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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 1,027 records · Page 57
All sourcesNASA NTRSDOE OSTI
DOE OSTI2024

Understanding electric vehicle ownership using data fusion and spatial modeling

The global shift toward electric vehicles (EVs) for climate sustainability lacks comprehensive insights into the impact of the built environment on EV ownership, especially in varying spatial contexts. This study, focusing on New York State, integrates data fusion techniques across diverse datasets to examine the influence of socioeconomic and built environmental factors on EV ownership. The utilization of spatial regression models reveals consistent coefficient values, highlighting the robustness of the results, with the Spatial Lag model better at capturing spatial autocorrelation. Further, results underscore the significance of charging stations within a 10-mile radius, indicative of a preference for convenient charging options influencing EV ownership decisions. Factors like higher education levels, lower rental populations, and concentrations of older population align with increased EV ownership. Utilizing publicly available data offers a more accessible avenue for understanding EV ownership across regions, complementing traditional survey approaches.

33 ADVANCED PROPULSION SYSTEMS↗
DOE OSTI2020

The ANI-1ccx and ANI-1x data sets, coupled-cluster and density functional theory properties for molecules

Abstract Maximum diversification of data is a central theme in building generalized and accurate machine learning (ML) models. In chemistry, ML has been used to develop models for predicting molecular properties, for example quantum mechanics (QM) calculated potential energy surfaces and atomic charge models. The ANI-1x and ANI-1ccx ML-based general-purpose potentials for organic molecules were developed through active learning; an automated data diversification process. Here, we describe the ANI-1x and ANI-1ccx data sets. To demonstrate data diversity, we visualize it with a dimensionality reduction scheme, and contrast against existing data sets. The ANI-1x data set contains multiple QM properties from 5 M density functional theory calculations, while the ANI-1ccx data set contains 500 k data points obtained with an accurate CCSD(T)/CBS extrapolation. Approximately 14 million CPU core-hours were expended to generate this data. Multiple QM calculated properties for the chemical elements C, H, N, and O are provided: energies, atomic forces, multipole moments, atomic charges, etc. We provide this data to the community to aid research and development of ML models for chemistry.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2020

Interface conformal anomalies

We consider two d ≥ 2 conformal field theories (CFTs) glued together along a codimension one conformal interface. The conformal anomaly of such a system contains both bulk and interface contributions. In a curved-space setup, we compute the heat kernel coefficients and interface central charges in free theories. The results are consistent with the known boundary CFT data via the folding trick. In d = 4, two interface invariants generally allowed as anomalies turn out to have vanishing interface charges. These missing invariants are constructed from components with odd parity with respect to flipping the orientation of the defect. We conjecture that all invariants constructed from components with odd parity may have vanishing coefficient for symmetric interfaces, even in the case of interacting interface CFT.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
NASA NTRS1987

Analysis of Martian ionosphere and solar wind electron gas data from the planar retarding potential analyzer on the Viking spacecraft

Approximate expressions for the electron current collected by a planar retarding potential analyzer (RPA) mounted on a moving, conducting, charged spacecraft are derived. They are utilized for the analysis of electron current data obtained by the RPAs on the Viking spacecraft in the ionosphere of Mars and in the disturbed and undisturbed solar wind near this planet. It is shown that contamination currents by photoelectrons emitted from the spacecraft can be distinguished and removed from the signal. Parameters deduced from the analysis of RPA electron sampling data are the multicomponent electron temperatures, the number densities, and the spacecraft potential.

Mantas, G. P.↗
DOE OSTI2023

Search for doubly charged Higgs boson production in multi-lepton final states using 139 fb$^{-1}$ of proton–proton collisions at $\sqrt{s}$ = 13 TeV with the ATLAS detector

A search for pair production of doubly charged Higgs bosons ($H$ ±± ), each decaying into a pair of prompt, isolated, and highly energetic leptons with the same electric charge, is presented. The search uses a proton–proton collision data sample at a centre-of-mass energy of 13 TeV corresponding to an integrated luminosity of 139 fb -1 recorded by the ATLAS detector during Run 2 of the Large Hadron Collider (LHC). This analysis focuses on same-charge leptonic decays, $H$ ±± → $\ell$ ± $\ell$ '± where $\ell$,$\ell$ ' = $e, μ, τ$, in two-, three-, and four-lepton channels, but only considers final states which include electrons or muons. No evidence of a signal is observed. Corresponding upper limits on the production cross-section of a doubly charged Higgs boson are derived, as a function of its mass $m$($H$ ±± ), at 95% confidence level. Assuming that the branching ratios to each of the possible leptonic final states are equal, $\mathcal{B}$($H$ ±± → $e$ ± $e$ ± ) = $\mathcal{B}$($H$ ±± → $e$ ± $μ$ ± ) = $\mathcal{B}$($H$ ±± → $μ$ ± $μ$ ± ) = $\mathcal{B}$($H$ ±± → $e$ ± $τ$ ± ) = $\mathcal{B}$($H$ ±± → $μ$ ± $τ$ ± ) = $\mathcal{B}$($H$ ±± → $τ$ ± $τ$ ± ) = 1/6, the observed (expected) lower limit on the mass of a doubly charged Higgs boson is 1080 GeV (1065 GeV) within the left right symmetric type-II seesaw model, which is the strongest limit to date produced by the ATLAS Collaboration. Additionally, this paper provides the first direct test of the Zee– Babu neutrino mass model at the LHC, yielding an observed (expected) lower limit of $m$($H$ ±± ) = 900 GeV (880 GeV).

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
NASA NTRS1990

Dissociation and recombination of positive holes in minerals

The formation mechanisms are described of positive holes - electronic defects in the O2 sublattice - with attention given to detecting the positive surface charge of minerals with these holes. Charge distribution analysis (CDA) is presented which measures dielectric polarization in an inhomogeneous field. CDA can be applied to the detection of the peroxide/superoxide functionality caused by positive holes on the surface. It is demonstrated with obsidian that the measurements provide data on O(-) mobility as a function of surface-charge carrier density and on O(-) generation as a function of temperature.

Freund, Friedemann↗
DOE OSTI2024

Tunable Solid‐State Properties and Anisotropic Charge Mobility in Hydrogen‐Bonded Diketopyrrolopyrrole Polymers via Automated Device Fabrication and Characterization

The optoelectronic properties of semiconducting polymers and device performance rely on a delicate interplay of design and processing conditions. However, screening and optimizing the relationships between these parameters for reliably fabricating organic electronics can be an arduous task requiring significant time and resources. To overcome this challenge, Polybot is developed—a robotic platform within a self‐driving lab that can efficiently produce organic field‐effect transistors (OFETs) from various semiconducting polymers via high‐throughput blade coating deposition. Polybot not only handles the fabrication process but also can conduct characterization tests on the devices and autonomously analyze the data gathered, thus facilitating the rapid acquisition of data on a large scale. This work leverages the capabilities of this platform to investigate the fabrication of OFETs using hydrogen bonding‐containing semiconducting polymers. Through high‐throughput fabrication and characterization, various data trends are analyzed, and large extents of anisotropic charge mobility are observed in devices. The materials are thoroughly characterized to understand the role of processing conditions in solid state and electronic properties of these organic semiconductors. The findings demonstrate the effectiveness of automated fabrication and characterization platforms in uncovering novel structure–property relationships, facilitating refinement of rational chemical design, and processing conditions, ultimately leading to new semiconducting materials.

automated fabrication and characterization↗
NASA NTRS1981

Transport, charge exchange and loss of energetic heavy ions in the earth's radiation belts - Applicability and limitations of theory

Computer simulations of processes which control the relative abundances of ions in the trapping regions of geospace are compared with observations from discriminating ion detectors. Energy losses due to Coulomb collisions between ions and exospheric neutrals are considered, along with charge exchange losses and internal charge exchanges. The time evolution of energetic ion fluxes of equatorially mirroring ions under radial diffusion is modelled to include geomagnetic and geoelectric fluctutations. Limits to the validity of diffusion transport theory are discussed, and the simulation is noted to contain provisions for six ionic charge states and the source effect on the radiation belt oxygen ion distributions. Comparisons are made with ion flux data gathered on Explorer 45 and ISEE-1 spacecraft and results indicate that internal charge exchanges cause the radiation belt ion charge state to be independent of source charge rate characteristics, and relative charge state distribution is independent of the radially diffusive transport rate below the charge state redistribution zone.

Spjeldvik, W. N.↗
DOE OSTI2024

Analyzing School Bus Electrification in Richmond, Virginia

School buses are an essential component of the transportation infrastructure, serving as a lifeline for students across the globe. However, the widespread use of diesel school buses has raised concerns about the health impact on millions of students exposed to harmful emissions daily. Recognizing this issue, school districts worldwide are urgently seeking cleaner energy alternatives. Electric school buses emerge as an environmentally friendly and sustainable option, fostering a healthier environment for both students and communities. However, school bus electrification faces the challenges of high upfront cost, cumbersome charging management, and constraints from power grids. To help school bus operators address those challenges, this study presents a data-driven analysis for school bus electrification. This study considered a real-world school bus system in Richmond, VA, and developed a mathematical programming model to analyze the system design, charging strategies, and charging load profiles for the electrification scenario. The study evaluated different charging strategies based on model outcomes, aiming to optimize efficiency and effectiveness. Ultimately, this research generated electric school bus charging demand profiles under various scenarios, shedding light on the feasibility and implications of transitioning to electric-powered school buses.

29 ENERGY PLANNING, POLICY, AND ECONOMY↗
DOE OSTI2021

A framework for integrated dispatching and charging management of an autonomous electric vehicle ride-hailing fleet

The convergence of electrification and automated driving will introduce opportunities to improve the operation and energy-efficiency of transportation systems. This paper discusses the challenges of dispatching autonomous electric vehicles (AEVs) in a ride-hailing fleet and their interactions with charging infrastructure. An integrated decision-making framework for dispatching and charging has been proposed using system optimization approaches. An agent-based platform has been developed for simulating and testing the proposed methods. A case study using New York City taxi data has been performed with different fleet sizes, dispatching strategies, and charging networks. Advantages of optimization-based approaches for AEV fleet management have been studied and demonstrated, for example, for a fleet of 1,750 AEVs to meet 100,000 daily requests, optimization-based centralized fleet management would result in 14% more ride requests satisfied and 43% fewer zero-occupancy miles traveled than if AEVs make independent decisions based on heuristic strategy. Benefits on reducing fleet size and charging downtime from optimization approaches are also comprehensively illustrated.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗
DOE OSTI2022

Synthesis and thermomechanical characteristics of zwitterionic poly(arylene ether sulfone) copolymers

Charge-containing polymeric materials have been widely studied for a range of applications. The fundamental relationships between the charge species, charge density, and the microscale morphology of charge-containing polymers are critical for defining the application in which they may be used. In this work, a series of thermoplastic poly(arylene ether sulfone) (PAES) copolymers with controllable sulfobetaine charge contents (0~100 mol%) and high molecular weights (Mw ~ 65 kDa) were prepared. All the zwitterionic PAESs synthesized showed thermal stability up to 250 °C. DSC and tensile tests showed a decreased T g and mechanical strength with the incorporation of increasing charge density, which suggests a plasticization effect by the charged group. Electron microscopy and X-ray scattering data confirmed the absence of microphase separation in the ion-containing random copolymer system, which corroborated with the observation of a single T g for all zwitterionic copolymers studied. Furthermore, the relative hydrophilicity of the samples was evaluated by water uptake measurements, which revealed that the water uptake of the zwitterionic PAESs can reach up to 64% for the 72 mol% zwitterion copolymer while the free-standing film in the wet state still maintains a Young's modulus of 185 MPa. Here, the thermoplastic charge-containing copolymers in this work demonstrated potential for applications such as coatings or water purification membranes, in which balancing hydrophilicity, processibility, and thermomechanical performance are important.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
NASA NTRS1985

Lead, platinum, and other heavy elements in the primary cosmic radiation - HEAO 3 results

An observation of the abundances of cosmic-ray lead-group and platinum-group nuclei is reported, using data from the HEAO 3 Heavy Nuclei Experiment. From an analysis of 580 days of exposure, 322 nuclei were selected with reasonable charge resolution, E at least 1.3 GeV/nucleon and Z at least 50. The data show a defined abundance peak in the 'platinum' region (Z from 74 to 80), a small abundance of 'lead' (Z from 81 to 83), and a significant number of 'secondary' nuclei in the range of Z between 62 and 73. Possible explanations are offered for the deduced ratio in space of 0.25 plus or minus 0.09 for 'Pb/Pt' being distinctly lower than that predicted by any of the standard models for cosmic-ray sources and propagation effects.

Binns, W. R.↗
DOE OSTI2023

Combination of inclusive top-quark pair production cross-section measurements using ATLAS and CMS data at $ \sqrt{s} $ = 7 and 8 TeV

A combination of measurements of the inclusive top-quark pair production cross-section performed by ATLAS and CMS in proton–proton collisions at centre-of-mass energies of 7 and 8 TeV at the LHC is presented. The cross-sections are obtained using top-quark pair decays with an opposite-charge electron–muon pair in the final state and with data corresponding to an integrated luminosity of about 5 fb$^{−1}$ at $ \sqrt{s} $ = 7 TeV and about 20 fb$^{−1}$ at $ \sqrt{s} $ = 8 TeV for each experiment. The combined cross-sections are determined to be 178.5 ± 4.7 pb at $ \sqrt{s} $ = 7 TeV and $ {243.3}_{-5.9}^{+6.0} $ pb at $ \sqrt{s} $ = 8 TeV with a correlation of 0.41, using a reference top-quark mass value of 172.5 GeV. The ratio of the combined cross-sections is determined to be R$_{8/7}$ = 1.363 ± 0.032. The combined measured cross-sections and their ratio agree well with theory calculations using several parton distribution function (PDF) sets. The values of the top-quark pole mass (with the strong coupling fixed at 0.118) and the strong coupling (with the top-quark pole mass fixed at 172.5 GeV) are extracted from the combined results by fitting a next-to-next-to-leading-order plus next-to-next-to-leading-log QCD prediction to the measurements. Using a version of the NNPDF3.1 PDF set containing no top-quark measurements, the results obtained are $ {m}_t^{\textrm{pole}}={173.4}_{-2.0}^{+1.8} $ GeV and $ {\alpha}_{\textrm{s}}\left({m}_Z\right)={0.1170}_{-0.0018}^{+0.0021} $.[graphic not available: see fulltext]

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
NASA NTRS1973

Propagation anisotropies of solar flare protons and electrons at low energies in interplanetary space.

Flux anisotropies in interplanetary space were investigated for protons with E greater than 0.66 MeV and electrons with E greater than 400 keV. Data were taken from the University of Chicago charged-particle telescope aboard the deep-space probe Pioneer 7 and from the Goddard Space Flight Center magnetometer aboard the same spacecraft. Flux anisotropies lying to the east of the average interplanetary magnetic field direction were first reported by McCracken et al. (1971), late in a solar particle event, for proton energies greater than 7.5 MeV. This work extends this investigation to much lower proton energies, studies the proton and electron anisotropies during both early and late phases of a particle event, and makes use of detailed magnetic field data. The investigation consists of two parts, a study of many periods taken at random during solar events, for both protons and electrons, and a detailed analysis of one period, early in an event, during which the magnetic field was near the solar direction.

Pyle, K. R.↗
DOE OSTI2026

V1G Frequency Regulation: Algorithm Development, Validation & Analysis at Scale

Researchers at Argonne National Laboratory developed and validated a high-fidelity digital twin of a smart charging (V1G) ecosystem to model the participation of up to 1,000 unique electric vehicles (EVs) in the PJM frequency regulation market. Utilizing a discrete-event framework, the simulation models complex interactions, from dynamic grid signals (updated every 2 seconds) to individual EV charging dynamics. The simulation incorporates multiple EV models created from real-world lab test data. Researchers tested multiple control algorithms to balance the dual objectives of maximizing aggregator’s revenue and driver charging needs. Results demonstrate that aggregated EVs function as a controllable, highly effective grid resource, achieving high PJM Performance Scores (80–90%). Additionally, an optimized, market-aware bidding strategy was identified as key to profitability. The platform was shown to provide drivers with an average charging discount of nearly 50%. The algorithm was further validated in the lab using production EVs and charging stations to compare simulation results with real-world performance.

Manne, Nithin↗
NASA NTRS2003

Ultraviolet and Visible Emission Mechanisms in Astrophysics

The project involved the study of ultraviolet (UV) and visible emission mechanisms in astrophysical and atmospheric environments. In many situations, the emission is a direct consequence of a charge transferring collision of an ion with a neutral with capture of an electron to an excited state of the product ion. The process is also important in establishing the ionization and thermal balance of an astrophysical plasma. As little of the necessary collision data are available, the main thrust of the project was the calculation of total and state-selective charge transfer cross sections and rate coefficients for a very large number of collision systems. The data was computed using modern explicit techniques including the molecular-orbital close-coupling (MOCC), classical trajectory Monte Carlo (CTMC), and continuum distorted wave (CDW) methods. Estimates were also made in some instances using the multichannel Landau-Zener (MCLZ) and classical over-the-barrier (COB) models. Much of the data which has been computed has been formatted for inclusion in a charge transfer database on the World Wide Web (cfadc.phy.ornl.gov/astro/ps/data/). A considerable amount of data has been generated during the lifetime of the grant. Some of it has not been analyzed, but it will be as soon as possible, the data placed on our website, and papers ultimately written.

Stancil, Phillip C.↗
DOE OSTI2025

Fractal Scaling of Explosively Driven Product Gases

ABSTRACT Characterization of the interface between explosive product gases and ambient air in an explosion is a complicated task due to the turbulent mixing and inherently three‐dimensional expansion of the interface. This study aims to quantify the evolution of the interface as a temporally varying Hausdorff dimension. Two test series were conducted with Composition C‐4 charges with masses of 105 and 880 g. Imaging data were collected from the time of detonation until shock wave detachment using ultra‐high‐speed cameras. Gas cloud profiles were extracted using automated image processing algorithms, and the Hausdorff dimension of these two‐dimensional slices of the gas cloud was then estimated using boxcounting algorithms. When scaled with standard gas dynamic nondimensional scalings, the Hausdorff dimension of all explosive events appears to collapse towards a single curve. The fireball was initially nonfractal and began to develop fractal properties as the shock wave separated from the detonation products. Artificial perturbation of the charged surface had no detectable impact on the evolution of the Hausdorff dimension in the early development of the fireball outside of error, despite visible phenomenological differences in the early development of mixing on the fireball surface.

42 ENGINEERING↗
NASA NTRS1987

High spacecraft potentials on ISEE-1 in sunlight

Data from two electric field experiments and from the plasma composition experiment on ISEE-1 show that the spacecraft charged to close to -70 V in sunlight at about 0700 UT on March 17, 1978. Data from the electron spectrometer experiment show that there was a potential barrier of some -10 to -20 V about the spacecraft during this event. The potential barrier was effective in turning back emitted photoelectrons to the spacecraft. Potential barriers can be formed by differential charging on the spacecraft or by the presence of space charge. The stringent electrostatic cleanliness specifications imposed on ISEE made the presence of differential charging seem unlikely, if these precautions were effective. Modeling of the event to determine if the barrier was produced by the presence of space charge suggested that this could not explain the observed barrier. The angular shape of the distribution could be successfully modeled as a product of differential charging on the solar arrays. This implies that the conductive coating was not completely effective in preventing differential charging, and that differential charging did occur.

Whipple, E. C., Jr.↗