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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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At least 271 records · Page 15
All sourcesNASA NTRSDOE OSTI
DOE OSTI2018

Factorization and resummation for groomed multi-prong jet shapes

Observables which distinguish boosted topologies from QCD jets are playing an increasingly important role at the Large Hadron Collider (LHC). These observables are often used in conjunction with jet grooming algorithms, which reduce contamination from both theoretical and experimental sources. In this paper we derive factorization formulae for groomed multi-prong substructure observables, focusing in particular on the groomed D 2 observable, which is used to identify boosted hadronic decays of electroweak bosons at the LHC. Our factorization formulae allow systematically improvable calculations of the perturbative D 2 distribution and the resummation of logarithmically enhanced terms in all regions of phase space using renormalization group evolution. They include a novel factorization for the production of a soft subjet in the presence of a grooming algorithm, in which clustering effects enter directly into the hard matching. We use these factorization formulae to draw robust conclusions of experimental relevance regarding the universality of the D 2 distribution in both e+e- and pp collisions. In particular, we show that the only process dependence is carried by the relative quark vs. gluon jet fraction in the sample, no non-global logarithms from event-wide correlations are present in the distribution, hadronization corrections are controlled by the perturbative mass of the jet, and all global color correlations are completely removed by grooming, making groomed D 2 a theoretically clean QCD observable even in the LHC environment. Lastly, we compute all ingredients to one-loop accuracy, and present numerical results at next-to-leading logarithmic accuracy for e + e - collisions, comparing with parton shower Monte Carlo simulations. Results for pp collisions, as relevant for phenomenology at the LHC, are presented in a companion paper.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2019

Colonie, New York, FUSRAP Site: Pathway from Remediation to Redevelopment - 19465

The Colonie, New York, Formerly Utilized Sites Remedial Action Program (FUSRAP) Site consists of a 4.5-hectare (11.2-acre) US Department of Energy (DOE)-owned vacant property (Main Site) and 56 commercial and residential vicinity properties (VPs). The site was owned and operated by National Lead Industries (NL) from 1937 to 1984. The Main Site was used for manufacturing fuel and weapons components using uranium and thorium. Depleted uranium dust was emitted from exhaust stacks that contaminated the site and the VPs. NL also filled in portions of the site with industrial waste and released contaminants to groundwater. The state court shut the plant down in 1984. The site was acquired by DOE in 1985, which remediated the VPs and began to remediate the Main Site up to 1997. The US Army Corps of Engineers (USACE) undertook remedial actions beginning in 1997. The site has three Operable Units (Main Site, Groundwater, and VPs). The Main Site soil was remediated to residential standards except for three small easement areas. The soils in the easement areas are safe for exposure to workers. There is a groundwater plume beneath the site that will require the use of monitoring and temporary land use controls until cleanup standards are met. The VPs require no further action. A 2-year transition period from USACE to the DOE Office of Legacy Management (LM) began on June 18, 2018, with the receipt of the Site Closeout Report from USACE. LM has determined that the 4.5-hectare site is excess to its mission needs and intends to pursue sale of the property for redevelopment. There are several processes required before the disposal can occur. Organizations with similar sites that are federally owned and ready for private redevelopment may benefit from reviewing the Colonie site disposition processes. This paper will discuss (1) Determining disposal alternatives for the Colonie, New York, site. (2) Describing the federal requirements for the disposal of excess real property. (3) Communicating to stakeholders that the site is ready for disposal. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗
DOE OSTI2023

Total metals, carbon, nitrogen & anion concentration data; Slate River & East River floodplains, Crested Butte, CO; May 2022-October 2022

This data package includes processed and undiluted measurements for metal, total carbon, total nitrogen, and anion concentrations from pore water (groundwater) and surface water samples from the Slate River and East River floodplains of Crested Butte, CO, focus field sites for the SLAC Floodplain Hydro-Biogeochemistry SFA. The data was generated as part of the work targeting the overarching research question for the SLAC SFA: How do ubiquitous subsurface interfaces mediate molecular-scale biogeochemical processes and groundwater quality in floodplains and watersheds? Samples were collected between May and October of 2022. These measurements were all recorded at the Arizona Laboratory for Emerging Contaminants (ALEC) at the University of Arizona located in Tucson, AZ. Groundwater samples were extracted from a network of installed rhizon (Rhizosphere Research Products, part no. 19.60.21F, 0.6 micrometer mesh size) and piezometer wells within the river floodplain. All water samples were shaded from sun exposure during extraction from the subsurface and preserved at 4C until measured at ALEC.Analysis by ICP-MS (metals):Measurements for total metals were made on the Agilent 7700x ICP-MS (for total metals) – Agilent Technologies, Santa Clara, CA. The analytical QA/QC protocol was adapted from US EPA Method 200.8 for analysis by ICP-MS. Calibration standards were prepared from multi-element stock solutions (SPEX Certiprep, Metuchen, NJ). Calibration curves include at least 7 points with correlation coefficients > 0.995. The QC protocol includes a continuing calibration blank (CCB), a continuing calibration verification (CCV) solution and at least one quality control sample (QCS) to be analyzed just after calibration and again after every 12 samples and at the completion of the run. The QCS solutions are from an independent source, such as NIST SRM 1643e - Trace elements in water, or QCS solutions from High Purity Standards (Charleston, SC). Acceptable QC responses must be between 90 and 110% of the certified value. Lastly, a suitable internal standard (usually Rh, In, Ga or Ge) is added using on-line addition into the sample line and mixing tee.Analysis by Shimadzu TOC-L (TOC/TN):The TOC-L system is a combustion technique where liquid samples are injected and combusted into CO2 for carbon detection by non-dispersive infrared (NDIR) and NO for detection by chemiluminescence. A calibration curve using five standard solutions between 0.1 and 7 ppm for carbon and 0.05 and 3.5 ppm for nitrogen is made for each type of measurement with a linearity >0.99. All samples, standards, and QC’s are prepared in 24mL scintillation vials that have been baked for 4hrs at 475 Cº and made using RO water (18.2mΩ). QC’s include a calibration blank check (CCB), continuing calibration check (CCC), and a certified reference material check (CRM). All QC’s are within ±10% error and are run before and after each batch of samples. Samples are diluted and rerun if any measurement concentrations are above the highest standard.Analysis by Ion Chromatography (Anions):The instrument used is the Thermo Scientific Dionex ICS-6000 using AS+AG22 column set for anion analysis with sodium carbonate eluent. A calibration curve using five standard solutions between 5 and 250 umol/L is made with a linearity >0.99. Standards and QC’s are prepared in 15mL polypropylene conical tubes, pipetted along with the samples into 1.5mL polypropylene vials. Dilutions are made using RO water (18.2mΩ). QC’s include a calibration blank check (CCB), continuing calibration check (CCC), and a certified reference material check (CRM). All QC’s are within ±10% error and are run before and after each batch of samples. Samples are diluted and rerun if any measurement concentrations are above the highest standard.All files are in csv format.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2019

Ambient vapor sampling and selective cluster formation for the trace detection of tributyl phosphate via atmospheric flow tube mass spectrometry

In addition to serving as an f-element ligand and rare-earth method complexing agent, tributyl phosphate (TBP) is a compound containing core functional groups that mimic those routinely found in degradation products from industrial processes. Because detection of trace quantities of TBP can provide insight into the routes of contamination and degradation in the environment, there is a need to develop methods capable of detecting trace quantities of TBP. Vapor detection at atmospheric pressure is one approach that is both sensitive and rapid. We present here the use of atmospheric flow tube mass spectrometry (AFT-MS) for the ambient vapor sampling of TBP from headspace of ppb-level solutions in methanol. Gas phase clustering reactions were to enhance detection levels via the addition of small quantities of the dopants diethylamine (DEA), triethylamine (TEA), and pinacolyl methylphosphonate (PMP) in the vapor stream. Detection of the TBP vapor emanating from these solutions demonstrated a linear range for the protonated TBP species of 1-1000 ppb from solution. The clusters of TBP with DEA, TEA, and PMP each yielded linear ranges of 1-250 ppb for TBP in solution. Despite smaller linear ranges, the addition of these dopant species added a layer of analytical selectivity and reduced variability in signals from quality control samples. These data were obtained using an AFT source coupled to a linear ion trap mass spectrometer, which demonstrates the applicability of trapping systems to the AFT ionization technique while monitoring positive ions.

Ambient vapor sampling, Dielectric barrier dischar↗
DOE OSTI2019

Evolution of Stakeholder Relations at the Mound Laboratory-End of DoE's Mission to the Present - 19551

In November 1989, the same month the Berlin Wall fell, the US Environmental Protection Agency (EPA) placed the Mound Laboratory (Mound Plant or Mound site) in Ohio on the National Priorities List (NPL) due to volatile organic compound contamination in the groundwater. As a result of the Cold War ending, the United States sought to greatly reduce the nation's nuclear weapons arsenal, consolidate the US Department of Energy's (DOE) mission, and close many DOE facilities. In 1991, the City of Miamisburg learned that DOE was planning to close the Mound Laboratory. The city spent two years lobbying in Washington, DC, to keep the facility open; however, that effort was not successful. By 1993, DOE, EPA, and Ohio EPA had signed a Federal Facility Agreement that formalized EPA and Ohio EPA oversight of the DOE environmental cleanup of the Mound NPL site under the Comprehensive Environmental Response, Compensation, and Liability Act (CERCLA). The decontamination and cleanup of the Mound site fell under two federal laws, CERCLA and the Resource Conservation and Recovery Act. DOE, EPA, Ohio EPA, the City of Miamisburg, and other local stakeholders all agreed that the Mound site should be cleaned up to an industrial/commercial land use standard. This would allow the site to transition into a privately owned business park. In 1994, the City of Miamisburg created the nonprofit Miamisburg Mound Community Improvement Corporation (MMCIC) that would own, market, and redevelop the site. The City also chartered the Mound Reuse Committee to act as an independent advisory organization, composed of representatives from the local community and business, government, education, and special interest groups. In 1994, DOE and the MMCIC entered into a lease agreement that facilitated immediate reuse of site buildings that were no longer required by DOE and did not require remediation. In 1995, DOE, EPA, and Ohio EPA developed the Mound 2000 Process to more effectively use CERCLA Removal Action authority to evaluate and remediate, as necessary, disparate areas of the Mound site. The Mound 2000 process divided the site into smaller, more manageable areas that accelerated cleanup and allowed areas to be reused more quickly. All areas of the Mound site were cleaned up to meet the EPA standard for industrial/commercial land use. The CERCLA process included opportunities for the public to review proposed cleanup strategies. Public input on cleanup and reuse included that from local citizens, businesses, Miamisburg City Council, local schools and financial institutions, Ohio EPA, Montgomery County, and the State of Ohio. In 1998, while site cleanup was still in process, DOE agreed to sell the entire Mound property to the MMCIC for $10.00. The site sales agreement accelerated reuse by allowing DOE to offer ownership of discrete land parcels to MMCIC as soon as EPA confirmed those areas met CERCLA standards for property transfer. This allowed the Mound site to become one of the first former DOE weapons sites to transition to reuse as a privately owned and operated community asset. Many other former DOE production facilities require continued federal ownership to protect the integrity of the environmental cleanup. In 2011, the MMCIC changed its name to the Mound Development Corporation (MDC) and continued to transition the site for reuse as part of the Mound Business Park. The MMCIC/MDC is a nonprofit economic development arm of the City of Miamisburg. DOE supported the economic development efforts with grants and matching funds. Individual land parcels were transferred from DOE to the MDC according to the DOE Mound Land Transfer Process. Ownership of parcels was transferred to the MDC via quitclaim deeds with no repair, replacements, or rebuild of areas. Each parcel's quitclaim deed contains the CERCLA institutional controls. To reduce the property tax burden, the Miamisburg City Council passed an ordinance that allowed the City to accept temporary ownership of specific parcels and hold ownership until the MDC could either lease or sell them. With the exception of one 23-acre parcel that includes the Operable Unit 1 area (site of former sanitary landfill), the entire site has been transferred to the MDC. Today, the former Mound Laboratory site is home to the vibrant Mound Business Park operated by the MDC. The site contains numerous buildings with active businesses and multiple areas suitable for new construction. Private companies continue cutting-edge work that carries forward the legacy of more than 50 years of DOE research, development, production, and inspiration from the former Mound Laboratory scientists, engineers, technicians, and support personnel. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗
DOE OSTI2023

Rapid denitrification of nitrate-contaminated groundwater in a low-gradient blackwater stream valley

Leaching of excess nitrogen (N) to groundwater in fertilized landscapes can overwhelm natural biogeochemical processes and cause long-term eutrophication of aquatic systems. We investigated N fate and transport from an intensively managed short-rotation woody crop (Pinus taeda) plantation through the riparian zone of an intermittent, low-gradient blackwater stream. Fertilization of the P. taeda plantation on the uplands resulted in contamination of groundwater with nitrate concentrations between 0.9 and 1.9 mg N L -1 . No corresponding increase in nitrate was observed in stream water or shallow groundwater in the riparian zone. Groundwater travel-time modeling predicted that N from near-stream, upland plantation areas should have reached streams during the monitoring period. Two years of measuring N species in well water in contrasting landscape positions (within the plantation, swale, riparian edge, forested hillslope, and valley), indicated rapid nitrate transformation and denitrification within the forested wetland valleys. Denitrification in the shallow groundwater system within the toeslopes and the riparian zone was estimated to have removed > 90% of nitrate. Finally, these results highlight the importance of riparian zones as pathways for the removal of N and for controlling downstream N loads.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2018

Predicting the effectiveness of different mulching techniques in reducing post-fire runoff and erosion at plot scale with the RUSLE, MMF and PESERA models

Highlights: • RUSLE, MMF and PESERA, were able to predict the erosive response in burned areas and their mitigation. • These models can be calibrated at a small spatial scale and provide accurate results at greater spatial scales. • RUSLE model ideal for fast and simple risk assessment. • MMF or PESERA models could be the base of a post-fire management decision tool. Wildfires have become a recurrent threat for many Mediterranean forest ecosystems. The characteristics of the Mediterranean climate, with its warm and dry summers and mild and wet winters, make this a region prone to wildfire occurrence as well as to post-fire soil erosion. This threat is expected to be aggravated in the future due to climate change and land management practices and planning. The wide recognition of wildfires as a driver for runoff and erosion in burnt forest areas has created a strong demand for model-based tools for predicting the post-fire hydrological and erosion response and, in particular, for predicting the effectiveness of post-fire management operations to mitigate these responses. In this study, the effectiveness of two post-fire treatments (hydromulch and natural pine needle mulch) in reducing post-fire runoff and soil erosion was evaluated against control conditions (i.e. untreated conditions), at different spatial scales. The main objective of this study was to use field data to evaluate the ability of different erosion models: (i) empirical (RUSLE), (ii) semi-empirical (MMF), and (iii) physically-based (PESERA), to predict the hydrological and erosive response as well as the effectiveness of different mulching techniques in fire-affected areas. The results of this study showed that all three models were reasonably able to reproduce the hydrological and erosive processes occurring in burned forest areas. In addition, it was demonstrated that the models can be calibrated at a small spatial scale (0.5 m{sup 2}) but provide accurate results at greater spatial scales (10 m{sup 2}). From this work, the RUSLE model seems to be ideal for fast and simple applications (i.e. prioritization of areas-at-risk) mainly due to its simplicity and reduced data requirements. On the other hand, the more complex MMF and PESERA models would be valuable as a base of a possible tool for assessing the risk of water contamination in fire-affected water bodies and for testing different land management scenarios.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2018

Tin Oxynitride Anodes by Atomic Layer Deposition for Solid-State Batteries

Major advances in thin-film solid-state batteries (TFSSBs) may capitalize on 3D structuring using high-aspect-ratio substrates such as nanoscale pits, pores, trenches, flexible polymers, and textiles. This will require conformal processes such as atomic layer deposition (ALD) for every active functional component of the battery. In this paper, we explore the deposition and electrochemical properties of SnO 2 , SnN y , and SnO x N y thin films as TFSSB anode materials, grown by ALD using tetrakisdimethylamido(tin), H 2 O, and N 2 plasma as precursors. By controlling the dose ratio between H 2 O and N 2 , the N–O fraction can be tuned between 0% N and 95% N. The electrochemical properties of these materials were tested across a composition range varying from pure SnO 2 , to SnON intermediates, and pure SnNy. In TFSSBs, the SnNy anodes are found to be more stable during cycling than the SnO 2 or SnO x N y films, with an initial reversible capacity beyond that of Li–Sn alloying, retaining 75% of their capacity over 200 cycles compared to only 50% for SnO 2 . Lastly, the performance of the SnO x N y anodes indicates that SnN y anodes should not be negatively impacted by small levels of O contamination.

36 MATERIALS SCIENCE↗
DOE OSTI2025

Montane Conifer, Aspen, Meadow, and Sagebrush Metagenome Resolved Genomes and Traits in East River Watershed, Colorado, USA

Climate change is driving vegetation shifts in mountain watersheds, with unknown impacts on biogeochemical cycles. We hypothesize that these shifts will reshape soil microbiomes and associated biogeochemical processes. As a part of Lawrence Berkeley National Laboratory (LBNL) Watershed Science Focus Area (SFA), we assessed microbiome and microbial functional trait differences between soils under conifer, aspen, forby meadows, and sagebrush across the East River Watershed, CO, controlling for elevation and aspect.Here we present metagenome assembled genomes (MAGs) for the bacterial and archaeal communities from soils 0-20cm in depth across three locations in the watershed—Headwaters, Upper Reaches, and Lower Reaches from August 3-11th 2016. Each location was further subdivided into two blocks, with one block on a west facing aspect, and two on the east aspect of the valley. Within blocks, two samples per vegetation type were taken (one at each depth). This resulted in 66 samples, which were sequenced at JGI and can be found under the Joint Genome Institute (JGI) Genomes Online Database (GOLD) sequencing project Gs0118068. Metagenomes were assembled through an inhouse pipeline (see methods), binned using four autobinners (concoct, maxbin2, metabat2, and vamb) and consolidated using dastool. The consolidated bins from all metagenomes were pooled, filtered by completeness (>75%) and contamination (<25%), and dereplicated at 95% ANI using drep. The dataset includes a zip file of 687 genomes (Vegtype_MAGS.zip), the accession numbers for the underlying metagenomes, a csv file with MAG quality metrics and taxonomy from Genome Taxonomy Database (GTDB) and National Center for Biotechnology Information (NCBI) taxonomic representative genome proteins (EastRiver_Vegtype_drep_genome_info.csv), and a file containing MAG quality metrics and taxonomy (gtdb_drep_bin_taxonomy.csv). The dataset additionally includes a sample metadata file (EastRiver_Vegtype_sample_metadata.csv), a metadata file used to register associated samples with IGSNs (International Generic Sample Numbers) (samples.csv), a Google KML file for the sampled locations (sample_collection_sites.kml), a location metadata file (locations.csv), a file-level metadata file (flmd.csv), and a data dictionary (dd.csv) file.This work was supported by the Watershed Function Science Focus Area at Lawrence Berkeley National Laboratory funded by the US Department of Energy, Office of Science, Biological and Environmental Research under Contract No. DE-AC02-05CH11231.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2025

Short-Term Inhibition and Long-Term Enhancement of Irreversible Trace Metal Binding to Goethite in Multi-Metal Systems

Iron (oxyhydr)oxide minerals are important sorbents of trace metals in aquatic environments. Adsorption–desorption hysteresis has been documented for trace metals after aging, suggesting that they become incorporated over time. We previously found that ion size controls the extent of irreversible metal binding of single metals to goethite. In this study, we evaluate how the presence of multiple metals influences irreversible binding. Mixed Ni–Zn and Ni–Cd solutions were aged with goethite at pH 7 for 2 days, 30 days, and 60 days, after which isotope exchange experiments were performed to assess the lability of the adsorbed metal pools. After 2 days of aging, Ni and Cd in mixed-metal systems were more labile than in single-metal systems, indicating that competitive adsorption may partially block irreversible binding on short time scales. After 60 days, all three metals had larger irreversibly bound fractions than in single-metal systems. X-ray absorption near-edge structure (XANES) spectroscopy indicates that irreversibly bound fractions correlate with incorporation into goethite. This study demonstrates that pools of coadsorbed metals are bioaccessible on a time scale of minutes. Cooperative effects promote the structural sequestration of even large trace metals, causing reactive transport models to likely overpredict metal mobility. Long-term metal entrapment processes hinder micronutrient availability, impact contaminant sequestration and critical mineral recovery, and yield complex pathways through which metal solubilization may be enhanced or hindered during redox cycling.

58 GEOSCIENCES↗
DOE OSTI2020

FX Hg Fogging Fixative Deployment for Mercury Vapor Suppression

Idaho National Laboratory’s (INL) FX Hg fixative solution was deployed at the Y-12 Complex in Oak Ridge, Tennessee to support disposal of mercury-contaminated metal debris. The fixative was dispensed via fogging. Fogging infiltrates non-line-of-sight areas improving fixative coating on complex geometries such as debris piles. FX Hg is the mercury vapor controlling derivative of INL’s FX2 fixative. FX2 was jointly developed with the National Nuclear Laboratory of the United Kingdom, and INL developed the FX Hg derivative to suppress mercury vapor generation. The Y-12 deployment was performed in concert with cleanup contractor UCOR. A dumpster filled with debris was fogged with FX Hg. The material was acceptable as municipal landfill waste, save for the mercury vapor levels measured. If the mercury vapor generation rate could be sufficiently reduced, disposal costs for this waste would be dramatically reduced. FX Hg had previously proven effective at significantly reducing mercury vapor generation rates in bench scale testing at INL. This deployment was the first field scale deployment of the method. Efficacy results were underwhelming, but interpretation of the outcome is complicated by a paucity of hard data. Methods for improving data capture and analysis are analyzed. Operational difficulties associated with scaling the process up and process improvements for future deployments are discussed.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗
DOE OSTI2022

Preferential Solute Transport in Low Permeability Zones During Spontaneous Imbibition in Heterogeneous Porous Media

Multiphase flows in porous media|and the associated solute transport processes|are controlled by a combination of gravity, capillary, and viscous forces. Geologic heterogeneity influences flow and transport processes, yet gaps exist in our understanding of how heterogeneity impacts capillary-driven transport, such as during spontaneous imbibition. Here we use positron emission tomography, combined with a newly developed method for conducting spontaneous imbibition experiments, to observe solute transport into low permeability regions during imbibition. Using an experimentally parameterized 2D numerical model, we demonstrate how capillary-driven ow near the imbibition front can carry solutes into low permeability regions. This process displaces solutes from high permeability zones while the cumulative amount of solute in low permeability zones increases- opposite of what is observed under fully saturated solute transport conditions. These results highlight the complex flow and solute transport behavior that arise during multiphase displacements in heterogeneous geologic porous media.

58 GEOSCIENCES↗
DOE OSTI2018

Challenges of Remote Handling in Windowless Hot Cells - 18341

Facilities such as nuclear power stations and neutron sources produce radioactive waste, which must be handled in shielded containment chambers [hot cells]. Traditionally these hot cells are built with lead glass windows to allow direct observation by operators, however, as the complexity and size of handling operations increases, the restrictions imposed by such windows becomes problematic. For the International Thermonuclear Experimental Reactor [ITER] under construction in the South of France and the European Spallation Source [ESS] under construction in Lund, Sweden the hot cell must be capable of processing large, activated and contaminated components, requiring the dexterous tele-manipulation of high dose payloads in the cell. Using lead glass windows would severely restrict the operational envelope within the cell to the volumes directly in front of the windows. This places unreasonable constraints on the types of handling operations that can be carried out. Conversely, a windowless configuration is much more flexible and maximises the operational space for robotic manipulators. Windowless hot cells do however introduce their own challenges. This paper examines the difficulties introduced by lack of direct sight and describes solutions to overcome them. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗
DOE OSTI2025

Metagenome-assembled genomes from soil samples in control and warming plots in Blodgett Forest, CA (2014-2021)

The pathways of carbon transport and loss through and from soils—soil organic matter (SOM) depolymerization to dissolved organic carbon and mineralization to carbon dioxide (CO2)—are fundamentally driven by microbial activity, which is strongly regulated by environmental conditions. As part of LBNL (Lawrence Berkeley National Laboratory) TES (Terrestrial Ecosystem Science) Belowground Biogeochemistry Science Focus Area (SFA), we have established a novel whole-soil long-term warming experiment at the University of California (UC) Blodgett Forest Research Station (Sierra Nevada) in 2014, where we study the role of biogeochemical, microbial and geochemical process interactions in SOM decomposition and stabilization.Here, we present metagenome-assembled genomes (MAGs) for the bacterial and archaeal community from soil depth profiles collected from 2014 to 2021 from three paired control and warming plots. We collected soil samples across a range of depth profiles (spanning surface to 90 cm deep) from three paired control and warming plots from a temperate mixed forest in Northern California. Each paired plot had been subjected to experimental warming since June 2014 to simulate a predicted climate change scenario for northern California. 101 soil metagenomes were sequenced at JGI (Joint Genome Institute) and UCSF (University of California San Francisco) Center for Advanced Technology and can be found under the JGI (Joint Genome Institute) GOLD (Genomes Online Database) Sequencing project Gs0151586 and NCBI (National Center for Biotechnology Information) Projects PRJNA1225762 and PRJEB39497. Metagenomes were assembled using JGI (Joint Genome Institute) Metagenome Workflow (10.1128/mSystems.00804-20). For each metagenome, the assembled contigs were binned into genomes using 3 binning algorithms (cocacola, metabat, and maxbin) and the resulting bins were consolidated using dastool. The consolidated bins from all metagenomes were pooled, filtered by completeness (>50%) and contamination (<25%), and dereplicated at 99% ANI (average nucleotide identity) using dRep (https://github.com/MrOlm/drep).The dataset includes a zip file of 2321 MAG (Metagenome Assembled Genome) fasta files, the accession numbers for the underlying metagenomes, and a csv file with MAG (Metagenome Assembled Genome) quality metrics and taxonomic classification (GTDB -Genome Taxonomy Database-RS220). This dataset also includes a file-level metadata (flmd.csv) file that lists each file contained in the dataset with associated metadata and a data dictionary (dd.csv) file that contains column/row headers used throughout the files along with a definition, units, and data type. A sample metadata file (samples.csv) that contains site information has also been included.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2018

Dissolution Behavior of Iron and Steel Materials in Liquid Magnesium

The dissolution of metallic elements from Fe and steel materials into pure liquid Mg was investigated with the aim of improving control of impurities in Mg during processes such as Mg-alloy production and Ti smelting. Pure Mg was melted between 1073 and 1323 K (800 and 1050 °C) for 24 to 96 hours in closed crucibles made of pure Fe, low-carbon steel, or austenitic stainless steel SUS316. From the experiments using the pure Fe crucible, the relationship between the solubility of Fe in liquid Mg [C{sub sol,Fe} (mass pct)] and temperature [T (K)] was determined to be log(C{sub sol,Fe}) = − 3.67 × 10{sup 3}/T + 2.48 (± 0.06), from which the standard Gibbs energy of Fe dissolution in liquid Mg was evaluated. The amount of Fe dissolved from low-carbon steel was the same as that from pure Fe. From SUS316, not only Fe but also Cr and Ni dissolved into liquid Mg; the Fe and Cr concentrations in liquid Mg did not change significantly over time, whereas the Ni concentration increased monotonically. Preferential Ni dissolution resulted in a Ni-poor layer on the SUS316 surface. Finally, using the experimental data of Fe dissolution from low-carbon steel, the Fe contamination route in the current Ti smelting process, where a large amount of Mg is used as a reducing agent, is discussed.

36 MATERIALS SCIENCE↗
DOE OSTI2018

Hydrogen Sensor for Parabolic Trough Expansion Tanks

The National Renewable Energy Laboratory and Acciona Energy North America are developing and implementing a process that addresses the issue of hydrogen buildup in parabolic trough power plants. We are pursuing a method that selectively removes hydrogen from the expansion tanks of the power plant to control hydrogen levels in the circulating heat-transfer fluid. As part of this effort, we are developing a sensor that measures hydrogen partial pressure in the expansion-tank headspace gas. During previous work, we demonstrated that our sensor design measures hydrogen levels over a wide partial pressure range from 1.33 mbar down to 0.003 mbar with an accuracy of +/-20%. We acquired these results under limited conditions because we measured hydrogen partial pressure in gas mixtures of hydrogen and nitrogen only. In this paper, we report our most recent results in which we measured hydrogen partial pressures in gas mixtures that contain hydrogen, nitrogen, biphenyl, and diphenylether. Our results for this gas mixture were essentially the same as those obtained for the hydrogen/nitrogen mixture only, and they also had the same accuracy of +/-20%. This level of accuracy is sufficient to evaluate the performance of a hydrogen mitigation process because hydrogen partial pressure in the expansion tank decreases more than an order of magnitude when the mitigation process is operating. We examined the palladium/silver membrane after completing these measurements and did not observe any signs of membrane deterioration or contamination due to exposure to biphenyl and diphenylether at 405 degrees C. The membrane for these tests was 25 um thick. For the next sensor design that we are developing in 2018, we are using a membrane that is 127 um thick. This thickness is required for the membrane to withstand the 150 psi pressure drop across the membrane when exposed to actual headspace gas from the expansion tank. We performed initial tests in which we exposed a 127-um-thick palladium alloy membrane to 400 degrees C and 150 psi pressure drop and observed no signs of failure or gas leakage. Finally, we developed a transient model that accounts for hydrogen transport mechanisms within the sensor when measurements are made. Our model accounted for hydrogen diffusion through the boundary layer that is adjacent to the membrane and for hydrogen permeation across the membrane and into the permeate volume. Our modeling results agreed very closely with our experimental data when we assumed a boundary-layer thickness of 0.2 cm. This thickness is within the range of expected thicknesses for this gas composition, temperature, and pressure at minimum flowrate. Our model results showed that hydrogen diffusion through the boundary layer adjacent to the membrane is the rate-determining step for the transient pressure response when measuring hydrogen partial pressure.

14 SOLAR ENERGY↗
DOE OSTI2019

A Comparison of GoldSim, RESRAD-Onsite, and NORMALYSA Modeling Tools at Radioactive Waste Sites - 19480

Radioactive waste disposal and associated decision making is a challenging problem around the world. A strong performance assessment model plays a crucial role in making good management and remediation decisions and in optimizing the performance of a site. The International Atomic Energy Agency (IAEA) MODARIA II Working Group 1 (WG1) is comparing the performance of various modeling platforms used at Naturally Occurring Radioactive Material (NORM) and legacy waste sites to support risk-informed decision making. Neptune and Company, Inc. (Neptune) has developed probabilistic performance assessment models using the GoldSim system modeling software at a variety of radioactive waste sites. This paper presents a comparison between GoldSim and two other tools used to evaluate radiation exposure and their associated risks: the NORM And Legacy Site Assessment (NORMALYSA) tool used to assess risk at the Zapadnoe mill tailings site, and the residual radioactivity (RESRAD-Onsite) computer program used to calculate Authorized Limits at the Los Alamos National Laboratory (LANL). The International Atomic Energy Agency (IAEA) supported development of NORMALYSA based off of Ecolego 6.0, in which the user connects several universal modules, representing various environmental transport and exposure pathways, and enters in site-specific data. Further work with NORMALYSA has continued under the MODARIA II WG 1. A radionuclide transport and dose calculation model of the Zapadnoe uranium mill tailings site at the Pridneprovsky Chemical Plant in the Ukraine has been configured by MODARIA II WG1 to test the capabilities of NORMALYSA. Under this test case, contaminant transport and effective dose calculations were performed for two exposure scenarios. The onsite worker is exposed via external ground irradiation and radon and radioactive dust inhalation. The offsite resident defines a residence established 300 years after institutional control has ended, 800 meters downstream from the site with exposure pathways including: ingestion of garden vegetables irrigated by contaminated ground water, ingestion of fish from the Konoplyanka River and agricultural activities in the contaminated garden. GoldSim modeling software is a dynamic probabilistic modeling platform that evaluates uncertainty in a robust and transparent manner. Although GoldSim provides contaminant and radionuclide transport modules to facilitate integrated modeling of radionuclide migration in the environment, these features are not embedded in an existing modeling framework, except as created by the user. Neptune developed a GoldSim model for the two exposure scenarios of the Zapadnoe test case. Neptune's Generic PA Model was used as a starting point for the Zapadnoe site. Input parameters for the GoldSim model include site-specific parameters from the MODARIA Working Group as well as parameters from the Generic PA Model and other PA models created by Neptune. For the other comparison, Version 7.0 of RESRAD-Onsite, developed by Argonne National Laboratory for the U.S. Department of Energy (DOE), was used to calculate Authorized Limits for LANL. Authorized Limits are concentrations of radionuclides in soil that support the evaluation process to clear land for release under different uses. The RESRAD-Onsite computer code was used to calculate Authorized Limits because this program was specifically designed to derive radionuclide soil guidelines corresponding to a specific dose criterion. The scope of the RESRAD dose or risk evaluation is constrained to the transport and exposure pathways that have been included in the computer code. To assist in illustrating the capability of GoldSim modeling software, a GoldSim model was created to replicate the calculation of LANL's Authorized Limits for soil. The main exposure pathways in this model are inhalation of dust and gas, plant ingestion, soil ingestion, and external ground irradiation. All of the processes and outputs of RESRAD-Onsite and NORMALYSA can be created in a GoldSim model, but the value of GoldSim lies in its flexibility for application to any of a wide variety of environmental modeling problems. GoldSim allows development of site-specific inventory, transport mechanisms and risk assessment scenarios. If all potentially complete release, transport, and exposure pathways are addressed in an existing dose and risk assessment computer code, and if the code's capabilities fulfill the project modeling objectives, then expending resources to create a GoldSim model may not be necessary. Site optimization and good decision making about site management are often best when supported with the flexibility of GoldSim as a modeling tool. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗
DOE OSTI2020

FX Hg Fogging Fixative Deployment for Mercury Vapor Suppression - 20410

Idaho National Laboratory's (INL) FX Hg fixative solution was deployed at the Y-12 National Security Complex in Oak Ridge, Tennessee to support disposal of mercury-contaminated metal debris. The fixative was dispensed via fogging. Fogging infiltrates non-line-of-sight areas improving fixative coating on complex geometries such as debris piles. FX Hg is the mercury vapor controlling derivative of INL's FX2 fixative. FX2 was jointly developed with the National Nuclear Laboratory of the United Kingdom, and INL developed the FX Hg derivative to suppress mercury vapor generation. The Y-12 deployment was performed in concert with UCOR (URS CH2M Oak Ridge), the cleanup contractor for Y-12. A dumpster filled with debris was fogged with FX Hg. The debris was acceptable as municipal landfill waste, save for the mercury vapor levels measured. If the mercury vapor generation rate could be sufficiently reduced, disposal costs for this waste would be dramatically reduced. FX Hg had previously proven effective at significantly reducing mercury vapor generation rates in bench scale testing at INL. This deployment was the first field-scale deployment of the method. Efficacy results were underwhelming, but interpretation of the outcome is complicated by a paucity of hard data. Methods for improving data capture and analysis are analyzed. Operational difficulties associated with scaling up the process and process improvements for future deployments are discussed. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗