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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 361 records · Page 20
All sourcesNASA NTRSDOE OSTI
DOE OSTI2023

Energy-conserving coupled trajectory mixed quantum–classical dynamics

The coupled-trajectory mixed quantum–classical method (CTMQC), derived from the exact factorization approach, has successfully predicted photo-chemical dynamics in a number of interesting molecules, capturing population transfer and decoherence from first principles. Furthermore, due to the approximations made, CTMQC does not guarantee energy conservation. We propose a modified algorithm, CTMQC-E, which redefines the integrated force in the coupled-trajectory term so to restore energy conservation, and demonstrate its accuracy on scattering in Tully’s extended coupling region model and photoisomerization in a retinal chromophore model.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2023

Estimating cross-field particle transport at the outer midplane of TCV by tracking filaments with machine learning

Abstract Cross-field transport of particles in the boundary region of magnetically confined fusion plasmas is dominated by turbulence. Blobs, intermittent turbulent structures with large amplitude and a filamentary shape appearing in the scrape-off layer (SOL), are known from theoretical and experimental studies to be the main contributor to the cross-field particle transport. The dynamics of blobs differs depending on various plasma conditions, including triangularity ( δ ). In this work, we analyze triangularity dependence of the cross-field particle transport at the outer midplane of plasmas with δ = + 0.38 , +0.15, −0.14, and −0.26 on the Tokamak à Configuration Variable, using our novel machine learning (ML) blob-tracking approach applied to gas puff imaging data. The cross-field particle flux determined in this way is of the same order as the overall transport inferred from KN1D, GBS, and SOLPS-ITER simulations, suggesting that the blobs identified by the ML blob-tracking account for most of the cross-field particle transport in the SOL. Also, the ML blob-tracking and KN1D show a decrease in the cross-field particle transport as δ becomes more negative. The blob-by-blob analysis of the result from the tracking reveals that the decrease of cross-field particle transport with decreasing δ is accompanied by a decrease in the number of blobs in a fixed time, which tend to have larger area and lower radial speed. Also, the blobs in these plasmas are in the connected sheath regime, and show a velocity scaling consistent with the two-region model.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2025

The effect of African Easterly Wave suppression by periodicity on Atlantic tropical cyclones

Research has shown that suppressing African Easterly Waves (AEWs) does not reduce basin-wide North Atlantic tropical cyclone (TC) frequency but can enhance TC environmental favorability. We investigated the AEW-TC relationship further by examining the effects of suppressing the two AEW periodicities individually on TC activity. Using regional model simulations, AEWs were prescribed or suppressed in the 2–6 d or 6–10 d ranges through the lateral boundary conditions. Seasonal TC frequency increased significantly when either AEW periodicity was suppressed, with a larger increase when the 2–6 d waves were suppressed. We also found that suppressing the 2–6 d waves increased mid-tropospheric moisture by up to 8%, as well as overall atmospheric instability, near the western coast of northern Africa. Furthermore, the convective disturbances that developed into TCs exhibited stronger rotation, increased ascending motion, and higher rainfall. Our results suggest that reduced 2–6 d AEW activity may trigger a more active TC season.

Danso, Derrick K↗
DOE OSTI2021

δ 13 C methane source signatures from tropical wetland and rice field emissions

The atmospheric methane (CH 4 ) burden is rising sharply, but the causes are still not well understood. One factor of uncertainty is the importance of tropical CH 4 emissions into the global mix. Isotopic signatures of major sources remain poorly constrained, despite their usefulness in constraining the global methane budget. Here, a collection of new δ 13 C CH 4 signatures is presented for a range of tropical wetlands and rice fields determined from air samples collected during campaigns from 2016 to 2020. Long-term monitoring of δ 13 C CH 4 in ambient air has been conducted at the Chacaltaya observatory, Bolivia and Southern Botswana. Both long-term records are dominated by biogenic CH 4 sources, with isotopic signatures expected from wetland sources. From the longer-term Bolivian record, a seasonal isotopic shift is observed corresponding to wetland extent suggesting that there is input of relatively isotopically light CH 4 to the atmosphere during periods of reduced wetland extent. This new data expands the geographical extent and range of measurements of tropical wetland and rice δ 13 C CH 4 sources and hints at significant seasonal variation in tropical wetland δ 13 C CH 4 signatures which may be important to capture in future global and regional models.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2025

Light right-handed smuons at the LHC: Natural dark matter and g μ − 2 in an unexplored realm of the phenomenological MSSM

We introduce an in-depth study of an unprobed phenomenological minimal supersymmetric Standard Model region offering a natural solution to dark matter. Since the 1980s this region has been referred to as the “bulk,” consisting of sub 200 GeV neutralinos and right-handed smuons. The bulk satisfies recent muon g μ − 2 measurements and sustains consistency with all presently operating SUSY experiments and LHC constraints. Initial ingress into the bulk will arrive soon via the LUX-ZEPLIN 1000-day experiment. The ATLAS Collaboration at the LHC has confirmed that observation of these light right-handed smuon events can occur at the ongoing LHC Run 3 and forthcoming High-Luminosity LHC. Moreover, the future FCC-ee and CEPC circular colliders should handily observe the events. Published by the American Physical Society 2025

Yin, Xiangwei (ORCID:0000000193823206)↗
DOE OSTI2025

Integral X-ray diffuse scattering for studying irradiation-induced dislocation loops in single crystals

Numerical diffuse scattering cross-section calculations are used to establish a rigorous basis for determining the concentration and size distribution of dis­location loops in irradiated single crystals from integral X-ray diffuse scattering (XRDS) measurements. Differential XRDS intensities for prismatic {111} type dislocation loops are numerically calculated as a function of loop radius R and wavevectors q relative to Bragg reflections in tungsten. The results show the well known 1/q 2 Huang scattering form at small q that transitions to a ∼1/q 4 dependence associated with the Stokes–Wilson approximation for q ≳ 1/R. More importantly, they show further that the 1/q 4 falloff is not the asymptotic large-q form of the diffuse scattering for small loops (R < 200 Å) as has often been assumed. Rather, for loop sizes as small as R ≃ 5 Å with strong curvature, the calculations show definitively that the scattering transitions to a robust 1/q 5 falloff at larger q that arises due to the local strains near the dislocation core defining the circumference of the dislocation loops. The presence of this 1/q 5 asymptotic form for both small and large loops is experimentally confirmed using an integral XRDS measurement around the 110 reflection on self-ion-irradiated tungsten combined with numerically calculated integral XRDS cross-sections. Accordingly, the historical two-region theoretical treatment of the cross-sections for integral XRDS is extended to a three-region model that has direct sensitivity to the (first-moment) dislocation line lengths of dislocation loops. In conclusion, these developments enable the use of both numerical and analytically modeled cross-sections to make accurate integral XRDS determinations of dislocation loop sizes and concentrations using modest-intensity laboratory X-ray sources.

42 ENGINEERING↗
DOE OSTI2025

Shoreline wave breaking strongly enhances the coastal sea spray aerosol population: Climate and air quality implications

Sea spray aerosol (SSA) emission is a major source of atmospheric aerosols, influencing global climate and coastal air quality. Much of our knowledge about SSA derives from coastal observations near shorelines, but whether and when these observations accurately represent open oceans remain unclear. Here, we show that strong nearshore SSA production during high-wave periods greatly enhances downwind cloud condensation nuclei (CCN) and aerosol mass concentrations. Strong shoreline wave breaking is widespread globally, and swell waves, which are decoupled from local winds, play a dominant role in many coastal regions. Therefore, extrapolating results based on coastal measurements to open oceans may significantly overestimate SSA concentration and its contribution to CCN and, by extension, the impact of SSA on clouds and climate. Additionally, the strong enhancement of coastal aerosol population by shoreline wave breaking and its environmental impact on coastal communities cannot be captured by current regional models, which do not parameterize nearshore SSA generation using wave energy or completely neglect it.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2022

Cloud Radiative Effects on MJO Development in DYNAMO

Observed Madden-Julian Oscillation (MJO) events are examined with the aid of regional model simulations to understand the role of cloud radiative effects in the MJO development. The importance of this role is demonstrated by the absence of MJO in the model simulations that contain no cloud radiative effects. Comparisons of model simulations with and without the cloud radiative effects and observation help identify the major processes arising from those effects. Those processes develop essentially from heating in the upper-troposphere due to shortwave absorption within anvil clouds in the upper troposphere and the convergence of longwave radiation in the middle-upper troposphere, with a peak at 300-hPa, during deep convection. First, that heating adds extra buoyancy and accelerates the rising motion in the upper troposphere in deep convection. The vertical acceleration in the upper troposphere creates a vacuum effect and demands for more deep convection to develop. Second, in response to that demand and required by mass balance arises the large-scale horizontal and vertical mass, moisture, and energy convergence. It strengthens deep convection and, with the feedback from continuing cloud radiative effect, creates conditions that can perpetuate deep convection and MJO development. That perpetuation does not occur however because those processes arising from the cloud radiative heating in the upper troposphere stabilize the troposphere till it supports no further deep convection. Weakening deep convection reduces cloud radiative effects. The subsequent reduction of the vacuum effect in the upper troposphere diminishes deep convection completing an MJO cycle. These results advance our understanding of the development of the MJO in the radiative-convective system over warm waters in the tropics. They show that while the embryo of intraseasonal oscillation may exist in the system its growth/development is largely dependent on cloud radiative effects and feedbacks.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2022

Data used for Figure 3 of the Nature Reviews Earth and Environment (NREE) paper: "A low-to-no snow future and its impacts on water resources in the western United States

In order to synthesize western United States snowpack projections, this dataset contains the results of 18 peer-review journal articles over three periods of interest (2025-2049, 2050-2074, and 2075-2099) and over 4 mountain ranges (Cascades, Sierra Nevada, Rockies, Wasatch/Uinta) in addition to western-US wide projections. Distinction is made by model type (Earth System Models, bias-corrected statistically downscaled Earth System Models, and regional climate models). RCP4.5 and RCP8.5 emission scenarios are considered. Percent snow water equivalent (SWE) loss considers 1 April, peak SWE and/or seasonal SWE. Heterogeneity in projected snowpack changes exists across mountain ranges and for different modeling approaches, but generally indicate agreement in decreases by the end of the century.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2020

Total Residual Radiation Source Term Produced by the Hiroshima Detonation

Residual radiation from a nuclear detonation consists of fission products and activation products produced by the excess neutrons released during the explosion. The ability to accurately predict nuclear fallout begins with a calculation of the residual radiation source term. The intent of this paper is to define the residual radiation source term for the Hiroshima detonation. The calculation was performed using the Livermore Weapon Activation Code (LWAC), which is a simplified three-region model that estimates the residual radiation associated with the fission products, the unburnt fuel, and activation products produced in the weapon components, the surrounding air, and the ground in the vicinity of ground zero. For the Hiroshima detonation, ~1200 radionuclides were produced. A time-dependent solution for the total activity of each of the major residual radiation source terms is provided in the Appendices. In addition, the timedependent exposure rates produced by the activation rings are included in the report.

45 MILITARY TECHNOLOGY, WEAPONRY, AND NATIONAL DEF↗
DOE OSTI2021

Considering Climate Change Scenarios in Site Resilience Planning

This paper was prepared in support of the U.S. Department of Energy’s Federal Energy Management Program. The paper serves as a resource for site-level personnel who are performing energy and water resilience planning at their sites and who need to identify and incorporate data that may help them assess risks to infrastructure and operations as a result of future climate change impacts. Specifically, the paper is a high-level look at available scenarios of future climate that can be incorporated into assessments based on U.S. regional models.

29 ENERGY PLANNING, POLICY, AND ECONOMY↗
DOE OSTI2024

Jurassic deserts and CO2 sequestration: the Glen Canyon Group in Utah, western USA

The Early Jurassic in the Western Interior of USA consisted of an extensive desert environment, including one of the largest ergs in geologic history. The Navajo erg has been estimated to extend as much as 2.2 million square kilometers, though the preserved extent is somewhat smaller. The Mesozoic was a global greenhouse phase, and during the Jurassic this region experienced fluctuations in climate aridity, reflected in the depositional environment. In addition to extensive dunefields, interdune deposits (lakes and oases) and fluvial systems are also documented within formations of the Glen Canyon Group. The Navajo Sandstone has received much attention as a potential CO2 injection target in recent years. It consists of thick, aeolian sandstones with high porosity and permeability, occurs in both outcrop and subcrop, and has industry data. Mapping of stratigraphic and sedimentologic changes within the Navajo Sandstone has been undertaken in localized areas, however piecing together these studies and developing regional models for CO2 potential has not received as much attention. There is significant industry data across Utah, and utilizing this data to pivot from a focus on hydrocarbon extraction to CO2 injection is an effective way to move forward with green energy, and to meet carbon neutral emission goals. Using legacy well data, we are developing a more comprehensive study of the Navajo Sandstone as a potential CO2 reservoir, in addition to identifying other zones of interest within the Glen Canyon Group, and improving understanding of stratigraphic complexity within one of the most significant aeolian systems in the world.

Mahon, Elizabeth↗
DOE OSTI2021

BVR{sub c}I{sub c} Observations, Third-body Orbital Study, and Analysis of the UV Leo-type, Pre-W UMA Binary V642 Virginis

V642 Vir is a polar spotted, well-detached, UV Leo-type, low-mass, pre-WUMa (T1 ~ 4250K, ~K6V) eclipsing binary. It was observed in 2020 April, May, and June at the Dark Sky Observatory in North Carolina, USA with the 0.81 m reflector of Appalachian State University. A total of 88 timings were used in our 22-year period study which included 12 Transiting Exoplanet Survey Satellite (TESS) timings. The O - C plots show a low-amplitude oscillation of residuals that points to the existence of an orbiting third body, a dwarf of minimum mass, 0.15 M {sub ⊙} in an eccentric orbit (e = 0.41), with an orbital period of 20.07 yr. The odd light curves of V642 Virginis indicate that it has polar spots similar to UV Leo and the recently published V1023 Per. Its present large polar spot region indicates that it must have a strong magnetic field and that it is synchronously rotating. The BVR{sub c}I{sub c} simultaneous Wilson–Devinney Program solution gives a detached binary (primary and secondary components are underfilling their respective Roche Lobes, with 76% and 78% fill outs respectively). The cool spot region models near the pole of the primary component (centered at 10° colatitude) and is angled toward the secondary component. Its large radius (68°) and T-fact (T{sub spot}/T{sub surface} = 0.69) also attest to the conclusion of the strength of the magnetic field. The small ΔT in the components (~318 K) and mass ratio near unity (0.9542 ± 0.0005) show that the stars are similar in spectral type (secondary ~K9V). The inclination is high, ~86.87 ± 0.04°, yet there is no time of constant light due to the two stars’ essentially equal radii.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2021

Impact of Initialized Land Surface Temperature and Snowpack on Subseasonal to Seasonal Prediction Project, Phase I (LS4P-I): organization and experimental design

Subseasonal-to-seasonal (S2S) prediction, especially the prediction of extreme hydroclimate events such as droughts and floods, is not only scientifically challenging, but also has substantial societal impacts. Motivated by preliminary studies, the Global Energy and Water Exchanges (GEWEX)/Global Atmospheric System Study (GASS) has launched a new initiative called “Impact of Initialized Land Surface Temperature and Snowpack on Subseasonal to Seasonal Prediction” (LS4P) as the first international grass-roots effort to introduce spring land surface temperature (LST)/subsurface temperature (SUBT) anomalies over high mountain areas as a crucial factor that can lead to significant improvement in precipitation prediction through the remote effects of land–atmosphere interactions. LS4P focuses on process understanding and predictability, and hence it is different from, and complements, other international projects that focus on the operational S2S prediction. More than 40 groups worldwide have participated in this effort, including 21 Earth system models, 9 regional climate models, and 7 data groups.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2022

Downscaling atmospheric chemistry simulations with physically consistent deep learning

Abstract. Recent advances in deep convolutional neural network (CNN)-based super resolution can be used to downscale atmospheric chemistry simulations with substantially higher accuracy than conventional downscaling methods. This work both demonstrates the downscaling capabilities of modern CNN-based single image super resolution and video super-resolution schemes and develops modifications to these schemes to ensure they are appropriate for use with physical science data. The CNN-based video super-resolution schemes in particular incur only 39 % to 54 % of the grid-cell-level error of interpolation schemes and generate outputs with extremely realistic small-scale variability based on multiple perceptual quality metrics while performing a large (8×10) increase in resolution in the spatial dimensions. Methods are introduced to strictly enforce physical conservation laws within CNNs, perform large and asymmetric resolution changes between common model grid resolutions, account for non-uniform grid-cell areas, super-resolve lognormally distributed datasets, and leverage additional inputs such as high-resolution climatologies and model state variables. High-resolution chemistry simulations are critical for modeling regional air quality and for understanding future climate, and CNN-based downscaling has the potential to generate these high-resolution simulations and ensembles at a fraction of the computational cost.

54 ENVIRONMENTAL SCIENCES↗