controlling basin dimensions. Megafans in the other les constricted basins appear to conform to classic relationships fan area, slope, and feeder-basin area. (iii) Active fans occupy the Okavango rift depression with one in the Owambo basin. The rest of the population are relict but recently active fans (surfaces are relict with respect to activity by the feeder river). (iv) Avulsive behavior of the formative river-axiomatic for the evolution of megafans-has resulted in repeated rearrangements of regional drainage, with likely effects in the study area well back into the Neogene. Divide megafans comprise the majority of the identified features, some of which have delivered water and sediment alternately to neighboring basins in the course of normal avulsion activity, likely resulting in significant changes in the hydrologies of two of the study-area subbasins. (v) Paleoclimatic inferences extracted from fluvial and lacustrine sediments therefore need to take account of avulsion-driven drainage configurations, especially where these are autogenically controlled.

Wilkinson, M. J.↗

Effective Engagement for Community Action with NASA’s Indigenous Peoples Initiative

NASA’s Indigenous Peoples Initiative (IPI) seeks to support and cultivate efforts within Indigenous communities and NASA to increase the use of Earth Observations (EO) to inform decisions, policies, and actions. IPI is dedicated to building lasting relationships with Indigenous communities by creating a trusted, reliable, and Indigenous-centric geospatial community with a focus on environmental justice and climate issues on Indigenous lands and territories. Indigenous communities through conservation, restoration, and adaptation have the opportunity to further empower their landscape work through the potential use of EO and other NASA data and tools. We will outline our guiding principles, multiple approaches, and lessons learned for working alongside Indigenous communities in a respectful and reciprocal manner. These include the recognition of multiple ways of knowing, co-development of trainings, acknowledgement of all sovereignty, maintaining healthy relationships with tribal natural resource managers and building bridges for their engagement with NASA researchers and other federal agency partners, and making space for reflection and adaptation of our practices as we grow. Future activities, such as dialogue sessions with Indigenous communities around EO needs, aim to enhance these practices and ultimately benefit the ability for Indigenous communities to maintain and protect their lands, people, and practices in the face of environmental injustices and climate change.

Effective↗

Ecological connectivity and habitat loss shape patterns of genetic diversity in a threatened salamander

Context The maintenance of genetic diversity is essential for preserving adaptive potential in populations, yet it is increasingly threatened by landscape alteration. The field of landscape genetics offers a framework for assessing how patch-level landscape conditions, modeled at multiple scales, influence genetic diversity. Objectives We sought to assess how local environmental features and connectivity influence genetic diversity across 74 four-toed salamander (Hemidactylium scutatum) breeding wetlands in the southeastern United States. Methods Using next-generation sequencing data and hierarchical Bayesian models, we examined genome-wide heterozygosity in relation to local landscape features and ecological connectivity. We also assessed the scale of effect of landscape features and tested for temporal lag effects. Results Genetic diversity was lower in wetlands with higher levels of historic deforestation and lower connectivity. An interaction between deforestation and connectivity indicated that deforestation had stronger negative effects in isolated wetlands but weaker effects in well-connected wetlands. Accounting for scale of effect and temporal lags was critical for detecting these relationships. Conclusions Our analyses highlight the importance of assessing the spatial scale (scale of effect) and temporal lag of landscape features to detect key drivers of genetic diversity. In line with population genetic theory, our results indicate that the genetic consequences of habitat loss do not affect populations uniformly and are most severe in isolated populations where gene flow cannot buffer against loss of diversity. Altogether, we highlight the importance of considering the interaction of habitat loss and connectivity in conservation genetic management.

Hemidactylium scutatum↗