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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 1,333 records · Page 74
All sourcesNASA NTRSDOE OSTI
DOE OSTI2025

Extreme flood return levels in a U.S. mid-Atlantic estuary using 40-year fluvial-coastal model simulations

Using an integrated watershed-coastal modeling framework, we conducted long-term historical simulations (1980-2019) of fluvial and coastal flooding in the Delaware Bay and River, a vulnerable estuarine system in the U.S., at high spatial resolutions. By applying process-based models, we generated physically consistent and spatially detailed estimates of estuarine, riverine, and surge-driven extreme water level compared to previous studies that used field data only. We then evaluated changes in the magnitude of flood events using the 40-year simulations and detrended Floodwater Depth values with stationary extreme value analysis. Our detailed assessment of spatial-varying extreme values revealed how different flood-generation mechanisms can dominate various zones in the estuary. The datasets produced through this work will be valuable for long-term flood hazard mitigation planning in coastal communities in the Delaware Bay and River region. Additionally, this work will serve as a benchmark for other coastal flood hazard modeling communities worldwide, aiding them in systematically modeling long-term and continuous extreme flood events.

Coastal and Riverine Flooding↗
DOE OSTI2015

Mechanism of water oxidation by [Ru(bda)(L)₂]: The return of the "blue dimer"

We describe here a combined solution-surface-DFT calculations study for complexes of the type [Ru(bda)(L)₂] including X-ray structure of intermediates, their reactivity, as well as pH-dependent electrochemistry and spectroelectrochemistry. These studies shed light on the mechanism of water oxidation by [Ru(bda)(L)₂], revealing key features unavailable from solution studies with sacrificial oxidants.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2026

Perturbative second-order optical susceptibility of bulk materials: a symmetry-enforced return to non-orthogonal localized basis sets

The second-order optical susceptibility of semiconductors $\chi^{(2)}_{ijk}(-2\omega;\omega,\omega)$ finds application in metrology, spectroscopy, telecommunications, material characterization, and quantum information. Pioneering calculations of $\chi^{(2)}_{ijk}(-2\omega;\omega,\omega)$ utilized non-orthogonal Gaussian orbitals centered at atoms. That formulation transitioned into plane-wave-based algorithms as time went by. As of late, nevertheless, multiple tools for calculating optical susceptibilities have recast the problem using Wannier (i.e. localized) orbitals, making a comeback onto frameworks based on localized basis sets. Here, in this work, we present an approach for calculating $\chi^{(2)}_{ijk}(-2\omega;\omega,\omega)$ reliant on numerical pseudo-atomic orbitals (PAOs) within perturbation theory in the velocity gauge. Its salient feature is a calculation of ‘Slater–Koster-like’ two-center integrals of the momentum operator in between PAOs identified by symmetry. The approach was successfully tested on paradigmatic cubic silicon carbide (3C-SiC) and gallium arsenide, for which linear responses are contributed as well.

Huamán, Angiolo [Univ. of Arkansas, Fayetteville, ↗
DOE OSTI2017

Will kinematic Sunyaev-Zel'dovich measurements enhance the science return from galaxy redshift surveys?

Yes. Future CMB experiments such as Advanced ACTPol and CMB-S4 should achieve measurements with S/N of > 0.1 for the typical host halo of galaxies in redshift surveys. These measurements will provide complementary measurements of the growth rate of large scale structure f and the expansion rate of the Universe H to galaxy clustering measurements. This paper emphasizes that there is significant information in the anisotropy of the relative pairwise kSZ measurements. We expand the relative pairwise kSZ power spectrum in Legendre polynomials and consider up to its octopole. Assuming that the noise in the filtered maps is uncorrelated between the positions of galaxies in the survey, we derive a simple analytic form for the power spectrum covariance of the relative pairwise kSZ temperature in redshift space. While many previous studies have assumed optimistically that the optical depth of the galaxies τ{sub T} in the survey is known, we marginalize over τ{sub T}, to compute constraints on the growth rate f and the expansion rate H . For realistic survey parameters, we find that combining kSZ and galaxy redshift survey data reduces the marginalized 1-σ errors on H and f to ∼50-70% compared to the galaxy-only analysis.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2024

Number of bits returned by a quantum estimation

We give two upper bounds to the mutual information in arbitrary quantum estimation strategies. The first is based on some simple Fourier properties of the estimation apparatus. The second is derived using the first, but, interestingly, depends only on the Fisher information of the parameter, so it is valid even beyond quantum estimation. We illustrate the usefulness of these bounds by characterizing the quantum phase estimation algorithm in the presence of noise. In addition, for the noiseless case, we extend the analysis beyond applying the bound and we discuss the optimal entangled and adaptive strategies, clarifying inaccuracies appearing on this topic in the literature.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2022

Return of the templates: Revisiting the Galactic Center excess with multimessenger observations

The Galactic center excess (GCE) remains one of the most intriguing discoveries from the Fermi Large Area Telescope (LAT) observations. We revisit the characteristics of the GCE by first producing a new set of high-resolution galactic diffuse gamma-ray emission templates. This diffuse emission, which accounts for the bulk of the observed gamma rays, is ultimately due to cosmic-ray interactions with the interstellar medium. Using recent high-precision cosmic-ray observations, in addition to the continuing Fermi-LAT observations and observations from lower energy photons, we constrain the properties of the galactic diffuse emission. We describe a large set of diffuse gamma-ray emission templates which account for a very wide range of initial assumptions on the physical conditions in the inner galaxy. The broad properties of the GCE that we find in this work are qualitatively unchanged despite the introduction of this new set of templates, though its quantitative features appear mildly different than those obtained in previous analyses. In particular, we find a high-energy tail at higher significance than previously reported. This tail is very prominent in the northern hemisphere, and less so in the southern hemisphere. This strongly affects one prominent interpretation of the excess: known millisecond pulsars are incapable of producing this high-energy emission, even in the relatively softer southern hemisphere, and are therefore disfavored as the sole explanation of the GCE. The annihilation of dark matter particles of mass 40 - 7 + 10 GeV (95% CL) to b quarks with a cross-section of ⟨ σ A v ⟩ = 1. 4 - 0.3 + 0.6 × 10 - 26 cm 3 s − 1 provides a good fit to the excess especially in the relatively cleaner southern sky. Dark matter of the same mass range annihilating to b quarks or heavier dark matter particles annihilating to heavier Standard Model bosons can combine with millisecond pulsars to provide a good fit to the southern hemisphere emission as well, as can a broken power-law spectrum which would be related to recent cosmic-ray burst activity. As part of this paper, we make publicly available all of our templates and the data covariance matrix we have generated to account for systematic uncertainties.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗