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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 343 records · Page 19
All sourcesNASA NTRSDOE OSTI
NASA NTRS2004

How Well are Recent Climate Variability Signals Resolved by Satellite Radiative Flux Estimates?

One notable aspect of Earth s climate is that although the planet appears to be very close to radiative balance at top-of-atmosphere (TOA), the atmosphere itself and underlying surface are not. Profound exchanges of energy between the atmosphere and oceans, land and cryosphere occur over a range of time scales. Recent evidence from broadband satellite measurements suggests that even these TOA fluxes contain some detectable variations. Our ability to measure and reconstruct radiative fluxes at the surface and at the top of atmosphere is improving rapidly. Understanding the character of radiative flux estimates and relating them to variations in other energy fluxes and climate state variables is key to improving our understanding of climate. In this work we will evaluate several recently released estimates of radiative fluxes, focusing primarily on surface estimates. The International Satellite Cloud Climatology Project FD radiative flux profiles are available from rnid-1983 to near present and have been constructed by driving the radiative transfer physics from the Goddard Institute for Space Studies (GISS) global model with ISCCP clouds and HlRS operational soundings profiles. Full and clear sky SW and LW fluxes are produced. A similar product from the NASA/GEWEX Surface Radiation Budget Project using different radiative flux codes and thermodynamics from the NASA/Goddard Earth Observing System assimilation model makes a similar calculation of surface fluxes. However this data set currently extends only through 1995. Several estimates of downward LW flux at the surface inferred from microwave data are also examined. Since these products have been evaluated with Baseline Surface Radiation Network data over land we focus over ocean regions and use the DOE/NOAA/NASA Shipboard Ocean Atmospheric Radiation (SOAR) surface flux measurements to characterize performance of these data sets under both clear and cloudy conditions. Some aspects of performance are stratified according to SST and vertical motion regimes. Comparisons to the TRMM/CERES SRB data in 1998 are also interpreted. These radiative fluxes are then analyzed to determine how surface (and TOA) radiative exchanges respond to interannual signals of ENS0 warm and cold events. Our analysis includes regional changes as well as integrated signals over land, ocean and various latitude bands. Changes in water vapor and cloud forcing signatures are prominent on interannual time scales. Prominent signals are also found in the SW fluxes for the Pinatubo volcanic event. These systematic changes in fluxes are related to changes in large-scale circulations and energy transport in the atmosphere and ocean. Some estimates of signal-to-noise and reliability are discussed to place our results in context.

Robertson, Franklin R.↗
DOE OSTI2025

Performance of Diffusion Monte Carlo Calculations for Predicting the Relative Energies of Quinoidal and Nonquinoidal Species

Coupled cluster singles and doubles with perturbative triples [CCSD(T)] and single determinant fixed-node diffusion Monte Carlo (SD-DMC) have emerged as two of the most useful methods for providing benchmark reaction and interaction energies of chemical systems without strong static correlation. The errors in DMC energies are dominated by an inexact description of the nodal surfaces for electron exchange. One of the main approaches to addressing the fixed-node error is to use multideterminant (MD) trial wave functions. We consider here the energy differences between pairs of related molecules with aromatic and quinoidal structures as well as between quinoidal isomers. Quinoidal systems tend to have some diradical character, leading one to anticipate that SD-DMC calculations may face challenges in accurately describing their energetics. The MD trial wave functions were generated from the complete active space calculations. A comparison is made with the predictions of well-converged CCSD(T) calculations.

basis sets↗
DOE OSTI2023

Detecting Permafrost Active Layer Thickness Change From Nonlinear Baseflow Recession

We report permafrost underlies about one fifth of the global land area and affects ground stability, freshwater runoff, soil chemistry, and surface-atmosphere gas exchange. The depth of thawed ground overlying permafrost (active layer thickness) has broadly increased across the Arctic in recent decades, coincident with a period of increased streamflow, especially the lowest flows (baseflow). Mechanistic links between active layer thickness and baseflow have recently been explored using linear reservoir theory, but most watersheds behave as nonlinear reservoirs. We derive theoretical nonlinear relationships between long-term average saturated soil thickness $\bar{η}$(proxy for active layer thickness) and long-term average baseflow. When applied to 38 years of daily streamflow data for the Kuparuk River basin on the North Slope of Alaska, the theory predicts $\bar{η}$ increased 0.17 ± 0.22[2σ] cm a -1 between 1983 and 2020 (6.4 ± cm total). The rate of increase nearly doubled to 0.29 ± 0.31 cm a -1 between 1990 and 2020, during which time local field measurements from Circumpolar Active Layer Monitoring sites indicate the active layer increased 0.31 ± 0.22 cm a -1 . The predicted rate of increase more than doubled again between 2002 and 2020, outpacing a near doubling of observed active layer thickening, consistent with trends in terrestrial water storage inferred from Gravity Recovery and Climate Experiment satellite gravimetry and Modern-Era Retrospective Analysis for Research and Applications climate reanalysis. Overall, hydrologic change is accelerating in the Kuparuk River basin, and we provide a theoretical framework for estimating basin-scale changes in active layer water storage from streamflow measurements.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2024

Climate induced microbiome alterations increase cadmium bioavailability in agricultural soils with pH below 7

Climate change and metals independently stress soil microbiomes, but their combined effects remain unresolved. Here we show that future climate affects soil cadmium through altered soil microbiome and nutrient cycles, with soil pH as critical factor. In soils with pH<7 and during summer temperatures, future climate increased porewater cadmium, shifting total and potentially active taxonomic microbiome structures. Microbial ammonium oxidation released protons liberating cadmium through cation exchange from mineral surfaces. When porewater cadmium levels became toxic to non-cadmium-tolerant bacteria, microbial activity, and nutrient cycling decreased, reducing carbon and nitrogen emissions. In contrast, pH>7 soil show no climate impacts on cadmium mobilization, though imprints on microbiome structure were apparent. Subsequent nutrient cycling increased under future climate, stimulating soil respiration and nitrous oxide release. These findings underscore complex interactions between climate change and soil contaminants affecting the soil microbiome and its activity and highlights potential impacts on crop production, groundwater quality, and climate feedback.

60 APPLIED LIFE SCIENCES↗
DOE OSTI2025

Tensorized Interior Radiative Heat Transfer for a Scalable and Calibrated Building Energy Simulator

Building energy simulation is a critical tool for developing and testing advanced control strategies, such as Reinforcement Learning (RL), to provide demand flexibility and affordable energy costs. The recently introduced Smart Buildings Control Suite (sbsim) provides a lightweight, scalable, and data-calibrated simulation environment based on a 2D finite-difference model. However, the initial model primarily focused on conductive and convective heat transfer, neglecting the significant impact of long-wave radiative heat exchange between interior surfaces. This paper presents a significant extension to the sbsim framework by incorporating a physically-grounded model for interior radiative heat transfer. Our primary contribution is the development and integration of a fully tensorized radiative heat transfer module, which preserves the computational efficiency and scalability of the original simulator. This was achieved by developing a pipeline for view factor calculation, including an algorithm to identify directly seeing surfaces within complex floor plans, and formulating the net radiation equations for efficient execution on modern hardware accelerators. We validate the numerical accuracy of our tensorized implementation by comparing its results against a traditional iterative approach, demonstrating identical outcomes. This enhancement increases the physical fidelity of sbsim, enabling more accurate training of RL agents for building energy optimization.

Ham, Sang woo↗
DOE OSTI2021

Progress on Computational Modeling of Water-Based NSTF (FY2021)

This report documents the FY21 progress and achievements made in the computational analyses of the water-based NSTF. Both system-level and high-fidelity Computational Fluid Dynamics (CFD) analyses were performed to gain a complete understanding of the complex flow and heat transfer phenomena in natural convection systems. The progress on the waterbased NSTF experimental testing is summarized in a companion report (ANL-ART-230). As a continuation of progress from previous years, in FY21 the RELAP5 model of the NSTF was first updated to include a representative heated cavity that incorporated convection and conduction means of heat transfer. Two different cavity models were developed, one that models the radiation heat exchange among all surfaces in one enclosure (Cavity Model 1), and another that employs multiple radiation enclosures with each considering the surfaces at one axial level (Cavity Model 2). This updated RELAP5 deck was benchmarked with single-phase test data to tune form loss coefficients of the elbows and tees, along with heat transfer coefficients within the cavity and off the external insulation panels. This tuned model was then found to accurately predict fluid temperatures within 2.5% and both system and riser flow rates within 6% during single-phase, steady-state simulations. For transient simulations, there is a slight over prediction of the flow rate, fluid temperatures, and heater temperatures during the heat-up period, which indicate that the transient heat loss may be underestimated. Following, the capabilities of RELAP5-3D were examined, which feature a conduction enclosure model that is not present in the current version of RELAP5-MOD3.3 used for all previous NSTF simulations. As an initial comparison of the two codes, single-phase simulations were run that used similar input decks. The results indicate that the single-phase flow predicted by the two codes was very similar, however RELAP5-3D appears to predict a higher system flow during the two-phase transient when compared to the flow rates predicted by RELAP5-MOD3.3. Furthermore, RELAP5-3D run did not capture the density wave oscillations or geysering phenomena, which are large oscillation flow instabilities observed in the experimental facility. To further the prediction capabilities for capturing two-phase instabilities, Options 55, 57, 58, 61, which are implemented by default in RELAP5-MOD3.3 but not in RELAP5-3D, were investigated. When enabling Option 61, RELAP5-3D agrees well with MOD3.3 in predicting the total system flow, while other options have negligible effect on the predicted total system flow by RELAP5-3D. However, none of these options enables RELAP5-3D to produce the same flow instabilities. For future steps, efforts are currently underway to investigate RELAP5-3D’s different behavior in predicting low-pressure two-phase instabilities. STAR-CCM+ was used to perform CFD analysis of the water-based test facility and provide simulation results for comparisons to experimental data. Efforts first focused on describing the characteristics of flow within the heated cavity. A study was performed on whether possible leakage flow between the two sides of the cavity could substantially impact and explain the results. An additional second assumption was examined which defined adiabatic side walls, so physical insulation structures were added to the models to allow conduction across this outer insulation. The results suggest that potential porosity of the insulation could be a major factor in the temperature distribution within the cavity and should be considered in any studies where it is desirable to know the cavity wall temperatures to higher accuracy.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗
DOE OSTI2026

Interactions between molecular-scale biogeochemical processes and hyporheic exchange for understanding coupled Fe-S-C cycling in iron-rich riparian wetlands (Final Technical Report)

Riparian wetlands are dynamic interfaces that exert strong control over water quality, contaminant mobility, and greenhouse gas emissions. These systems are characterized by hyporheic exchange between oxic surface water and anoxic groundwater, which generates steep redox gradients and promotes spatially and temporally variable microbial activity. Despite growing recognition of tightly coupled iron (Fe), sulfur (S), and carbon (C) cycling in these environments, the mechanisms governing these interactions—particularly under low-sulfate freshwater conditions—remain poorly constrained. This project developed a mechanistic understanding of how hydrologic variability and microbial processes interact to control Fe–S–C cycling in iron-rich riparian wetlands. Using a multi-scale and multi-method approach integrating field observations, geochemical and spectroscopic analyses, metagenomics, and reactive transport modeling, we demonstrate that “cryptic” sulfur cycling—rapid sulfur transformations involving intermediate-valence species—plays a dominant and previously underrecognized role in freshwater wetlands. These processes persist despite low sulfate concentrations and significantly influence iron reduction, carbon mineralization, and methane dynamics. The results show that cryptic sulfur cycling enhances dissolved Fe 2+ production, regulates methane concentrations, and is strongly controlled by climate-driven hydrologic fluxes. By linking hydroclimate, subsurface flow, and biogeochemical reactions, this work provides a predictive framework for understanding how wetland systems respond to environmental change, with direct implications for water quality and carbon cycling.

54 ENVIRONMENTAL SCIENCES↗
NASA NTRS1969

BOMEX bulletin, no. 4

Acquisition of data in Caribbean related to energy exchange between ocean surface and atmosphere - Project BOMEX

Source record↗
NASA NTRS1974

Seasonal canopy reflectance patterns of wheat, sorghum and soybean

The author has identified the following significant results. Reflectance characteristics of agronomic crops are of major importance in the energy exchanges of a surface. In addition, unique reflectance patterns may be an aid in crop identification by means of remote sensing. This study suggests that the ratio of the reflectances of the 545-nm to to the 655-nm wavebands provides information about the viewed surface, regardless of the crop. The reflectance ratio is less than unity early and late in the growing season. For all crops studied, the ratio closely followed crop growth and development and appeared to be more desirable than the near-infrared reflectance as an index of growth.

Kanemasu, E. T.↗
NASA NTRS1978

Modification of the continuous flow diffusion chamber for use in zero-gravity

The design philosophy and performance characteristics of the continuous flow diffusion chamber developed for use in ground-based simulation of some of the experiments planned for the atmospheric cloud physics laboratory during the first Spacelab flight are discussed. Topics covered include principle of operation, thermal control, temperature measurement, tem-powered heat exchangers, wettable metal surfaces, sample injection system, and control electronics.

Keyser, G.↗
NASA NTRS1978

Basic approaches to and tasks of space technology

The high vacuum and weightlessness of outer space offer great possibilities for the new field of space technology. To take advantage of this, it is necessary to study such physical and chemical phenomena as diffusion, surface tension, heat exchange, and crystallization. The research shows the possibility of obtaining materials with a more perfect structure. Methods of treating materials can be used in space which are impossible on earth. Achievements in material science in outer space will have a large impact on the national economy.

Okhotin, A. S.↗
NASA NTRS1980

Thermal Pollution Mathematical Model: Verification of One-Dimensional Numerical Model at Lake Keowee - Volume 2

A one dimensional model for studying the thermal dynamics of cooling lakes was developed and verified. The model is essentially a set of partial differential equations which are solved by finite difference methods. The model includes the effects of variation of area with depth, surface heating due to solar radiation absorbed at the upper layer, and internal heating due to the transmission of solar radiation to the sub-surface layers. The exchange of mechanical energy between the lake and the atmosphere is included through the coupling of thermal diffusivity and wind speed. The effects of discharge and intake by power plants are also included. The numerical model was calibrated by applying it to Cayuga Lake. The model was then verified through a long term simulation using Lake Keowee data base. The comparison between measured and predicted vertical temperature profiles for the nine years is good. The physical limnology of Lake Keowee is presented through a set of graphical representations of the measured data base.

Lee, S. S.↗
NASA NTRS1981

A study of model parameters associated with the urban climate using HCMM data

The use of infrared and visible data from the Heat Capacity Mapping Mission (HCMM) and in situ data to study the intensity of the urban heat island of Saint Louis is described. Analysis of HCMM data shows that an urban heat island exists day and night in all seasons when clear skies prevail. The lower albedo value of the urban region during the day suggests that the higher temperatures are due to more absorption of solar radiation. Preliminary analysis of in situ meteorological data was performed after merging with HCMM data, and surface roughness, the exchange coefficient, and the soil moisture were calculated.

Source record↗
NASA NTRS1982

Comments on collision mechanics in ring systems

Collisions within planetary ring systems, especially Saturn's, are discussed. The particles may have coherent icy cores and less coherent granular or frosty surface layers, consistent with thermal eclipse observations. Collisions do not cause catastrophic fragmentation of the particles, although minor surface erosion and reaccretion is possible. Evolution by collisional fragmentation is thus not as important as in the asteroid belt. Models suggest that the fractional number of projectile masses dislodged when solid (or solid-core) projectiles strike solid ice or granular surface layers does not exceed the order of 10 to the minus 7th to minus 9th power. Even at this rate, the half life of ring particles would be less than the age of the solar system in crowded ring regions unless there was very efficient reaccretion. A plausible ring particle model involves solid ice cores with granular surface layers that exchange material by slow erosion and efficient reaccretion; the granular layers protect the cores from rapid erosion.

Hartmann, W. K.↗
NASA NTRS1989

A high level Ab initio study of the anionic hydrogen-bonded complexes FH-CN-, FH-NC-, H2O-CN- and H2O-NC-

HF, H2O, CN- and their hydrogen-bonded complexes were studied using state-of-the-art ab initio quantum mechanical methods. A large Gaussian one particle basis set consisting of triple zeta plus double polarization plus diffuse s and p functions (TZ2P + diffuse) was used. The theoretical methods employed include self consistent field, second order Moller-Plesset perturbation theory, singles and doubles configuration interaction theory and the singles and doubles coupled cluster approach. The FH-CN- and FH-NC- and H2O-CN-, H2O-NC- pairs of complexes are found to be essentially isoenergetic. The first pair of complexes are predicted to be bound by approx. 24 kcal/mole and the latter pair bound by approximately 15 kcal/mole. The ab initio binding energies are in good agreement with the experimental values. The two being shorter than the analogous C-N hydrogen bond. The infrared (IR) spectra of the two pairs of complexes are also very similar, though a severe perturbation of the potential energy surface by proton exchange means that the accurate prediction of the band center of the most intense IR mode requires a high level of electronic structure theory as well as a complete treatment of anharmonic effects. The bonding of anionic hydrogen-bonded complexes is discussed and contrasted with that of neutral hydrogen-bonded complexes.

Lee, Timothy J.↗
NASA NTRS1989

A high-level ab initio study of the anionic hydrogen-bonded complexes FH-CN(-), FH-NC(-), H2O-CN(-), and H2O-NC(-)

HF, H2O, CN- and their hydrogen-bonded complexes were studied using state-of-the-art ab initio quantum mechanical methods. A large Gaussian one particle basis set consisting of triple zeta plus double polarization plus diffuse s and p functions (TZ2P + diffuse) was used. The theoretical methods employed include self consistent field, second order Moller-Plesset perturbation theory, singles and doubles configuration interaction theory and the singles and doubles coupled cluster approach. The FH-CN- and FH-NC- and H2O-CN-, H2O-NC- pairs of complexes are found to be essentially isoenergetic. The first pair of complexes are predicted to be bound by approx. 24 kcal/mole and the latter pair bound by approximately 15 kcal/mole. The ab initio binding energies are in good agreement with the experimental values. The two being shorter than the analogous C-N hydrogen bond. The infrared (IR) spectra of the two pairs of complexes are also very similar, though a severe perturbation of the potential energy surface by proton exchange means that the accurate prediction of the band center of the most intense IR mode requires a high level of electronic structure theory as well as a complete treatment of anharmonic effects. The bonding of anionic hydrogen-bonded complexes is discussed and contrasted with that of neutral hydrogen-bonded complexes.

Lee, Timothy J.↗
NASA NTRS1992

High-Aspect-Ratio Rotating Cell-Culture Vessel

Cylindrical rotating cell-culture vessel with thin culture-medium layer of large surface area provides exchange of nutrients and products of metabolism with minimal agitation. Rotation causes averaging of buoyant forces otherwise separating components of different densities. Vessel enables growth of cells in homogeneous distribution with little agitation and little shear stress.

Wolf, David A.↗
NASA NTRS1991

Precipitation rates in the tropics based on the Q1-budget method - 1 June 1984-31 May 1987

The 'apparent' heat source method (Q1 budget) is used to compute the total derivative of dry static energy from 30 deg N to 30 deg S for the period June 1, 1984-May 31, 1987. The dataset is produced from the ECMWF global analyses and consists of twice-daily values of temperature, geopotential height, horizontal wind components, and vertical velocity at increments of 2.5 x 2.5 deg lat/long at seven pressure levels. Vertically integrated values of ds/dt, which are equal to total diabatic heating, Q1, are combined with estimates of net columnar radiation and surface sensible heat exchange to compute mean monthly precipitation rates, P0, as the residual in the Q1 budget. The accuracy of these P0 values is thoroughly examined, and it is suggested that the technique produces reliable estimates of precipitation over tropical oceanic areas on a monthly basis. Time series of mean monthly P0 for several geographic regions of the Southern Hemisphere tropics and the equatorial western Pacific (TOGA-COARE region) reveal that (1) the South Pacific convergence zone has the highest precipitation rates in the Southern Hemisphere; (2) a clear and distinct seasonal cycle is prominent in all regions; and (3) the 1986-87 ENSO event is easily identified, particularly in the TOGA-COARE region.

Vincent, Dayton G.↗