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At least 685 records · Page 38

PyPop: a mature open-source software pipeline for population genomics

Python for Population Genomics (PyPop) is a software package that processes genotype and allele data and performs large-scale population genetic analyses on highly polymorphic multi-locus genotype data. In particular, PyPop tests data conformity to Hardy-Weinberg equilibrium expectations, performs Ewens-Watterson tests for selection, estimates haplotype frequencies, measures linkage disequilibrium, and tests significance. Standardized means of performing these tests is key for contemporary studies of evolutionary biology and population genetics, and these tests are central to genetic studies of disease association as well. Here, we present PyPop 1.0.0, a new major release of the package, which implements new features using the more robust infrastructure of GitHub, and is distributed via the industry-standard Python Package Index. New features include implementation of the asymmetric linkage disequilibrium measures and, of particular interest to the immunogenetics research communities, support for modern nomenclature, including colon-delimited allele names, and improvements to meta-analysis features for aggregating outputs for multiple populations.

59 BASIC BIOLOGICAL SCIENCES↗

Hadronic contributions to (g - 2) µ

The Muon g-2 Experiment at Fermilab, which recently started running, plans to reduce the uncertain- ties on the already very precisely measured anomalous magnetic moment of the muon by a factor of four. The goal of this effort is to probe the observed difference of more than three standard deviations between Standard-Model theory and experiment, one of the few persistent hints for physics beyond the Standard Model. The Fermilab experiment collected data from their first run last year with statistics comparable to BNL E821. They expect to release the measurement result in 2019. On the theoretical side, because the muon g - 2 arises from quantum- mechanical loop contributions in the Standard Model, it is sensitive to virtual effects of new particles, and places important constraints on Standard-Model extensions. To leverage the anticipated reduction in experimental errors, and determine unambiguously whether or not new-physics effects contribute to this quantity, the theoretical errors must be made more reliable and reduced to a commensurate precision. The Muon g-2 Theory Initiative was created to facilitate this development. The dominant sources of uncertainty in the Standard-Model prediction of the muon g -2 are from the hadronic contributions. The hadronic vacuum polarization (HVP) provides the leading correction followed by hadronic light-by-light (HLbL) scattering. There are a number of complementary theoretical efforts underway to better understand and quantify these contributions, including dispersive and data driven methods, lattice QCD, and effective field theories. Given the precision goals and the phenomenological importance, it is important to have more than one independent method for each of the two hadronic corrections, each with fully quantified uncertainties. Fostering the development of such methods is a prime goal of the initiative, as this will enable critical cross checks, and, upon combination, may yield gains in precision, to maximize the impact of E989. An important aspect of the Muon g-2 Theory Initiative’s activities are providing platforms that facilitate interactions between the different groups, as well as between the theoretical and experimental g - 2 communities. To this end, several workshops were organized in 2017 and 2018. The first meeting, held at Fermilab (June 3–6, 2017, St. Charles, IL, USA), served to kick-off the Initiative’s activities. Two meetings in early 2018 were focused respectively on the HVP and HLbL corrections. The HVP meeting was held at KEK (February 12–14, 2018, Tsukuba, Japan) and the HLbL meeting at the University of Connecticut (March 12–14, 2018, Storrs, CT, USA). The most recent workshop, which served as the second plenary meeting of the Initiative, was held at the University of Mainz (June 18–22, 2018, Mainz, Germany). An important outcome of these meetings are concrete plans for a first white paper, which is currently being written. We aim to post the white paper just prior to the release of the first E989 measurement, to present a clean theoretical prediction. The first white paper is focused on assessing and improving the reliability of the SM prediction. The purpose of the INT workshop in September 2019 is to start the next stage of the Initiative, focusing on the development of strategies to improve the theory uncertainties beyond the current level towards the E989 precision goal. We aim to accelerate theoretical developments on the hadronic contributions to the muon g - 2 so that the Standard-Model theory error can be brought to the needed precision, again in advance of the next release from E989. Hence the workshop will provide crucial theory support for a US experiment with broad impact. The Muon g-2 Theory Initiative relies on input from representatives of all the different communities that are engaged in this effort. It is therefore important that all these areas are properly represented. The funds from this grant will be used to enable more people, especially early-career scientists, to participate and make essential contributions to the workshop discussions. Since the workshop’s main goal is to kick-off the next stage of the theory initiative’s activities, support for this workshop from the DOE will help the theory community provide crucial theoretical support to the Fermilab Muon g-2 Experiment.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Understanding Measurement Artifacts Causing Inherent Cation Gradients in Depth Profiles of Perovskite Photovoltaics with TOF-SIMS

Time-of-flight secondary-ion mass spectrometry (TOF-SIMS) is one of the few techniques that can obtain chemical information from the hybrid organic-inorganic perovskite solar cells (PSCs) in one dimension (standard depth profiling), two dimensions (high-resolution 100-nm imaging), as well as three dimensions (tomography combining high-resolution imaging with depth profiling). We have very recently developed thermo-mechanical methods to cleave perovskite samples at the back transparent conducting oxide/PSC interface. This allowed for depth-profiling from the back of the device to the front. The resultant profiles answered the lingering question of the apparent A-site cation gradient typically seen in TOF-SIMS depth profiles. In fact, this gradient is a measurement artifact due to beam damage that the community should be informed of as TOF-SIMS data become more commonly employed. Methods of mitigating this artifact by altering the measurement conditions are also presented.

14 SOLAR ENERGY↗

LiDAR Measurements of Wind Shear Exponents and Turbulence Intensity Offshore the Northeast United States

This paper presents wind speed shear exponents and turbulence intensity measurements collected from LiDARs measuring wind speeds from 40m to 200m above sea-level and provides comparisons to industry design guidelines. The high-altitude wind speed data are unique and represent some of the first measurements made offshore in this part of the country, which is actively being developed for offshore wind. The data is used to support the New England Aqua Ventus I Floating Offshore Wind Farm to be located 17km offshore the Northeast United States. Multiple LiDAR measurements were made using a DeepCLiDAR floating buoy and LiDARs located on a nearby island. Here, the measured wind speed shear exponents are compared against industry standard mesoscale model outputs and offshore design codes including the American Bureau of Shipping, American Petroleum Institute, and DNV-GL guides. Significant variation in the vertical wind speed profile occurs throughout the year which is not addressed in design standards. Additionally, turbulence intensity measurements made from the LiDAR, although not widely accepted in the scientific community, are presented and compared against industry guidelines.

42 ENGINEERING↗

Flexible and Effective Object Tiering for Heterogeneous Memory Systems

Computing platforms that package multiple types of memory, each with their own performance characteristics, are quickly becoming mainstream. To operate efficiently, heterogeneous memory architectures require new data management solutions that are able to match the needs of each application with an appropriate type of memory. As the primary generators of memory usage, applications create a great deal of information that can be useful for guiding memory tiering, but the community still lacks tools to collect, organize, and leverage this information effectively. To address this gap, this work introduces a novel software framework that collects and analyzes object-level information to guide memory tiering. Using this framework, this study evaluates and compares the impact of a variety of data tiering choices, including how the system prioritizes objects for faster memory as well as the frequency and timing of migration events. The results, collected on a modern Intel platform with conventional DRAM as well as non-volatile RAM, show that guiding data tiering with object-level information can enable significant performance and efficiency benefits compared to standard hardware- and software-directed data tiering strategies.

Kammerdiener, Brandon↗

Development of an energy-absorbing passenger seat for a transport aircraft

Commercial air transport passenger safety and survivability, in the event of an impact-survivable crash, are subjects receiving increased technical focus/study by the aviation community. A B-720 aircraft, highly instrumented, and remotely controlled from the ground by a pilot in a simulated cockpit, was crashed on a specially prepared gravel covered impact site. The aircraft was impacted under controlled conditions in an air-to-ground gear-up mode, at a nominal speed of 150 knots and 4-1/2 deg glide slope. Data from a number of on board, crash worthiness experiments provided valuable information related to structural loads/failure modes, antimisting kerosene fuel, passenger and attendant restraint systems and energy absorbing seats. The development of an energy absorbing (EA) seat accomplished through innovative modification of a typical modern standard commercial aviation transport, three passenger seat is described.

Eichelberger, C. P.↗

Illinois Disasters: Utilizing NASA Earth Observations to Enhance Drought Monitoring in Illinois

Drought and flooding in Illinois have severe impacts on the communities and ecosystems of the state. Soil moisture is a valuable indicator of drought and flood vulnerability but can be difficult to measure since in situ monitoring is limited to discrete stations throughout the state. The team created a framework to compare in situ, modeled, and NASA satellite soil moisture measurements to increase the spatial coverage of soil moisture monitoring. The team partnered with the Illinois State Weather Survey, USDA Midwest Climate Hub, NOAA Regional Climate Services of the Central Region, NOAA National Integrated Drought Information System’s Midwest Drought Early Warning System, and the NOAA North Central River ForecastCenter. The team standardized and compared soil moisture data from NASA’s Soil Moisture Active Passive (SMAP) mission, modeled soil moisture outputs from NASA’s SPoRT Land Information System (SPoRT-LIS), and in situ measurements from the Illinois State Weather Survey’s Water and Atmospheric Resources Monitoring (WARM) program. Compared to the WARM data, the satellite and modeled data showed seasonally variable differences and bias. The difference was highest in the winter months and lowest in the late summer and early fall months for the SMAP and SPoRT-LIS data products. SPoRT-LIS produced lower seasonal variability and SMAP demonstrated higher correlation values and lower differences. These analyses suggest that both SMAP and SPoRT-LIS products offer unique strengths and limitations when used for soil moisture monitoring

Joshua Green↗

Thoroughly testing and integrating hundreds of Pull Requests per month: ROOT’s new Cost-efficient and Feature Rich GitHub-based CI

ROOT is an open source framework, freely available on GitHub, at the heart of data acquisition, processing and analysis of HE(N)P experiments, and beyond. It is developed collaboratively: contributions are not authored only by ROOT team members, but also by the user community at large: developers and scientists from universities, labs as well as the private sector. More than 1500 GitHub Pull Requests are merged on average per year. It is in this context that code integration acquires a primary role. The review of code contributions isn’t enough: not only they need to be thoroughly reviewed, they also need to be thoroughly tested through a powerful CI infrastructure on several different platforms to comply with the high code quality standards of the project. Since the end of 2023, ROOT moved its continuous integration system from Jenkins to GitHub Actions. In this contribution, we characterise the transition to the GitHub CI, focussing on our strategy, its implementation and the lessons learned, as well as the advantages the new system offers with respect to the previous one. Particular emphasis will be given to the evaluation of the cost-benefit ratio for Jenkins and GitHub Actions for the ROOT project. We also describe how we manage to run in less than one hour thousands of unit, integration, functional and end-to-end tests on different flavours of Windows, four versions of macOS, as well as about ten of the most used Linux distributions, taking advantage of the CERN computing infrastructure.

Piparo, Danilo [CERN]↗

Baseline Climate Variables for Earth System Modelling

The Baseline Climate Variables for Earth System Modelling (ESM-BCVs) are defined as a list of 135 variables which have high utility for the evaluation and exploitation of climate simulations. The list reflects the most frequently used elements of the Coupled Model Intercomparison Project Phase 6 (CMIP6) archive. Successive phases of CMIP have supported strong results in science and substantially influence international climate policy formulation. This paper responds to both interest in exploiting CMIP data standards in a broader range of climate modelling activities and a need to achieve greater clarity about the significance and intention of variables in the CMIP Data Request. As Earth system modelling archives grow in scale and complexity, there are emerging problems associated with weak standardisation at the variable collection level. That is, there are good standards covering how specific variables should be archived, but this paper fills a gap in the standardisation of which variables should be archived. The ESM-BCV list is intended as a resource for ESM intercomparison projects (MIPs) developing requests to enable greater consistency among MIPs and as a reference for modelling centres to enhance consistency within MIPs. Provisional planning for the CMIP7 Data Request exploits the ESM-BCVs as a core element. The baseline variable list includes 98 variables which have modest or minor data volume footprints and could be generated systematically when simulations are produced and archived for exploitation by the World Climate Research Programme (WCRP) community. A further 35 variables are classed as “high volume” and are only suitable for production when the resource implications are justified.

Juckes, Martin [University of Oxford (United Kingd↗

SOHO Ultraviolet Coronagraph Spectrometer (UVCS) Mission Operations and Data Analysis

The scientific goal of UVCS is to obtain detailed empirical descriptions of the extended solar corona as it evolves over the solar cycle and to use these descriptions to identify and understand the physical processes responsible for coronal heating, solar wind acceleration, coronal mass ejections (CMEs), and the phenomena that establish the plasma properties of the solar wind as measured by 'in situ' solar wind instruments. This report covers the period from 01 February 2002 to 15 February 2003. During that time, UVCS observations have consisted of three types: 1) standard synoptic observations comprising, primarily, the H I Ly alpha line profile and the O VI 103.2 and 103.7 nm intensity over a range of heights from 1.5 to about 3.0 solar radii and covering 360 degrees about the sun, 2) sit and stare watches for CMEs, and 3) special observations designed by the UVCS Lead Observer of the Week for a specific scientific purpose. The special observations are often coordinated with those of other space-based and ground-based instruments and they often are part of SOHO joint observation programs and campaigns. Lead observers have included UVCS Co-Investigators, scientists from the solar physics community and several graduate and undergraduate level students. UVCS has continued to achieve its purpose of using powerful spectroscopic diagnostic techniques to obtain a much more detailed description of coronal structures and dynamic phenomena than existed before the SOHO mission. The new descriptions of coronal mass ejections (CMEs) and coronal structures from UVCS have inspired a large number of theoretical studies aimed at identifying the physical processes responsible for CMEs and solar wind acceleration in coronal holes and streamers. UVCS has proven to be a very stable instrument. Stellar observations have demonstrated its stability. UVCS has required no flight software modifications and all mechanisms are operational. The UVCS O VI Channel with its redundant optical path for wavelengths near H I Ly alpha is capable of observing the entire UVCS wavelength range. Since December 1998, the O VI Channel has been used for all UVCS observations. Although the H I Ly alpha Channel and detector are still operational, increases in the dark count up to about 5 x 10(exp -4) counts/sec/pixel and an increase in high voltage current to within a factor of two of the maximum used in the laboratory before flight led to the decision to not use that detector at the present time. There is no significant decrease in the scientific capability of UVCS owing to the O VI channel redundant optical path. UVCS data, data analysis software, calibration files and the mission log are available from the SOHO archive and SAO. All UVCS data is now available to scientists and the general public via the SOHO Data Archive and SAO within three months of the observations. UVCS has resulted in 46 scientific papers in 2002. There were numerous presentations at scientific meetings. All requests for observation time by qualified outside users have been granted.

Kohl, John L.↗

Coloration Determination of Spectral Darkening Occurring on a Broadband Earth Observing Radiometer: Application to Clouds and the Earth's Radiant Energy System (CERES)

It is estimated that in order to best detect real changes in the Earth s climate system, space based instrumentation measuring the Earth Radiation Budget (ERB) must remain calibrated with a stability of 0.3% per decade. Such stability is beyond the specified accuracy of existing ERB programs such as the Clouds and the Earth s Radiant Energy System (CERES, using three broadband radiometric scanning channels: the shortwave 0.3 - 5microns, total 0.3. > 100microns, and window 8 - 12microns). It has been shown that when in low earth orbit, optical response to blue/UV radiance can be reduced significantly due to UV hardened contaminants deposited on the surface of the optics. Since typical onboard calibration lamps do not emit sufficient energy in the blue/UV region, this darkening is not directly measurable using standard internal calibration techniques. This paper describes a study using a model of contaminant deposition and darkening, in conjunction with in-flight vicarious calibration techniques, to derive the spectral shape of darkening to which a broadband instrument is subjected. Ultimately the model uses the reflectivity of Deep Convective Clouds as a stability metric. The results of the model when applied to the CERES instruments on board the EOS Terra satellite are shown. Given comprehensive validation of the model, these results will allow the CERES spectral responses to be updated accordingly prior to any forthcoming data release in an attempt to reach the optimum stability target that the climate community requires.

Matthews, Grant↗

Generic extravehicular (EVA) and telerobot task primitives for analysis, design, and integration. Version 1.0: Reference compilation for the EVA and telerobotics communities

The results are described of an effort to establish commonality and standardization of generic crew extravehicular (crew-EVA) and telerobotic task analysis primitives used for the study of spaceborne operations. Although direct crew-EVA plans are the most visible output of spaceborne operations, significant ongoing efforts by a wide variety of projects and organizations also require tools for estimation of crew-EVA and telerobotic times. Task analysis tools provide estimates for input to technical and cost tradeoff studies. A workshop was convened to identify the issues and needs to establish a common language and syntax for task analysis primitives. In addition, the importance of such a syntax was shown to have precedence over the level to which such a syntax is applied. The syntax, lists of crew-EVA and telerobotic primitives, and the data base in diskette form are presented.

Smith, Jeffrey H.↗

Release of ENDF/B-VIII.1β1-Based ACE Data Files

On March 1 st , 2023, the National Nuclear Data Center (NNDC) released the ENDF/B-VIII.1β1 nuclear data library, which contained neutron, spontaneous and neutron-induced fission yield, and alpha sublibraries. The library was released in the standard Evaluated Nuclear Data File (ENDF) format. The files can be accessed on Brookhaven National Laboratory’s GitLab. The thermal scattering law (TSL) sublibrary will be released at a later date. The files provided in the neutron sublibrary were processed into A Compact ENDF (ACE)-formatted files, verified, and validated by the XCP-5 Nuclear Data Team. The resulting collection of ACE files will be referred to as the “e81b1” library. This report details the processing of these files and the quality assurance approach taken. This is not intended to be a full validation effort; rather, this library is intended to simply reproduce the released files for further validation testing by the community. The e81b1 ACE library will be released to the NNDC for access through GitLab and hosted locally on LANL computing resources. This library is only intended for analysis to support the future ENDF/B-VIII.1 release and should not be used for production results.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

SOHO Ultraviolet Coronagraph Spectrometer (UVCS) Mission Operations and Data Analysis

The scientific goal of UVCS is to obtain detailed empirical descriptions of the extended solar corona as it evolves over the solar cycle and to use these descriptions to identify and understand the physical processes responsible for coronal heating, solar wind acceleration, coronal mass ejections (CMEs), and the phenomena that establish the plasma properties of the solar wind as measured by "in situ" solar wind instruments. This report covers the period from 15 February 2003 to 14 April 2004. During that time, UVCS observations have consisted of three types: 1) standard synoptic observations comprising, primarily, the H I Lyalpha line profile and the 0 VI 103.2 and 103.7 nm intensity over a range of heights from 1.5 to about 3.0 solar radii and covering 360 degrees about the Sun, 2) sit and stare observations for major flare watches, and 3) special observations designed by the UVCS Lead Observer of the Week for a specific scientific purpose. The special observations are often coordinated with those of other space-based and ground-based instruments and they often are part of SOHO joint observation programs and campaigns. Lead observers have included UVCS Co-Investigators, scientists from the solar physics community and several graduate and undergraduate level students. UVCS has continued to achieve its purpose of using powerful spectroscopic diagnostic techniques to obtain a much more detailed description of coronal structures and dynamic phenomena than existed before the SOHO mission. The new descriptions of coronal mass ejections (CMEs) and coronal structures from UVCS have inspired a large number of theoretical studies aimed at identifying the physical processes responsible for CMEs and solar wind acceleration in coronal holes and streamers. UVCS has proven to be a very stable instrument. Stellar observations have demonstrated its radiometric stability. UVCS has not required any flight software modifications and all mechanisms are operational. The UVCS 0 VI Channel with its redundant optical path for wavelengths near H I Lyalpha is capable of observing the entire UVCS wavelength range. The regions of the detector currently being used require different grating angles for direct OVI observations and redundant path H I Lyalpha observations, and so those can no longer be observed simultaneously. Since December 1998, the 0 VI Channel has been used for all UVCS observations. Although the H I Lyalpha Channel and detector are still operational, increases in the dark count up to about 5x10(exp 4) counts/sec/pixel and an increase in high voltage current to within a factor of two of the maximum used in the laboratory before flight led to the decision to not use that detector after 1998. The visible light channel functioned nominally during the reporting period. UVCS data, data analysis software, calibration files and the mission log are available from the SOHO archive and SAO. All UVCS data are now available within three months of the observations to scientists and the general public via the SOHO Data Archive and SAO. UVCS has resulted in 33 scientific papers in 2003. There were numerous presentations at scientific meetings. UVCS Education and Public Outreach activities involved nine members of the UVCS team. During the reporting period, there were over a dozen events directed at students and teachers, museum audiences, and public audiences via the mass media, internet and educational literature.

Gurman, Joseph↗

Computationally Accelerated Discovery and Experimental Demonstration of High-Performance Materials for Advanced Solar Thermochemical Hydrogen Production

This project achieved its overarching goal of accelerating the discovery and validation of solar thermochemical hydrogen (STCH) materials through a tightly integrated approach that combined high-throughput computational screening, advanced machine learning (ML), and experimental testing. Guided by the objectives outlined in the Statement of Project Objectives (SOPO), our work fulfilled all major milestones across four technical tasks and delivered scientific breakthroughs and practical tools that significantly exceeded the original scope of the project. We began by addressing the challenge of predicting material phase stability through machine learning. A novel Python module was developed to generate thousands of meaningful features from composition, structure, and electronic properties, enabling rapid and reproducible ML model development. Using these tools, we trained a model to predict temperature-dependent Gibbs energies (G(T)) for inorganic crystalline materials with near-chemical accuracy—roughly 40 meV/atom—marking the first such descriptor of its kind. We also introduced a new machine-learned tolerance factor, τ, that accurately predicted perovskite formability with over 90% success, outperforming traditional heuristic models, such as the Goldschmidt tolerance factor. These capabilities allowed for rapid and accurate predictions of phase stability across a vast oxide composition space, setting the stage for high-throughput thermodynamic screening. Building on this foundation, we conducted an extensive computational screening of candidate STCH oxide materials. Over 1.1 million perovskite compositions were evaluated using the τ descriptor, leading to the identification of more than 27,000 predicted stable structures. Using density functional theory (DFT), we refined over 68,000 multinary perovskite structures and computed oxygen vacancy formation energies for over 1,300 ternary and double perovskites. These calculations enabled us to isolate compounds with redox behavior consistent with STCH requirements and resulted in a public dataset now hosted on the Materials Project. Recognizing that thermodynamic screening alone is insufficient, we addressed kinetic limitations by developing a suite of tools to estimate transition state (TS) energies for key redox reactions. We implemented a novel bounding approach that provides lower and upper estimates of TS energies with dramatically reduced computational cost, requiring less than 10% of the CPU time of a full nudged elastic band (NEB) calculation while maintaining high accuracy. This enabled rapid evaluation of over 200 reaction pathways across 90 materials. To further accelerate screening, we developed a SISSO-based ML model to predict diffusion barriers with a 96.7% success rate in classifying fast vs. slow materials, supporting a robust, data-driven framework for assessing redox kinetics. Experimental validation was critical to confirming the predictive power of our models. We synthesized and tested a wide array of candidate materials, including Mn-doped hercynite and several Gd- and La-based perovskites. Notably, Sr 0.4 Gd 0.6 Mn 0.6 Al 0.4 O 3 (SGMA) and Gd 0.5 La 0.5 Co 0.5 Fe 0.5 O 3 (GLCF) emerged as leading STCH materials, exhibiting robust redox cycling and high hydrogen yields exceeding 150 µmol H 2 /g per cycle. These materials also retained over 50% of their hydrogen productivity under high-conversion conditions (H 2 O:H 2 = 1333:1), demonstrating strong thermodynamic favorability and promising performance under industrially relevant scenarios. Additional candidates, such as La 2 MnNiO 6 (L2MN), were found to produce even higher yields than ceria under standard STCH conditions. Our collaborators at Sandia National Laboratories confirmed these findings using high-temperature X-ray diffraction and thermogravimetric analysis, observing stable phase evolution and reversible redox activity. In several respects, the project went beyond the goals initially outlined in the SOPO. We published 17 peer-reviewed articles, including a large dataset of over 66,000 theoretical perovskites and a new structure prediction method (SPuDS-DFT) that accurately identifies ground-state structures at a fraction of the cost of traditional DFT. We demonstrated that our machine-learned G(T) model offers accuracy rivaling quasiharmonic calculations while being orders of magnitude faster. In partnership with the Materials Project, we made our datasets openly available, providing a powerful new resource for the broader materials science community. The combined computational and experimental advances of this project represent a significant advance in STCH materials discovery. By creating a robust, generalizable, and open workflow for thermodynamic and kinetic screening, and validating key findings through synthesis and reactor testing, we have provided a practical and scalable pathway for the rapid identification of new redox-active materials. The tools, data, and materials developed under this project are already supporting ongoing research and have laid the groundwork for the next generation of solar fuel technologies.

08 HYDROGEN↗

Recent Advances in Assessing Environmental Effects of Marine Renewable Energy Around the World

Marine renewable energy (MRE) is increasingly of interest to coastal nations as a source of renewable energy that can support climate change mitigation goals as well as provide secure locally-produced energy for coastal and island communities. MRE extracts power from tidal streams, waves, ocean currents, run of rivers, and gradients in the ocean, with specialized devices developed and tested for each energy resource. Alongside development of MRE technologies and systems, first in Europe and then in North America, Australia, Asia, and other regions, it has been universally recognized that there is also a need to examine potential effects on marine animals, habitats, ecosystem processes, local communities and other sea users, to ensure that the MRE industry can be developed in a responsible and sustainable manner. This paper looks at the status of assessment and monitoring for potential environmental effects associated with MRE projects around the world. Over 80 projects were identified worldwide as having been tested, demonstrated, or commercially deployed with associated environmental monitoring. Five of the projects that represent tidal stream, wave, and run of river projects are examined in more detail to determine the types of data and information collected for those projects, the outputs of the monitoring campaigns, and the actions taken as a result of the data collection and analysis. Recommendations are provided for standardization of the monitoring approaches, instruments, and analysis methods at MRE project sites worldwide.

marine renewable energy, environmental effects, ri↗

MISR Observations of Etna Volcanic Plumes

In the last twelve years, Mt. Etna, located in eastern Sicily, has produced a great number of explosive eruptions. Volcanic plumes have risen to several km above sea level and created problems for aviation and the communities living near the volcano. A reduction of hazards may be accomplished using remote sensing techniques to evaluate important features of volcanic plumes. Since 2000, the Multiangle Imaging SpectroRadiometer (MISR) on board NASA s Terra spacecraft has been extensively used to study aerosol dispersal and to extract the three-dimensional structure of plumes coming from anthropogenic or natural sources, including volcanoes. In the present work, MISR data from several explosive events occurring at Etna are analyzed using a program named MINX (MISR INteractive eXplorer). MINX uses stereo matching techniques to evaluate the height of the volcanic aerosol with a precision of a few hundred meters, and extracts aerosol properties from the MISR Standard products. We analyzed twenty volcanic plumes produced during the 2000, 2001, 2002-03, 2006 and 2008 Etna eruptions, finding that volcanic aerosol dispersal and column height obtained by this analysis is in good agreement with ground-based observations. MISR aerosol type retrievals: (1) clearly distinguish volcanic plumes that are sulphate and/or water vapor dominated from ash-dominated ones; (2) detect even low concentrations of volcanic ash in the atmosphere; (3) demonstrate that sulphate and/or water vapor dominated plumes consist of smaller-sized particles compared to ash plumes. This work highlights the potential of MISR to detect important volcanic plume characteristics that can be used to constrain the eruption source parameters in volcanic ash dispersion models. Further, the possibility of discriminating sulphate and/or water vapor dominated plumes from ash-dominated ones is important to better understand the atmospheric impact of these plumes.

Scollo, S.↗

Trust Not Verify? The Critical Need for Data Curation Standards in Materials Informatics

The importance of data curation has been recognized in multiple areas of research; however, the discussion of this important issue is only beginning to emerge in materials science. In this Perspective, we highlight the benefits of using the standardized data curation protocols in materials science and discuss current gaps in accurate and reproducible data reporting using case studies drawn from high-impact materials science papers and well-known databases such as the Crystallography Open Database (COD) and the Cambridge Structural Database (CSD). We argue that both experimental and computational materials scientists need to embrace a culture of rigorous data curation as part of modern research data management. We propose a sample data curation pipeline for materials chemistry and illustrate its use by creating two new materials chemistry databases. Here, we hope that this perspective will serve to catalyze further discussion and promote the continuous development of rigorous data curation practices within the materials science research community. We posit that adherence to best practices of data curation will promote and enhance the reliability, reproducibility, and integrity of materials research and enable the development of reliable AI and machine learning models that critically depend on the use of quality data.

Chemical structure↗