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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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15 records
All sourcesNASA NTRSDOE OSTI
DOE OSTI2020

On the Minimum Radius of Very Massive Neutron Stars

Prospects of establishing the radii of massive neutron stars in PSR J1614 – 2230 and PSR J0740 + 6620 from Neutron Star Interior Composition ExploreR and Chandra observatories hold the potential to constrain the equation of state (EoS) of matter to densities well beyond those encountered in canonical stars of mass $\sim 1.4\,{M}_{\odot }$. In this work, we investigate the relation between the radii of very massive neutron stars up to the maximum mass, ${M}_{\max }$, supported by dense matter EoSs. Results from models with hadronic matter are contrasted with those that include a first-order hadron-to-quark phase transition. We find that a lower bound on ${M}_{\max }$ with an upper bound on the radius of massive pulsars serves to rule out quark matter that is too soft, and an upper bound on ${M}_{\max }$ with a lower bound on the radius of massive pulsars strongly disfavors a transition into quark matter that is too stiff appearing at low densities. In conclusion, the complementary role played by radius inferences from future gravitational-wave events of inspiraling binary neutron stars is also briefly discussed.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2022

Automating Genetic Algorithm Mutations for Molecules Using a Masked Language Model

Inspired by the evolution of biological systems, genetic algorithms have been applied to generate solutions for optimization problems in a variety of scientific and engineering disciplines. For a given problem, a suitable genome representation must be defined along with a mutation operator to generate subsequent generations. Unlike natural systems which display a variety of complex rearrangements (e.g. mobile genetic elements), mutation for genetic algorithms commonly utilizes only random point-wise changes. Furthermore, generalizing beyond point-wise mutations poses a key difficulty as useful genome rearrangements depend on the representation and problem domain. To move beyond the limitations of manually defined point-wise changes, here we propose the use of techniques from masked language models to automatically generate mutations. As a first step, common subsequences within a given population are used to generate a vocabulary. The vocabulary is then used to tokenize each genome. A masked language model is trained on the tokenized data in order to generate possible rearrangements (i.e. mutations). In order to illustrate the proposed strategy, we use string representations of molecules and use a genetic algorithm to optimize for drug-likeness and synthesizability. Finally, our results show that moving beyond random point-wise mutations accelerates genetic algorithm optimization.

59 BASIC BIOLOGICAL SCIENCES↗
DOE OSTI2020

Multiwavelength Observations of 2HWC J1928+177: Dark Accelerator or New TeV Gamma-Ray Binary?

2HWC J1928+177 is a Galactic TeV gamma-ray source detected by the High Altitude Water Cherenkov (HAWC) Observatory up to ~56 TeV. The HAWC source, later confirmed by the High Energy Stereoscopic System, still remains unidentified as a dark accelerator since there is no apparent supernova remnant or pulsar wind nebula detected in the lower-energy bands. The radio pulsar PSR J1928+1746, coinciding with the HAWC source position, has no X-ray counterpart. In this work, our SED modeling shows that inverse Compton scattering in the putative pulsar wind nebula can account for the TeV emission only if the unseen nebula is extended beyond $r\sim 4^{\prime} $. Alternatively, TeV gamma-rays may be produced by hadronic interactions between relativistic protons from an undetected supernova remnant associated with the radio pulsar and a nearby molecular cloud G52.9+0.1. NuSTAR and Chandra observations detected a variable X-ray point source within the HAWC error circle, potentially associated with a bright infrared (IR) source. The X-ray spectra can be fitted with an absorbed power-law model with N H = (9 ± 3) × 10 22 cm –2 and Γ X = 1.6 ± 0.3 and exhibit long-term X-ray flux variability over the last decade. If the X-ray source, possibly associated with the IR source (likely an O star), is the counterpart of the HAWC source, it may be a new TeV gamma-ray binary powered by collisions between the pulsar wind and stellar wind. Follow-up X-ray observations are warranted to search for diffuse X-ray emission and determine the nature of the HAWC source.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2024

CIRCLEZ : Reliable photometric redshifts for active galactic nuclei computed solely using photometry from Legacy Survey Imaging for DESI

Photometric redshifts for galaxies hosting an accreting supermassive black hole in their center, known as active galactic nuclei (AGNs), are notoriously challenging. At present, they are most optimally computed via spectral energy distribution (SED) fittings, assuming that deep photometry for many wavelengths is available. However, for AGNs detected from all-sky surveys, the photometry is limited and provided by a range of instruments and studies. This makes the task of homogenizing the data challenging, presenting a dramatic drawback for the millions of AGNs that wide surveys such as SRG/eROSITA are poised to detect. This work aims to compute reliable photometric redshifts for X-ray-detected AGNs using only one dataset that covers a large area: the tenth data release of the Imaging Legacy Survey (LS10) for DESI. LS10 provides deep grizW1-W4 forced photometry within various apertures over the footprint of the eROSITA-DE survey, which avoids issues related to the cross-calibration of surveys. We present the results from CIRCLEZ, a machine-learning algorithm based on a fully connected neural network. CIRCLEZ is built on a training sample of 14 000 X-ray-detected AGNs and utilizes multi-aperture photometry, mapping the light distribution of the sources. The accuracy (σNMAD) and the fraction of outliers (η) reached in a test sample of 2913 AGNs are equal to 0.067 and 11.6%, respectively. The results are comparable to (or even better than) what was previously obtained for the same field, but with much less effort in this instance. We further tested the stability of the results by computing the photometric redshifts for the sources detected in CSC2 and Chandra-COSMOS Legacy, reaching a comparable accuracy as in eFEDS when limiting the magnitude of the counterparts to the depth of LS10. The method can be applied to fainter samples of AGNs using deeper optical data from future surveys (for example, LSST, Euclid), granting LS10-like information on the light distribution beyond the morphological type. Along with this paper, we have released an updated version of the photometric redshifts (including errors and probability distribution functions) for eROSITA/eFEDS.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2022

New Clues to the Evolution of Dwarf Carbon Stars From Their Variability and X-Ray Emission

As main-sequence stars with C > O, dwarf carbon (dC) stars are never born alone but inherit carbon-enriched material from a former asymptotic giant branch (AGB) companion. In contrast to M dwarfs in post-mass-transfer binaries, C 2 and/or CN molecular bands allow dCs to be identified with modest-resolution optical spectroscopy, even after the AGB remnant has cooled beyond detectability. Accretion of substantial material from the AGB stars should spin up the dCs, potentially causing a rejuvenation of activity detectable in X-rays. Indeed, a few dozen dCs have recently been found to have photometric variability with periods under a day. However, most of those are likely post-common-envelope binaries, spin–orbit locked by tidal forces, rather than solely spun-up by accretion. Here, we study the X-ray properties of a sample of the five nearest-known dCs with Chandra. Two are detected in X-rays, the only two for which we also detected short-period photometric variability. We suggest that the coronal activity detected so far in dCs is attributable to rapid rotation due to tidal locking in short binary orbits after a common-envelope phase, late in the thermally pulsing (TP) phase of the former C-AGB primary (TP-AGB).

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2020

Blazars at the Cosmic Dawn

The uncharted territory of the high-redshift (z ≳ 3) universe holds the key to understanding the evolution of quasars. In an attempt to identify the most extreme members of the quasar population, that is, blazars, we have carried out a multiwavelength study of a large sample of radio-loud quasars beyond z = 3. Our sample consists of nine γ-ray-detected blazars and 133 candidate blazars selected based on the flatness of their soft X-ray spectra (0.3–10 keV photon index $\leqslant$ 1.75), including 15 with Nuclear Spectroscopic Telescope Array (NuSTAR) observations. The application of the likelihood profile stacking technique reveals that the high-redshift blazars are faint γ-ray emitters with steep spectra. The high-redshift blazars host massive black holes ($\langle$log M BH , M$\bigodot$ $\rangle$> 9) and luminous accretion disks ($\langle$L disk $\rangle$ > 10 46 erg s -1 ). Their broadband spectral energy distributions are found to be dominated by high-energy radiation, indicating their jets are among the most luminous ones. Focusing on the sources exhibiting resolved X-ray jets (as observed with the Chandra satellite), we find the bulk Lorentz factor to be larger with respect to other z > 3 blazars, indicating faster moving jets. In this paper, we conclude that the presented list of high-redshift blazars may act as a reservoir for follow-up observations, such as with NuSTAR, to understand the evolution of relativistic jets at the dawn of the universe.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2021

Advancing Equity in Utility Regulation

Increasingly, states are recognizing equity as a goal of utility regulation, going beyond traditionally stated objectives to ensure that electricity systems are reliable, safe, and fairly priced. State initiatives are critical not only to address historical inequities, but to ensure equitable benefits and burdens in the transition to net-zero emissions by 2050. This report provides four perspectives on advancing equity in electric utility regulation, from representatives of energy justice and consumer organizations and a leading utility in this area. The authors provide recommendations related to regulatory issues such as stakeholder engagement, defining "public interest," intervenor funding, electricity infrastructure siting, access to distributed energy technologies, consumer protections, bill affordability programs, rate design, program design, and metrics to track and evaluate results of policies, regulations, and programs intended to deliver equitable outcomes.

24 POWER TRANSMISSION AND DISTRIBUTION↗
DOE OSTI2021

Strain induced electronic structure, and magnetic and structural properties in quaternary Heusler alloys ZrRhTiZ (Z = Al, In)

In this work, electronic structure, and magnetic and structural properties of quaternary Heusler alloys ZrRhTiZ (Z = Al, In) have been analyzed from first principles calculations. The ferromagnetic ground state and thermodynamical stability of these compounds are supported by relative total energies, and by derived formation and cohesive energies, respectively. The investigated Curie temperatures of the compounds exceed room temperature indicating that these compounds are promising candidates for beyond room temperature spintronics and magneto-electronics applications. Both compounds follow the Slater-Pauling 18 electron rule and exhibit half-metallic ferromagnetic behavior with magnetic moments of 2 μB with 100% spin polarization in one spin channel at the Fermi-level. The effect of uniform strain on half-metallicity of these compounds inverts the band gap from one spin channel to another spin channel with a mixed spin (magnetic moment) regime that can be mapped to an exchange bias like effect observed in some of the magnetic Heusler compounds. The half metallic ferromagnetic behavior is retained within –2 to 2% strain contrasting with the anomalous spin flip in –1% and 1% strain in ZrRhTiZ (Z = Al, In).

36 MATERIALS SCIENCE↗
DOE OSTI2024

2024 roadmap on 2D topological insulators

Abstract 2D topological insulators promise novel approaches towards electronic, spintronic, and quantum device applications. This is owing to unique features of their electronic band structure, in which bulk-boundary correspondences enforces the existence of 1D spin–momentum locked metallic edge states—both helical and chiral—surrounding an electrically insulating bulk. Forty years since the first discoveries of topological phases in condensed matter, the abstract concept of band topology has sprung into realization with several materials now available in which sizable bulk energy gaps—up to a few hundred meV—promise to enable topology for applications even at room-temperature. Further, the possibility of combining 2D TIs in heterostructures with functional materials such as multiferroics, ferromagnets, and superconductors, vastly extends the range of applicability beyond their intrinsic properties. While 2D TIs remain a unique testbed for questions of fundamental condensed matter physics, proposals seek to control the topologically protected bulk or boundary states electrically, or even induce topological phase transitions to engender switching functionality. Induction of superconducting pairing in 2D TIs strives to realize non-Abelian quasiparticles, promising avenues towards fault-tolerant topological quantum computing. This roadmap aims to present a status update of the field, reviewing recent advances and remaining challenges in theoretical understanding, materials synthesis, physical characterization and, ultimately, device perspectives.

Weber, Bent (ORCID:000000018586127X)↗
DOE OSTI2026

Quaternary i-MAX Phases (Mo 2/3 RE 1/3 ) 2 AlC (RE: Dy, Tb, Er): Experimental Characterization and First-Principles Insights into their Fundamental Properties

Rare earth (RE)-based materials have unique electronic, magnetic, and optical properties, leading to the recent discovery of atomically layered solids with the chemical formula (M' 2/3 RE 1/3 ) 2 AlC, which have since garnered significant attention in the scientific community. This study aims to synthesize, characterize, and investigate the structural and thermal stability of the RE i-MAX phases. We prepared i-MAX phases using molybdenum (Mo) as M′ and RE elements as Dy, Tb, and Er, namely (Mo 2/3 Dy 1/3 ) 2 AlC, (Mo 2/3 Tb 1/3 ) 2 AlC, and (Mo 2/3 Er 1/3 ) 2 AlC. Structural characterization through x-ray diffraction (XRD) and Raman spectroscopy confirms the formation of the RE-based i-MAX phase, along with the presence of minor impurity phases in the alloys. Thermogravimetric analysis (TGA) conducted up to 1000°C under ambient conditions reveals that the i-MAX phases remain thermally stable up to approximately 450°C, beyond which oxidation leads to a noticeable weight gain in all samples. Differential scanning calorimetry (DSC) measurements during heating and cooling cycles show endothermic and exothermic peaks for (Mo 2/3 Dy 1/3 ) 2 AlC i-MAX in the 410–420°C range, indicating a temperature-induced minor atomic arrangement. In contrast, these peaks are absent in the Tb- and Er-based i-MAX phases. These findings offer valuable insights into the thermal behavior and stability of these i-MAX phases under thermal stress, contributing to a deeper understanding of their unique properties. Furthermore, first-principles density functional theory (DFT) calculations were performed to investigate the electronic and optical properties of the i-MAX phases. The results reveal their metallic nature, with pronounced contributions from Mo and RE elements near the Fermi level and within the conduction band.

Rare earth↗
DOE OSTI2024

Energy conversion and transport in molecular-scale junctions

Molecular-scale junctions (MSJs) have been considered the ideal testbed for probing physical and chemical processes at the molecular scale. Due to nanometric confinement, charge and energy transport in MSJs are governed by quantum mechanically dictated energy profiles, which can be tuned chemically or physically with atomic precision, offering rich possibilities beyond conventional semiconductor devices. While charge transport in MSJs has been extensively studied over the past two decades, understanding energy conversion and transport in MSJs has only become experimentally attainable in recent years. As demonstrated recently, by tuning the quantum interplay between the electrodes, the molecular core, and the contact interfaces, energy processes can be manipulated to achieve desired functionalities, opening new avenues for molecular electronics, energy harvesting, and sensing applications. This Review provides a comprehensive overview and critical analysis of various forms of energy conversion and transport processes in MSJs and their associated applications. We elaborate on energy-related processes mediated by the interaction between the core molecular structure in MSJs and different external stimuli, such as light, heat, electric field, magnetic field, force, and other environmental cues. Key topics covered include photovoltaics, electroluminescence, thermoelectricity, heat conduction, catalysis, spin-mediated phenomena, and vibrational effects. Furthermore, the review concludes with a discussion of existing challenges and future opportunities, aiming to facilitate in-depth future investigation of promising experimental platforms, molecular design principles, control strategies, and new application scenarios.

Charge transport↗
DOE OSTI2025

Neutrino Theory in the Precision Era

This document summarises discussions on future directions in theoretical neutrino physics, which are the outcome of a neutrino theory workshop held at CERN in February 2025. The starting point is the realisation that neutrino physics offers unique opportunities to address some of the most fundamental questions in physics. This motivates a vigorous experimental programme which the theory community fully supports. \textbf{A strong effort in theoretical neutrino physics is paramount to optimally take advantage of upcoming neutrino experiments and to explore the synergies with other areas of particle, astroparticle, and nuclear physics, as well as cosmology.} Progress on the theory side has the potential to significantly boost the physics reach of experiments, as well as go well beyond their original scope. Strong collaboration between theory and experiment is essential in the precision era. To foster such collaboration, \textbf{we propose to establish a CERN Neutrino Physics Centre.} Taking inspiration from the highly successful LHC Physics Center at Fermilab, the CERN Neutrino Physics Centre would be the European hub of the neutrino community, covering experimental and theoretical activities.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2026

Hidden-sectors search and probe of discrete symmetries at the REDTOP experiment

The $η$ and $η^{\prime}$ mesons are nearly unique in the particle universe since they are nearly Goldstone bosons, and their decay dynamics are strongly constrained. While earlier experiments collected samples of order $\sim 10^{9}η$, the proposed REDTOP (Rare Eta Decays To Observe Physics Beyond the Standard Model) facility targets $\mathcal{O}(10^{14})η$ and $\mathcal{O}(10^{12})η^\prime$, enabling broad searches for physics beyond the Standard Model. In this work, we present studies evaluating REDTOP sensitivity to processes that couple the Standard Model to New Physics through four portals: the Vector (dark photon), the Scalar (Higgs-mixing), the Axion-like, and the Heavy Lepton. In parallel, the proposed statistics allow precise tests of $CP$ and $T$ invariance and lepton universality and improve determinations of the $η/η'$ transition form factors, which are crucial inputs to the hadronic light-by-light contribution to the muon anomalous magnetic moment $(g-2)_μ$.

Gatto, C. [INFN, Naples; Northern Illinois U.]↗
DOE OSTI2025

Exploring the interaction between the MW and LMC with a large sample of blue horizontal branch stars from the DESI survey

The Large Magellanic Cloud (LMC) is a Milky Way (MW) satellite that is massive enough to gravitationally attract the MW disc and inner halo, causing significant motion of the inner MW with respect to the outer halo. In this work, we probe this interaction by constructing a sample of 9866 blue horizontal branch (BHB) stars with radial velocities from the DESI spectroscopic survey out to 120 kpc from the Galactic centre. This is the largest spectroscopic set of BHB stars in the literature to date, and it contains four times more stars with Galactocentric distances beyond 50 kpc than previous BHB catalogues. Using the DESI BHB sample combined with SDSS BHBs, we measure the bulk radial velocity of stars in the outer halo and observe that the velocity in the Southern Galactic hemisphere is different by 3.7σ from the North. Modelling the projected velocity field shows that its dipole component is directed at a point 22 deg away from the LMC along its orbit, which we interpret as the travel direction of the inner MW. The velocity field includes a monopole term that is –24 km s –1 ⁠, which we refer to as compression velocity. This velocity is significantly larger than predicted by the current models of the MW and LMC interaction. This work uses DESI data from its first 2 yr of observations, but we expect that with upcoming DESI data releases, the sample of BHB stars will increase and our ability to measure the MW–LMC interaction will improve significantly.

Galaxy: evolution↗
DOE OSTI2024

Innovating the next generation of commercial smart building software

Nearly 30% of commercial building energy use is wasted due to equipment faults and HVAC controls problems. The result is increased emissions, compromised comfort and productivity, and less reliable coordination of building power needs with a clean grid. The energy impact alone represents $17 billion in potential savings. Today’s smart building software provides a robust solution to address these operational deficiencies. Energy management and information systems (EMIS) are saving up to 9% on average, with two-year paybacks. They are being incorporated into energy management processes, commissioning services, and utility programs. As effective as they are, two barriers prevent even deeper benefits; limited personnel to fix problems once they are identified, and the expense and time to manually implement changes in control systems. In partnership with the research community, the EMIS industry is developing new capabilities to overcome these barriers. Moving beyond siloed products for either fault detection and diagnostics, or optimal control, these new capabilities empower users to not only automatically identify faults, but also to push corrective action, and control improvements to their buildings. In this paper, several areas for enhancements are documented: ‘one-time’ correction of faults such as setpoints, schedules, and economizer lockouts; short-term active testing for automated proportional integral derivative (PID) loop tuning and functional testing; and continuous supervisory control for demand flexibility and year-round efficiency. Results are presented from a pair of partner implementations out of a dozen providers integrating these enhancements into their products, including field tests from across the country, and insights into operator acceptance and integration into operations and maintenance practices.

Casillas, Armando↗