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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 55 records · Page 3
All sourcesNASA NTRSDOE OSTI
DOE OSTI2024

Pennsylvania Department of Environmental Protection (PA DEP) 26r Detailed Produced Water Compositions (version 1.0)

A database of geochemical compositions of aqueous species in produced water reported to the PA DEP. Samples were collected between mid-2012 to early-2020. Data from publicly-available PA DEP 26r reports were scraped from pdf files and cumulated into tabular spreadsheet format for >1000 produced water streams from Marcellus wells in Pennsylvania. In addition to providing the original values, the NETL NEWTS team has reformatted the dataset to allow sample streams to be easily copied into OLI Studio and Geochemist WorkBench (GWB) software for modeling the geochemistry and the recovery of critical minerals, such as lithium, from these produced water streams. In addition, a version of the dataset has been included with predictions for some missing values in the original dataset using machine learning techniques within CoDaRT software, a public ML software developed by the Nation Energy Technology Laboratory. We have made the Input into CoDaRT and one example output from CoDaRT available in this dataset.

Aqueous Chemistry↗
DOE OSTI2026

Observations of Nocturnal Sulfuric Acid Formation in Pittsburgh, PA

Measurements of sulfuric acid (H 2 SO 4 ) and sulfur trioxide (SO 3 ) were conducted in Pittsburgh, Pennsylvania, during field campaigns in Fall 2023 and Fall 2024. These measurements identified nocturnal concentrations of H 2 SO 4 comparable to those of daytime values. Nocturnal H 2 SO 4 concentrations were observed to increase by 5 × 10 5 to 5 × 10 7 molecules cm –3 above background on 16 of the 31 measurement nights. The median peak concentration during events was 6.5 × 10 6 molecules cm –3 , with a maximum of 1.0 × 10 8 molecules cm –3 , exceeding previously reported nighttime concentrations. Increases in H 2 SO 4 concentrations were positively correlated with the anomalously high SO 3 concentrations and condensation sink rates, indicating that the formation of H 2 SO 4 increased to overcome the loss rates to particles. Increases in particulate mass and the mass fraction of metals commonly emitted from coal combustion and steel production were also observed. The air masses were traced back to the southeast of Pittsburgh, a region home to a steel mill, coke plant, and a steel processing plant. The observations indicate a previously unrecognized nighttime formation pathway for H 2 SO 4 , potentially from heterogeneous catalysis with metal or black carbon, originating from steel and coke plant emissions. Further measurements are needed to identify key compounds and chemical processes driving these increases in nocturnal H 2 SO 4 concentrations.

aerosols↗
DOE OSTI2020

International cooperation in age-dating uranium standards for nuclear forensics using the 231 Pa/ 235 U radiochronometer

During 2017–2018 Los Alamos National Laboratory, Lawrence Livermore National Laboratory and the China Institute of Atomic Energy collaborated in an interlaboratory 231 Pa/ 235 U radiochronometry exercise. The laboratories used different analytical methods to obtain a consensus model purification date for CRM U010 of December 28, 1958 ± 198 days and for CRM U850 of May 20, 1958 ± 363 days. These results agree with previously reported model dates using the 230 Th/ 234 U radiochronometer as well as the production histories of these materials. The concordance of interlaboratory data here confirms the ability of laboratories to make reproducible radiochronometry measurements using distinct analytical approaches.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗
DOE OSTI2020

Quantum chemical topology and natural bond orbital analysis of M–O covalency in M(OC 6 H 5 ) 4 (M = Ti, Zr, Hf, Ce, Th, Pa, U, Np)

Covalency is complex yet central to our understanding of chemical bonding, particularly in the actinide series. In this work, we assess covalency in a series of isostructural d and f transition element compounds M(OC 6 H 5 ) 4 (M = Ti, Zr, Hf, Ce, Th, Pa, U, Np) using scalar relativistic hybrid density functional theory in conjunction with the Natural Bond Orbital (NBO), quantum theory of atoms in molecules (QTAIM) and interacting quantum atoms (IQA) approaches. The IQA exchange–correlation covalency metric is evaluated for the first time for actinides other than uranium, in order to assess its applicability in the 5f series. It is found to have excellent correlation with NBO and QTAIM covalency metrics, making it a promising addition to the computational toolkit for analysing metal–ligand bonding. Our range of metrics agree that the actinide-oxygen bonds are the most covalent of the elements studied, with those of the heavier group 4 elements the least. Within the early actinide series, Th stands apart from the other three elements considered, being consistently the least covalent.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2024

Electrical and thermal characteristics of LaB6 thermionic hollow cathodes operating in He, D2, Ar, and Xe at 4–200 Pa and 0.25–5 A cm−2

We report characteristics of lanthanum hexaboride (LaB6) cathodes for conditions relevant to a high-voltage, high-current switching device. LaB6 is selected because of its relatively low work function, stability in the presence of many common gas impurities, and a low evaporation rate (long life) at operating temperatures. We have investigated the effect of cathode geometry, gas type, pressure, and current on a LaB6 hollow cathode in a diode configuration with an opposing planar anode. The gas is stagnant at a relatively low pressure of 4–200 Pa (0.03–1.5 Torr) because of device high-voltage standoff requirements. In all cases, the plasma voltage decreases to a plateau value with increasing current where a practical device would operate. The plateau voltage aligns with the fill gas excitation or ionization voltage, depending on conditions. At high current, the cathode temperature exceeds that required for thermionic emission to supply the total current, a behavior that is understood by accounting for back-diffusing bulk electrons.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2021

Voltage and cathode emission mechanisms of a magnetized, constricted, orbiting plasma in helium 6.7–850 Pa

Abstract We present a semiquantitative description of several important properties of a magnetized cold-cathode plasma in helium over a wide pressure range 6.7–850 Pa. We focus on the ‘constricted orbiting’ mode where the plasma attaches to the cathode as a moving ‘dot’ and the voltage and rate of cathode erosion are both unusually low. We propose that the low plasma voltage and observed motion of the plasma adjacent to the cathode can be attributed to field emission as the source of electrons from the cathode, a process that is aided by the charging of an oxide film by ions. We find that the observed dependence of plasma voltage on pressure is consistent with the assumption that the axial electric field must increase in regions of strong crossed magnetic field to maintain current continuity.

Physics↗
DOE OSTI2021

PA-BCI Meteorological dataset 1985-2018

This data package contains a QA/QC-ed meteorological time series dataset from 1985 to 2018, including relative humidity, temperature, solar radiation, rainfall, wind speed, and barometric pressure at Barro Colorado Island (PA-BCI) in Panama. The data were collected at the elevations of 42 m and 48 m at the BCI Lutz station, except for rainfall that was collected at the BCI Clearing station at the elevation of 1 m. Individual time series datasets were collected using electro-mechanical (electronic sensors, data loggers, chart recorders, etc.). The rainfall dataset was collected using the tipping bucket method, and the data could have been underestimated by 13-17% (likely the large values). The data is included as a single CSV file.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2022

Canopy spectra, Feb2017, PA-SLZ: Panama

Canopy spectra of sunlit canopy of Guarea kunthiana, Brosimum utile, Terminalia amazonia (TERMAM), Vochysia ferruginea (VOCHFE), Miconia borealis (MICOBO) and Guatteria dumetorum (GUATDU) species from the Smithsonian Tropical Research Institute (STRI) canopy crane site in the San Lorenzo National Park, Republic of Panama (PA-SLZ: Bosque Protector San Lorenzo). Canopy spectra were measured at 1:20 – 2 pm on 22 February 2017, using a SVC spectroradiometer. This data package includes the raw SVC data (*.sig), processed data of individual spectra, and processed spectra averaged over the canopy of each of the six trees measured (*.csv). The package also includes photographs of the canopy spectral targets, metadata and the instrument manual. This data was collected as part of the 2017 Brookhaven National Laboratory – Smithsonian Tropical Research Institute leaf traits by age campaign.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2022

Leaf-to-canopy spectral reflectance photographs, Feb2018, PA-SLZ: Panama

Photographs of 37 tree canopies were taken at the Smithsonian Tropical Research Institute (STRI) San Lorenzo Protected Area site, utilising the canopy access crane to view tree crowns. Canopy photos were taken to capture canopy structural information to accompany matching canopy reflectance spectra. Canopy data were recorded in the middle of the day. This collection also includes photographs showing leaf-level detail of branches sampled from each tree, with the photo taken after the branch samples were removed from the trees. These full resolution canopy and branch sample photographs (*.jpg) accompany the dataset "Leaf-to-canopy spectral reflectance, February 2018, PA-SLZ: Panama". Refer to this companion dataset for full metadata, including sample and species information.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2022

Simulated tree recruitment at PA-BCI under four precipitation scenarios

Simulated recruitment rates are provided for four tropical tree plant functional types (PFTs) which vary in drought and shade tolerance, at Barro Colorado Island, Panama (PA-BCI). Recruitment rates are predicted using the Tree Recruitment Scheme (TRS; Hanbury-Brown et al., 2022) and model data output from the Ecosystem Demography model version 2 with hydrodynamics (ED2; Medvigy et al., 2009, Powell et al., 2018). Predictions of recruitment are provided under four precipitation scenarios: “BASE” = recycled 2008-2014 observed meteorology (Faybishenko & Paton, 2021), “SYN-ENSO” = two exceptionally strong El Niño events within 30 years (Powell et al., 2018), “WET” = 30% increase in precipitation compared to BASE, and DRY-DS = dry season (January–April) precipitation reduced by 75% compared to BASE. In addition to recruitment rates, this dataset provides TRS predictions of PFT-specific seed bank and seedling pool dynamics (tracked in units of carbon) and ED predictions of understory photosynthetically active radiation and soil matric potential at 6 cm soil depth.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2022

Leaf C and N content by leaf age, Feb2017, PA-SLZ: Panama

This dataset contains carbon, hydrogen and nitrogen content measurements of sunlit canopy leaves of Apeiba membranacea (APEIME), Guatteria dumetorum (GUATDU), Miconia borealis (MICOBO), Terminalia amazonia (TERMAM), Virola multiflora (VIROSP) and Vochysia ferruginea (VOCHFE) species. Data was collected from the NGEE-Tropics Bosque Protector San Lorenzo (PA-SLZ) site in Panama in February of 2017 as part of the 2017 Brookhaven National Lab–Smithsonian Tropical Research Institute leaf traits by age campaign. A PDF with full sapling protocol is included in this dataset, along with metadata files in Excel file format. Data is in both CSV (Panama2017_CHN.csv) and Excel file formats. See related datasets for further sample details, leaf spectra, sap flow, leaf water potential, leaf mass per area (LMA), and gas exchange measurements.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2020

Prediction of Performance Variation Caused by Manufacturing Tolerances and Defects in Gas Diffusion Electrodes of Phosphoric Acid (PA)–Doped Polybenzimidazole (PBI)-Based High-Temperature Proton Exchange Membrane Fuel Cells

The automated process of coating catalyst layers on gas diffusion electrodes (GDEs) for high-temperature proton exchange membrane fuel cells results inherently into a number of defects. These defects consist of agglomerates in which the platinum sites cannot be accessed by phosphoric acid and which are the consequence of an inconsistent coating, uncoated regions, scratches, knots, blemishes, folds, or attached fine particles—all ranging from μm to mm size. These electrochemically inactive spots cause a reduction of the effective catalyst area per unit volume (cm2/cm3) and determine a drop in fuel cell performance. A computational fluid dynamics (CFD) model is presented that predicts performance variation caused by manufacturing tolerances and defects of the GDE and which enables the creation of a six-sigma product specification for Advent phosphoric acid (PA)-doped polybenzimidazole (PBI)-based membrane electrode assemblies (MEAs). The model was used to predict the total volume of defects that would cause a 10% drop in performance. It was found that a 10% performance drop at the nominal operating regime would be caused by uniformly distributed defects totaling 39% of the catalyst layer volume (~0.5 defects/μm2). The study provides an upper bound for the estimation of the impact of the defect location on performance drop. It was found that the impact on the local current density is higher when the defect is located closer to the interface with the membrane. The local current density decays less than 2% in the presence of an isolated defect, regardless of its location along the active area of the catalyst layer.

Gurau, Vladimir (ORCID:0000000327429061)↗
DOE OSTI2025

Directed flow from parton spin-orbit coupling in $pp$ and $pA$ collisions

We point out a novel mechanism to generate cos φ two-particle azimuthal correlation (‘directed flow’) in unpolarized proton-proton and proton-nucleus collisions in the forward rapidity region of the projectile proton. This is a direct consequence of the recently discovered strong spin-orbit coupling in gluons at small-x. The observable simultaneously serves as a unique probe into the double helicity parton distribution functions of the proton.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2020

Multiplicity and pseudo-rapidity density distributions of charged particles produced in pp, pA and AA collisions at RHIC & LHC energies

Multiplicity and pseudorapidity (η) density (d N ch /dη) distributions of charged hadrons provide key information towards understanding the particle production mechanisms and initial conditions of high-energy heavy-ion collisions. However, detector constraints limit the η-range across which charged particle measurements can be carried out. Extrapolating the measured distributions to large η-range by parameterizing measured distributions and by using calculations from event generators, we characterize the production of charged particles over the full kinematic range. In the present study, we use three different ansätze to obtain quantitative descriptions of the shape of pseudorapidity distributions of charged hadrons produced in pp, p–A, and A–A collisions for beam energies ( s NN ) ranging from a few GeV to a few TeV corresponding to RHIC and LHC energies. We study the limiting fragmentation behavior in these collisions and report evidence for participant-scaling violations in high-energy collisions at the TeV scale. We additionally examine measured pseudorapidity distributions to constrain models describing initial conditions of particle production. We predict the centrality dependence of charged particle multiplicity distributions at FAIR and NICA energies and give an estimation of charged particle multiplicity at η = 0 for the proposed HE-LHC and FCC energies.

Physics↗
DOE OSTI2021

Angular correlations in pA collisions from CGC: multiplicity and mean transverse momentum dependence of $$v_2$$

Abstract Within the dense-dilute Color Glass Condensate approach, and using the Golec–Biernat–Wuesthoff model for the dipole scattering amplitude, we calculate $$v_2^2$$ v 2 2 as well as the correlations between $$v_2^2$$ v 2 2 and both the total multiplicity and the mean transverse momentum of produced particles. We find that the correlations are generally very small consistent with the observations. We note an interesting sharp change in the value of $$v^2_2$$ v 2 2 as well as of its correlations as a function of the width of the transverse momentum bin. This crossover is associated with the change from Bose enhancement dominance of the correlation for narrow bin to HBT dominated correlations for larger bin width.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗