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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 919 records · Page 51
All sourcesNASA NTRSDOE OSTI
DOE OSTI2024

Unconventional superconductivity near a nematic instability in a multi-orbital system

Abstract We analyze superconductivity in a multi-orbital fermionic system near the onset of a nematic order, using doped FeSe as an example. We associate nematicity with spontaneous polarization between d xz and d yz orbitals. We derive pairing interaction, mediated by soft nematic fluctuations, and show that it is attractive, and its strength depends on the position on the Fermi surface. As the consequence, right at the nematic quantum-critical point (QCP), superconducting gap opens up at T c only at special points and extends into finite arcs at T < T c . In between the arcs the Fermi surface remains intact. This leads to highly unconventional behavior of the specific heat, with no jump at T c and seemingly finite offset at T = 0. We discuss gap structure and pairing symmetry away from a QCP and compare nematic and spin-fluctuation scenarios. We apply the results to FeSe 1− x S x and FeSe 1− x Te x .

Materials Science↗
DOE OSTI2020

Green synthesis of reduced Ti 3 C 2 T x MXene nanosheets with enhanced conductivity, oxidation stability, and SERS activity

Transition metal carbides (MXenes) are an emerging family of highly conductive two-dimensional materials with additional functional properties introduced by surface terminations. Further modification of the surface terminations makes MXenes even more appealing for practical applications. Herein, we report a facile and environmentally benign synthesis of reduced Ti 3 C 2 T x MXene (r-Ti 3 C 2 T x ) via a simple treatment with L-ascorbic acid at room temperature. r-Ti 3 C 2 T x shows a six-fold increase in electrical conductivity, from 471 ± 49 for regular Ti 3 C 2 T x to 2819 ± 306 S m -1 for the reduced version. Additionally, we show an enhanced oxidation stability of r-Ti 3 C 2 T x as compared to regular Ti 3 C 2 T x . An examination of the surface-enhanced Raman scattering (SERS) activity reveals that the SERS enhancement factor of r-Ti 3 C 2 T x is an order of magnitude higher than that of regular Ti 3 C 2 T x . The improved SERS activity of r-Ti 3 C 2 T x is attributed to the charge transfer interaction between the MXene surface and probe molecules, re-enforced by an increased electronic density of states (DOS) at the Fermi level of r-Ti 3 C 2 T x . The findings of this study suggest that reduced MXene could be a superior choice over regular MXene, especially for the applications that employ high electronic conductivity, such as electrode materials for batteries and supercapacitors, photodetectors, and SERS-based sensors.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2011

Enhanced damping of ion acoustic waves in dense plasmas

A theory for the ion-acoustic wave damping in dense plasmas and warm dense matter, accounting for the Umklapp process, is presented. A higher decay rate compared to the prediction from the Landau damping theory is predicted for high-Z dense plasmas, where the electron density ranges from 10{sup 21} to 10{sup 24} cm{sup -3} and the electron temperature is moderately higher than the Fermi energy.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2010

A new approach to searching for dark matter signals in Fermi-LAT gamma rays

Several cosmic ray experiments have measured excesses in electrons and positrons, relative to standard backgrounds, for energies from ∼ 10 GeV–1 TeV. These excesses could be due to new astrophysical sources, but an explanation in which the electrons and positrons are dark matter annihilation or decay products is also consistent. Fortunately, the Fermi-LAT diffuse gamma ray measurements can further test these models, since the electrons and positrons produce gamma rays in their interactions in the interstellar medium. Although the dark matter gamma ray signal consistent with the local electron and positron measurements should be quite large, as we review, there are substantial uncertainties in the modeling of diffuse backgrounds and, additionally, experimental uncertainties that make it difficult to claim a dark matter discovery. In this paper, we introduce an alternative method for understanding the diffuse gamma ray spectrum in which we take the intensity ratio in each energy bin of two different regions of the sky, thereby canceling common systematic uncertainties. For many spectra, this ratio fits well to a power law with a single break in energy. The two measured exponent indices are a robust discriminant between candidate models, and we demonstrate that dark matter annihilation scenarios can predict index values that require ''extreme'' parameters for background-only explanations.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2026

Theory of ab initio downfolding with arbitrary-range electron-phonon coupling

Ab initio downfolding describes the electronic structure of materials within a low-energy subspace, often around the Fermi level. Typically starting from mean-field calculations, this framework allows for the calculation of one- and two-electron interactions, and the parametrization of a many-body Hamiltonian representing the active space of interest. The subsequent solution of such Hamiltonians can provide insights into the physics of strongly correlated materials. While phonons can substantially screen electron-electron interactions, electron-phonon coupling has been commonly ignored within ab initio downfolding, and when considered, this is done only for short-range coupling. Here we propose a theory of ab initio downfolding that accounts for short- and long-range electron-phonon coupling on equal footing. Our practical computational implementation is readily compatible with current downfolding approaches. We apply our approach to polar materials MgO and GeTe, and we reveal the importance of both short-range and long-range electron-phonon coupling in determining the magnitude of electron-electron interactions. Our results show that in the static limit, phonons reduce the on-site repulsion between electrons by 40% for MgO and by 79% for GeTe. Our framework also predicts that overall attractive nearest-neighbor interactions arise between electrons in GeTe, consistent with superconductivity in this material.

Tubman, Norm M↗
DOE OSTI2021

Tracing the Mott-Hubbard transition in one-dimensional Hubbard models without Umklapp scattering

Here we apply the density-matrix renormalization group (DMRG) method to a one-dimensional Hubbard model that lacks Umklapp scattering and thus provides an ideal case to study the Mott-Hubbard transition analytically and numerically. The model has a linear dispersion and displays a metal-to-insulator transition when the Hubbard interaction U equals the bandwidth U c = W, where the single-particle gap opens linearly, Δ(U ≥ W) = U - W. The simple nature of the elementary excitations permits us to determine numerically with high accuracy the critical interaction strength and the gap function in the thermodynamic limit. The jump discontinuity of the momentum distribution $n_k$ at the Fermi wave number $k_F$ = 0 cannot be used to locate accurately U c from finite-size systems. However, the slope of $n_k$ at the band edges $k_B$ = ±π, reveals the formation of a single-particle bound state which can be used to determine U c reliably from $n_k$ using accurate finite-size data.

1-dimensional systems↗
DOE OSTI2023

Non-Fermi Liquid Behavior in the Three-Dimensional Hubbard Model

We present a numerical study on the non-Fermi liquid behavior of a three-dimensional strongly correlated system. The Hubbard model in a simple cubic lattice is simulated by the dynamical cluster approximation; in particular, the quasi-particle weight is calculated at finite dopings for a range of temperatures. By fitting the quasi-particle weight to the marginal Fermi liquid form at finite doping near the putative quantum critical point, we find evidence of a separatrix between Fermi liquid and non-Fermi liquid regions. Our results suggest that a marginal Fermi liquid and possibly a quantum critical point exist in the non-symmetry broken solution of the three-dimensional interacting electron systems. We also calculate the spectral function, close to the half-filling, and we obtain evidence of pseudogap.

Kellar, Samuel↗
DOE OSTI2012

BCS-BEC crossover in two dimensions: A quantum Monte Carlo study

We investigate the crossover from Bardeen-Cooper-Schrieffer (BCS) superfluidity to Bose-Einstein condensation (BEC) in a two-dimensional Fermi gas at T= 0 using the fixed-node diffusion Monte Carlo method. We calculate the equation of state and the gap parameter as a function of the interaction strength, observing large deviations compared to mean-field predictions. In the BEC regime our results show the important role of dimer-dimer and atom-dimer interaction effects that are completely neglected in the mean-field picture. We also consider the highly polarized gas and the competition between a polaronic and a molecular picture.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2011

Relativistic distorted-wave analysis of quasielastic proton-nucleus scattering

A relativistic distorted-wave impulse approximation formalism is presented for the calculation of quasielastic proton-nucleus scattering. It is shown that the double differential cross section may be written as a contraction between the hadronic tensor (describing the projectile and ejectile) and the polarization tensor (describing the nuclear target) and that this mathematical structure also holds for the case where distortions are included. The eikonal approximation is used to introduce distortions in the wave functions, and the nuclear response is described using a Fermi gas model. The highly oscillatory nine-dimensional integrand contained in the expression for the double differential cross section is computed using a novel technique based on combining traditional Gaussian integration methods with the powerful fitting functions in the matlab programming language. This work has successfully calculated the distorted-wave quasielastic differential cross section for proton-nucleus scattering within a fully relativistic framework. It is found that the distortions lead to a reduction in the double differential cross section and have a negligible effect on the computed spin observables.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2025

First observations of solar halo gamma rays over a full solar cycle

We analyze 15 years of Fermi-LAT data and produce a detailed model of the Sun’s inverse-Compton scattering emission (solar halo), which is powered by interactions between ambient cosmic-ray electrons and positrons with sunlight. By developing a novel analysis method to analyze moving sources, we robustly detect the solar halo at energies between 31.6 MeV and 100 GeV, and angular extensions up to 45° from the Sun, providing new insight into spatial regions where there are no direct measurements of the Galactic cosmic-ray flux. The large statistical significance of our signal allows us to subdivide the data and provide the first 𝛾-ray probes into the time variation and azimuthal asymmetry of the solar modulation potential, finding time-dependent changes in solar modulation both parallel and perpendicular to the ecliptic plane. Our results are consistent with (but with independent uncertainties from) local cosmic-ray measurements, unlocking new probes into astrophysical processes near the solar surface.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2023

A Cross-correlation Study between IceCube Neutrino Events and the FERMI Unresolved Gamma-Ray Sky

With the coincident detections of electromagnetic radiation together with gravitational waves (GW170817) or neutrinos (TXS 0506+056), the new era of multimessenger astrophysics has begun. Of particular interest are the searches for correlation between the high-energy astrophysical neutrinos detected by the IceCube Observatory and gamma-ray photons detected by the Fermi Large Area Telescope (LAT). So far, only sources detected by the LAT have been considered in correlation with IceCube neutrinos, neglecting any emission from sources too faint to be resolved individually. Here we present the first cross-correlation analysis considering the unresolved gamma-ray background (UGRB) and IceCube events. We perform a thorough sensitivity study, and, given the lack of identified correlation, we place upper limits on the fraction of the observed neutrinos that would be produced in proton–proton or proton–$γ$ interactions from the population of sources contributing to the UGRB emission and dominating its spatial anisotropy (aka blazars). Our analysis suggests that, under the assumption that there is no intrinsic cutoff and/or hardening of the spectrum above Fermi-LAT energies, and that all gamma rays from the unresolved blazars dominating the UGRB fluctuation field are produced by neutral pions from $p–p$ ($p–γ$) interactions, up to 60% (30%) of such a population may contribute to the total neutrino events observed by IceCube. This translates into an O (1%) maximum contribution to the astrophysical high-energy neutrino flux observed by IceCube at 100 TeV.

79 ASTRONOMY AND ASTROPHYSICS↗
NASA NTRS2010

NASA Goddard Space Flight Center, on Behalf of the Fermi Large Area Telescope Collaboration

Because high-energy gamma rays can be produced by processes that also produce neutrinos, the gamma-ray survey of the sky by the Fermi (Gamma-ray Space Telescope offers a view of potential targets for neutrino observations. Gamma-ray bursts. Active Galactic Nuclei, and supernova remnants are all sites where hadronic, neutrino-producing interactions are plausible. Pulsars, pulsar wind nebulae, and binary sources are all phenomena that reveal leptonic particle acceleration through their gamma-ray emission. While important to gamma-ray astrophysics, such sources are of less interest to neutrino studies. This talk will present a broad overview of the constantly changing sky seen with the Large Area Telescope (LAT)on the Fermi spacecraft.

Thompson, David J.↗
DOE OSTI2014

Statistical approach to nuclear level density

We discuss the level density in a finite many-body system with strong interaction between the constituents. Our primary object of applications is the atomic nucleus but the same techniques can be applied to other mesoscopic systems. We calculate and compare nuclear level densities for given quantum numbers obtained by different methods, such as nuclear shell model (the most successful microscopic approach), our main instrument - moments method (statistical approach), and Fermi-gas model; the calculation with the moments method can use any shell-model Hamiltonian excluding the spurious states of the center-of-mass motion. Our goal is to investigate statistical properties of nuclear level density, define its phenomenological parameters, and offer an affordable and reliable way of calculation.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
NASA NTRS2019

Comparing Long-Duration Gamma-Ray Flares and High-Energy Solar Energetic Particles

Little is known about the origin of the high-energy and sustained emission from solar long-duration gamma-ray flares (LDGRFs) identified with the Compton Gamma Ray Observatory, the Solar Maximum Mission, and now Fermi. Though the Fermi Large Area Telescope (LAT) has identified dozens of flares with LDGRF signatures, the nature of this phenomenon has been a challenge to explain due to both extreme energies and long durations. The highest-energy emission has generally been attributed to pion production from the interaction of 300 MeV protons with the ambient matter. The extended duration suggests that particle acceleration occurs over large volumes extending high in the corona, either from stochastic acceleration within large coronal loops or from back precipitation from coronal mass ejection–driven shocks. It is possible to test these models by making a direct comparison between the properties of the accelerated ion population producing the γ-ray emission derived from the Fermi/LAT observations and the characteristics of solar energetic particles (SEPs) measured by the Payload for Matter-Antimatter Exploration and Light Nuclei Astrophysics spacecraft in the energy range corresponding to the pion-related emission detected with Fermi. For 14 of these events, we compare the two populations—SEPs in space and the interacting particles at the Sun—and discuss the implications in terms of potential sources. Our analysis shows that the two proton numbers are poorly correlated, with their ratio spanning more than 5 orders of magnitude, suggesting that the back precipitation of shock-acceleration particles is unlikely to be the source of the F emission.

Nolfo, G. A. de↗
DOE OSTI2020

Clathrate BaNi 2 P 4 : An Interplay of Heat and Charge Transport Due to Strong Host–Guest Interactions

Heat and charge transport properties of the metallic unconventional clathrate BaNi 2 P 4 , hosting Ba cations in oversized Ni 8 P 16 cages, are investigated. A novel method of single-crystal growth was developed, yielding 2–3 mm sized crystals of BaNi 2 P 4 . We also developed a setup to accurately measure thermal conductivity and electrical resistivity of the synthesized single crystals in a wide temperature range avoiding crystal remounting. BaNi 2 P 4 has a metallic temperature dependence of its electrical resistivity (decreasing with decreasing temperature) and manifests an unconventional T 2 power law for 50 K < T < 300 K; below 50 K, the power-law exponent increases gradually such that below 10 K the power law is T 5 , a predicted but extremely rarely experimentally observed dependence for peculiar electron–phonon interactions. Furthermore, electronic band structure calculations, consistent with measurements of de Haas–van Alphen oscillations, show large band dispersions with significant contributions of Ba orbitals to states near the Fermi level, which is atypical for clathrates. The thermal properties of BaNi 2 P 4 were probed using a combination of variable-temperature single-crystal X-ray diffraction experiments, heat capacity measurements, first-principles phonon dispersion calculations, and inelastic neutron scattering measurements. BaNi 2 P 4 exhibits significant hybridization of the Ba-guest and Ni–P-framework vibrational modes, which may be enhanced via the detected split of the Ba position, which results in strong Ba-framework interactions.

36 MATERIALS SCIENCE↗
DOE OSTI2024

Giant optical nonlinearity of Fermi polarons in atomically thin semiconductors

In this study, realizing strong nonlinear optical responses is a long-standing goal of both fundamental and technological importance. Recently, substantial efforts have been focused on exploring excitons in solids to achieve nonlinearities even down to few-photon levels. However, a crucial tradeoff arises as strong light–matter interactions require large oscillator strength and short radiative lifetime of excitons, which limits their nonlinearity. Here we experimentally demonstrate strong nonlinear optical responses with large oscillator strength by exploiting the coupling between excitons and carriers in an atomically thin semiconductor. By controlling the electric field and electrostatic doping of trilayer WSe 2 , we observe the hybridization between intralayer and interlayer excitons and the formation of Fermi polarons. Substantial optical nonlinearity is observed under continuous-wave and pulsed laser excitation, where the Fermi polaron resonance blueshifts by as much as ~10 meV. Intriguingly, we observe a remarkable asymmetry in the optical nonlinearity between electron and hole doping, which is tunable by the applied electric field. We attribute these features to the optically induced valley polarization due to the interactions between excitons and free charges. Our results establish atomically thin heterostructures as a highly versatile platform for engineering nonlinear optical response with applications to classical and quantum optoelectronics.

2d materials↗
DOE OSTI2024

Neural-network quantum states for ultra-cold Fermi gases

Abstract Ultra-cold Fermi gases exhibit a rich array of quantum mechanical properties, including the transition from a fermionic superfluid Bardeen-Cooper-Schrieffer (BCS) state to a bosonic superfluid Bose-Einstein condensate (BEC). While these properties can be precisely probed experimentally, accurately describing them poses significant theoretical challenges due to strong pairing correlations and the non-perturbative nature of particle interactions. In this work, we introduce a Pfaffian-Jastrow neural-network quantum state featuring a message-passing architecture to efficiently capture pairing and backflow correlations. We benchmark our approach on existing Slater-Jastrow frameworks and state-of-the-art diffusion Monte Carlo methods, demonstrating a performance advantage and the scalability of our scheme. We show that transfer learning stabilizes the training process in the presence of strong, short-ranged interactions, and allows for an effective exploration of the BCS-BEC crossover region. Our findings highlight the potential of neural-network quantum states as a promising strategy for investigating ultra-cold Fermi gases.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
NASA NTRS2011

Fermi Gamma-Ray Space Telescope: Highlights of the GeV Sky

Because high-energy gamma rays can be produced by processes that also produce neutrinos. the gamma-ray survey of the sky by the Fermi Gamma-ray Space Telescope offers a view of potenl ial targds for neutrino observations. Gamma-ray bursts. active galactic nuclei, and supernova remnants are all sites where hadronic, neutrino-producing interactions are plausible. Pulsars, pulsar wind nebulae, and binary sources are all phenomena that reveal leptonic particle acceleration through their gamma-ray emission. \Vhile important to gamma-ray astrophysics. such sources are of less interest to neutrino studies. This talk will present a broad overview of the constantly changing sky seen with the Large Area Telescope (LAT) on the Fermi spacecraft.

Thomspon, D. J.↗