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DOE OSTI2022

How to Get the Best Gas Separation Membranes from State-of-the-Art Glassy Polymers

Herein we focus on fundamental polymer science factors in membrane-based gas separation to open another chapter on this important topic. Realistically thinking about nano and angstrom scale matrix attributes that are translatable into higher performance thin glassy polymer asymmetric membrane layers in practical large-scale devices is crucial. Such thinking should be guided by expertise in both polymer and membrane communities to advance the state of the art. Polymer structures, membrane morphologies and effects of operating conditions are discussed here, using specific examples to illustrate key issues. Rubbery polymers are not the focus of this discussion, since they lack diffusive discrimination for size-similar penetrants, which glassy polymers provide and make them the focus here. Four scalable subtopics guide necessary thinking: (i) plasticization; (ii) anti-plasticization†2; (iii) dual-mode transport involving saturation of unrelaxed free volume, and (iv) non-uniform free volume and stress profiles in thin skin glassy polymer asymmetric or composite membranes. Furthermore, using these subtopics in the context of macromolecular science we discuss issues needed to expand the state-of-the-art in gas separation membranes.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

NASA NTRS2003

NASA's Far-IR/Submillimeter Roadmap Missions SAFIR and SPECS

The far-IR is rich with information about star, disk and planet formation because protostars emit predominantly in this spectral range, and the radiation can escape from the inherently dusty stellar birth sites. Spectral lines contain particularly valuable information about the cooling, collapse, and chemistry of molecular cloud cores and protostars. However, the interpretation of line intensities and profiles is model-dependent; ultimately, high angular resolution is needed to break model degeneracy and definitively characterize the source. Processes occurring on scales smaller than 10,000 AU (72 arcsec at 140 pc, where the nearest protostellar objects are found) likely affect the stellar initial mass function and determine the product of cloud collapse (Binary star or planetary system? How many planets, and what kind will they be?) The next-generation far-IR observatories SIRTF, SOFIA, and Herschel will revolutionize star formation studies and leave the community yearning for telescopes that operate in this spectral region but provide many orders of magnitude better angular resolution. NASA's space science roadmap includes the JWST-scale Single Aperture Far-IR (SAFIR) telescope and the 1 km maximum baseline far-IR interferometer, SPECS (the Submillimeter Probe of the Evolution of Cosmic Structure). I will give the scientific motivation for these missions, describe mission concepts and telescope measurement capabilities, and compare these capabilities with those of the next-generation IR telescopes and with the complementary JWST and ALMA. I will also describe the Space Infrared Interferometric Telescope (SPIRIT), a science and technology pathfinder for SPECS, which could be ready to launch in about a decade. At 100 microns, SAFIR will provide 2.5 arcsec resolution (10 times better than SIRTF), SPIRIT will provide 0.25 arcsec resolution, and SPECS will provide 10 milli-arcsec resolution, which is comparable to that of the Hubble Space Telescope.

Leisawitz, David↗

DOE OSTI2025

CMS Token Transition

Within the LHC community, a momentous transition has been occurring in authorization. For nearly 20 years, services within the Worldwide LHC Computing Grid (WLCG) have authorized based on mapping an identity, derived from an X.509 credential, or a group/role, derived from a VOMS extension issued by the experiment. A fundamental shift is occurring to capabilities: the credential, a bearer token, asserts the authorizations of the bearer, not the identity. By the HL-LHC era, the CMS experiment plans for the transition to tokens, based on the WLCG Common JSON Web Token profile, to be complete. Services in the technology architecture include the INDIGO Identity and Access Management server to issue tokens; a HashiCorp Vault server to store and refresh access tokens for users and jobs; a managed token bastion server to push credentials to the HTCondor CredMon service; and HTCondor to maintain valid tokens in long-running batch jobs. We will describe the transition plans of the experiment, current status, configuration of the central authorization server, lessons learned in commissioning token-based access with sites, and operational experience using tokens for both job submissions and file transfers.

43 PARTICLE ACCELERATORS↗

DOE OSTI2022

Countdown to perovskite space launch: Guidelines to performing relevant radiation-hardness experiments

Perovskite photovoltaics (PVs) are under intensive development for promise in terrestrial energy production. Soon, the community will find out how much of that promise may become reality. Perovskites also open new opportunities for lower cost space power. However, radiation tolerance of space environments requires appropriate analysis of relevant devices irradiated under representative radiation conditions. We present guidelines designed to rigorously test the radiation tolerance of perovskite PVs. We review radiation conditions in common orbits, calculate nonionizing and ionizing energy losses (NIEL and IEL) for perovskites, and prioritize proton radiation for effective nuclear interactions. Low-energy protons (0.05-0.15 MeV) create a representative uniform damage profile, whereas higher energy protons (commonly used in ground-based evaluation) require significantly higher fluence to accumulate the equivalent displacement damage dose due to lower scattering probability. Furthermore, high-energy protons may "heal" devices through increased electronic ionization. These procedural guidelines differ from those used to test conventional semiconductors.

14 SOLAR ENERGY↗

NASA NTRSDate not supplied

Investigation of the Potential for Lidar & Polarimeter Combined Aerosol Retrievals Using Various Instrument Combinations

As a scientific community, we are motivated to achieve better observational capabilities for aerosols, to reduce uncertainties about aerosol’s role in climate. Encouraged by the National Academies Decadal Survey, many are looking to the synergy of lidar and polarimeter as a means of achieving improved measurements. Polarimetric observations of total-column radiances have excellent sensitivity to aerosol size distribution and absorption properties. Active lidar measurements have fewer wavelengths and view angles and therefore more limited sensitivity to aerosol microphysical properties such as complex refractive index. Yet the advantage of vertically resolved profiles is game-changing, especially given that models contain significant uncertainty about the vertical distribution of aerosol and that polarimeter and other passive retrievals must make assumptions about vertical distribution which can impact performance. To optimize the synergy, a joint polarimeter + lidar mission requires a joint retrieval. However, the exact instruments that will be launched on a future satellite are unknown, and the capabilities of polarimeters and lidars cover a large range. In this study, we perform information content analysis for a range of nominal instrument combinations. The methodology is ideal for assessing the impact of measurements and a priori information (assumptions and constraints) with respect to the desired retrieval products, and for comparing measurement systems. It has advantages that make it useful in advance of or in parallel with retrieval development, such as producing quantitatively useful comparisons even for retrieval scenarios that are significantly underdetermined and therefore impossible to retrieve without significant assumptions, and it is not impacted by retrieval-specific sources of error such as incomplete or incorrect convergence which can complicate the interpretation of a retrieval performance analysis. Here, we will derive the expected uncertainty in retrieved aerosol concentration, effective radius, fine mode fraction and single scattering albedo, for a combination of a polarimeter with various grades of lidar, from an elastic backscatter lidar, similar to the pathfinder CALIOP on the CALIPSO satellite, to a multi-wavelength high spectral resolution lidar.

Sharon P Burton↗

DOE OSTI2025

Dynamic Rhizodeposition in the Woody Perennial Populus trichocarpa

Plants undergo physiological and metabolic changes that release specific molecules into the surrounding soil, a process collectively known as rhizodeposition. These compounds play crucial roles in plant‐microbe‐soil interactions, such as supporting plant development and resilience in changing environments. Under nutrient‐limited conditions, these plant‐derived compounds modify the rhizosphere environment, mobilizing otherwise inaccessible nutrients and recruiting stress‐adaptive microbial communities that support stress resilience. Currently, the chemical diversity of rhizodeposition has yet to be fully realized but is expected to be a complex mixture that includes soluble organic compounds excreted from root cells, along with products of root cell turnover, sloughed‐off root cap and border cells, and mucilage. Here, we developed a methodological and conceptual framework for an in‐depth measurement of rhizodeposition through critical advancements in untargeted metabolomics. Further, this approach provided foundational insights into the dynamic changes in rhizodeposition for the woody perennial Populus trichocarpa and rhizodeposit profiles varying by genotype, time, location, and environment. More broadly, this study provides a framework that will help formulate the next steps to effectively study rhizodeposition.

59 BASIC BIOLOGICAL SCIENCES↗

NASA NTRS1993

Constraints on the rate of discharge and duration of the Mangala Valles flood

Interest in Mangala Valles remains high within the planetary science community. This is justified because the survey mission images provide us with nearly complete coverage of the system at high resolution. Upcoming high resolution topography from the Mars Observer Laser Altimeter will enable the application of flood discharge models with an unprecedented level of detail. Previous work on the Mangala Valles problem has relied on the available low resolution topography. This has limited the ability of workers to constrain discharge calculations to only within several-order-of-magnitude estimates. Local determinations of channel depths via shadow length measurements and photoclinometric profiling are much more accurate, but can only be applied to steep slopes (and/or low sun elevations) in the case of shadow measurements, or across relatively short distances (to avoid changes in albedo along asymmetric photoclinometric profiles). We are taking stereo parallax measurements from medium resolution Viking Orbiter images, which provide a valuable intermediate check of the topography between those measurements made thus far and the upcoming Mars Observer data. The images used are from orbits 034A and 637A, and cover Mangala Valles from the source graben in Memnonia Fossae to the beginning of the bifurcated reach (at 9.5 deg lat., 151.5 deg lon.). These images are about 300 m/pixel and 250 m/pixel, respectively. Both sets of images were orthographically projected to 250 m/pixel. The separation angle between left-right pairs is approximately 52 degrees. This results in a vertical accuracy on the order of plus or minus 260 m. Though this is still somewhat coarse, the channel relief is clearly resolved. Preliminary profiles across Mangala Valles and the large topographic ridge to the east are shown on the following page. An east-west regional tilt that resulted from slight scaling differences in the digital data has been 'removed' by visually estimating a regional datum on the stereo pairs. North-south variations in scale have not yet been adjusted for, so the zero datum for each profile was simply taken to be the high water line of the channel itself. Our depth measurement for the source breach of about 750 m agrees reasonably well with values of 700-1000 m determined from shadow measurements.

Parker, T. J.↗

NASA NTRS2004

Characteristics and Trade-Offs of Doppler Lidar Global Wind Profiling

Accurate, global profiling of wind velocity is highly desired by NASA, NOAA, the DOD/DOC/NASA Integrated Program Office (IPO)/NPOESS, DOD, and others for many applications such as validation and improvement of climate models, and improved weather prediction. The most promising technology to deliver this measurement from space is Doppler Wind Lidar (DWL). The NASA/NOAA Global Tropospheric Wind Sounder (GTWS) program is currently in the process of generating the science requirements for a space-based sensor. In order to optimize the process of defining science requirements, it is important for the scientific and user community to understand the nature of the wind measurements that DWL can make. These measurements are very different from those made by passive imaging sensors or by active radar sensors. The purpose of this paper is to convey the sampling characteristics and data product trade-offs of an orbiting DWL.

Kavaya, Michael J.↗

NASA NTRS2011

Enterprise Reference Library

Introduction: Johnson Space Center (JSC) offers two extensive libraries that contain journals, research literature and electronic resources. Searching capabilities are available to those individuals residing onsite or through a librarian s search. Many individuals have rich collections of references, but no mechanisms to share reference libraries across researchers, projects, or directorates exist. Likewise, information regarding which references are provided to which individuals is not available, resulting in duplicate requests, redundant labor costs and associated copying fees. In addition, this tends to limit collaboration between colleagues and promotes the establishment of individual, unshared silos of information The Integrated Medical Model (IMM) team has utilized a centralized reference management tool during the development, test, and operational phases of this project. The Enterprise Reference Library project expands the capabilities developed for IMM to address the above issues and enhance collaboration across JSC. Method: After significant market analysis for a multi-user reference management tool, no available commercial tool was found to meet this need, so a software program was built around a commercial tool, Reference Manager 12 by The Thomson Corporation. A use case approach guided the requirements development phase. The premise of the design is that individuals use their own reference management software and export to SharePoint when their library is incorporated into the Enterprise Reference Library. This results in a searchable user-specific library application. An accompanying share folder will warehouse the electronic full-text articles, which allows the global user community to access full -text articles. Discussion: An enterprise reference library solution can provide a multidisciplinary collection of full text articles. This approach improves efficiency in obtaining and storing reference material while greatly reducing labor, purchasing and duplication costs. Most importantly, increasing collaboration across research groups provides unprecedented access to information relevant to NASA s mission. Conclusion: This project is an expansion and cost-effective leveraging of the existing JSC centralized library. Adding key word and author search capabilities and an alert function for notifications about new articles, based on users profiles, represent examples of future enhancements.

Bickham, Grandin↗

DOE OSTI2023

exRNA-eCLIP intersection analysis reveals a map of extracellular RNA binding proteins and associated RNAs across major human biofluids and carriers

Although the role of RNA binding proteins (RBPs) in extracellular RNA (exRNA) biology is well established, their exRNA cargo and distribution across biofluids are largely unknown. To address this gap, we extend the exRNA Atlas resource by mapping exRNAs carried by extracellular RBPs (exRBPs). This map was developed through an integrative analysis of ENCODE enhanced crosslinking and immunoprecipitation (eCLIP) data (150 RBPs) and human exRNA profiles (6,930 samples). Computational analysis and experimental validation identified exRBPs in plasma, serum, saliva, urine, cerebrospinal fluid, and cell-culture-conditioned medium. exRBPs carry exRNA transcripts from small non-coding RNA biotypes, including microRNA (miRNA), piRNA, tRNA, small nuclear RNA (snRNA), small nucleolar RNA (snoRNA), Y RNA, and lncRNA, as well as protein-coding mRNA fragments. Computational deconvolution of exRBP RNA cargo reveals associations of exRBPs with extracellular vesicles, lipoproteins, and ribonucleoproteins across human biofluids. Overall, we mapped the distribution of exRBPs across human biofluids, presenting a resource for the community.

59 BASIC BIOLOGICAL SCIENCES↗

DOE OSTI2020

Dryland feedbacks to future climate change: how species mortality and replacement will affect coupled biogeochemical cycles and energy balance (Final Technical Report)

The overall goal of the dryland climate manipulation experiment is to improve our understanding and ability to forecast dryland responses to increasing temperatures and altered precipitation regimes. Drylands cover over 40% of Earth’s terrestrial surface and are predicted to increase in size 11-23% by 2100. Yet our understanding of this vast biome, which exchanges enormous amounts of CO 2 and energy with the atmosphere, is exceedingly poor. This project aims to transform and improve that understanding in order to reduce uncertainty and increase the confidence with which we can make global predictions of future climate. We focus on both above- and belowground processes, and explore temperature controls over critical aspects of carbon and nutrient cycling for dryland plants, soil, and microbes. We have 60 climate manipulation plots where plants (from above the canopy) and soils are warmed using infrared lamps and where precipitation has been altered using targeted watering regimes. We have measured myriad aspects of plant physiology, morphology, carbon exchange, energy exchange, and phenology, as well as analogous climate-induced changes to biological soil crusts and soil microbial communities. Our goals are to investigate temperature responses and acclimation potential of dryland plant and soil processes. Concurrent soil incubation experiments complement the in-situ soil warming component and enable more controlled mechanistic investigations of temperature response on microbial function. Automated soil CO 2 efflux chambers within the plots provide phenomenal opportunity to improve our understanding of dryland CO 2 exchange with the atmosphere and are coupled with plant CO 2 exchange measurements. The project has been exceptionally successful, with 35 peer-reviewed publications (and more in review), including in high-profile journals such as Nature Climate Change and PNAS. We have given over fifty presentations on the work and it has been featured in many high-profile media outlets, such as Discover Magazine and on NPR.

54 ENVIRONMENTAL SCIENCES↗

DOE OSTI2022

Substrate Utilization and Competitive Interactions Among Soil Bacteria Vary With Life-History Strategies

Microorganisms have evolved various life-history strategies to survive fluctuating resource conditions in soils. However, it remains elusive how the life-history strategies of microorganisms influence their processing of organic carbon, which may affect microbial interactions and carbon cycling in soils. Here, we characterized the genomic traits, exometabolite profiles, and interactions of soil bacteria representing copiotrophic and oligotrophic strategists. Isolates were selected based on differences in ribosomal RNA operon ( rrn ) copy number, as a proxy for life-history strategies, with pairs of “high” and “low” rrn copy number isolates represented within the Micrococcales, Corynebacteriales, and Bacillales. We found that high rrn isolates consumed a greater diversity and amount of substrates than low rrn isolates in a defined growth medium containing common soil metabolites. We estimated overlap in substrate utilization profiles to predict the potential for resource competition and found that high rrn isolates tended to have a greater potential for competitive interactions. The predicted interactions positively correlated with the measured interactions that were dominated by negative interactions as determined through sequential growth experiments. This suggests that resource competition was a major force governing interactions among isolates, while cross-feeding of metabolic secretion likely contributed to the relatively rare positive interactions observed. By connecting bacterial life-history strategies, genomic features, and metabolism, our study advances the understanding of the links between bacterial community composition and the transformation of carbon in soils.

59 BASIC BIOLOGICAL SCIENCES↗

DOE OSTI2024

A Gaussian process guide for signal regression in magnetic fusion

Extracting reliable information from diagnostic data in tokamaks is critical for understanding, analyzing, and controlling the behavior of fusion plasmas and validating models describing that behavior. Recent interest within the fusion community has focused on the use of principled statistical methods, such as Gaussian process regression (GPR), to attempt to develop sharper, more reliable, and more rigorous tools for examining the complex observed behavior in these systems. While GPR is an enormously powerful tool, there is also the danger of drawing fragile, or inconsistent conclusions from naive GPR fits that are not driven by principled treatments. Here we review the fundamental concepts underlying GPR in a way that may be useful for broad-ranging applications in fusion science. We also revisit how GPR is developed for profile fitting in tokamaks. We examine various extensions and targeted modifications applicable to experimental observations in the edge of the DIII-D tokamak. Finally, we discuss best practices for applying GPR to fusion data.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

NASA NTRS2003

Mars Data Visualization and E/PO with Marsoweb

Marsoweb is a collaborative web environment that has been developed for the Mars research community to better visualize and analyze Mars orbiter data. Its goal is to enable online data discovery by providing an intuitive, interactive interface to data from the Mars Global Surveyor and other orbiters. Recently Marsoweb has served a prominent role as a resource center for the site selection process for the Mars Explorer Rover 2003 missions. In addition to hosting a repository of landing site memoranda and workshop talks, it includes a Java-based interface to a variety of datamaps and images. This interface enables the display and numerical querying of data, and allows data profiles to be rendered from user-drawn cross-sections. High-resolution Mars Orbiter Camera (MOC) images (currently, over 100,000) can be graphically perused; browser-based image processing tools can be used on MOC images of potential landing sites. An automated VRML atlas allows users to construct 'flyovers' of their own regions-of-interest in 3D. These capabilities enable Marsoweb to be used for general global data studies, in addition to those specific to landing site selection. As of September 2002, over 70,000 distinct users from NASA, USGS, academia, and the general public have accessed Marsoweb.

Gulick, V. C.↗

NASA NTRS2002

Soho Ultraviolet Coronograph Spectrometer (UVCS) Mission Operations and Data Analysis

Kohl, John L.↗

NASA NTRS2003

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.↗

NASA NTRS2003

Thermal and Chemical Characterization of Composite Materials. MSFC Center Director's Discretionary Fund Final Report, Project No. ED36-18

The purpose of this research effort was to: (1) provide a concise and well-defined property profile of current and developing composite materials using thermal and chemical characterization techniques and (2) optimize analytical testing requirements of materials. This effort applied a diverse array of methodologies to ascertain composite material properties. Often, a single method of technique will provide useful, but nonetheless incomplete, information on material composition and/or behavior. To more completely understand and predict material properties, a broad-based analytical approach is required. By developing a database of information comprised of both thermal and chemical properties, material behavior under varying conditions may be better understood. THis is even more important in the aerospace community, where new composite materials and those in the development stage have little reference data. For example, Fourier transform infrared (FTIR) spectroscopy spectral databases available for identification of vapor phase spectra, such as those generated during experiments, generally refer to well-defined chemical compounds. Because this method renders a unique thermal decomposition spectral pattern, even larger, more diverse databases, such as those found in solid and liquid phase FTIR spectroscopy libraries, cannot be used. By combining this and other available methodologies, a database specifically for new materials and materials being developed at Marshall Space Flight Center can be generated . In addition, characterizing materials using this approach will be extremely useful in the verification of materials and identification of anomalies in NASA-wide investigations.

Stanley, D. C.↗

DOE OSTI2023

BinaRena: a dedicated interactive platform for human-guided exploration and binning of metagenomes

Background: Exploring metagenomic contigs and “binning” them into metagenome-assembled genomes (MAGs) are essential for the delineation of functional and evolutionary guilds within microbial communities. Despite the advances in automated binning algorithms, their capabilities in recovering MAGs with accuracy and biological relevance are so far limited. Researchers often find that human involvement is necessary to achieve representative binning results. This manual process however is expertise demanding and labor intensive, and it deserves to be supported by software infrastructure. Results: We present BinaRena, a comprehensive and versatile graphic interface dedicated to aiding human operators to explore metagenome assemblies via customizable visualization and to associate contigs with bins. Contigs are rendered as an interactive scatter plot based on various data types, including sequence metrics, coverage profiles, taxonomic assignments, and functional annotations. Various contig-level operations are permitted, such as selection, masking, highlighting, focusing, and searching. Binning plans can be conveniently edited, inspected, and compared visually or using metrics including silhouette coefficient and adjusted Rand index. Completeness and contamination of user-selected contigs can be calculated in real time. In demonstration of BinaRena’s usability, we show that it facilitated biological pattern discovery, hypothesis generation, and bin refinement in a complex tropical peatland metagenome. It enabled isolation of pathogenic genomes within closely related populations from the gut microbiota of diarrheal human subjects. It significantly improved overall binning quality after curating results of automated binners using a simulated marine dataset. Conclusions: BinaRena is an installation-free, dependency-free, client-end web application that operates directly in any modern web browser, facilitating ease of deployment and accessibility for researchers of all skill levels. The program is hosted at https://github.com/qiyunlab/binarena, together with documentation, tutorials, example data, and a live demo. It effectively supports human researchers in intuitive interpretation and fine tuning of metagenomic data.

59 BASIC BIOLOGICAL SCIENCES↗