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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 991 records · Page 55
All sourcesNASA NTRSDOE OSTI
DOE OSTI2025

Soil biogeochemical properties and metrics of tree-mycorrhizal dominance for a 25-Ha forest in South Central Indiana, USA.

This data package contains a dataset used in the papers “Seeing the forest for all the trees: Mycorrhizal-associated nutrient economies are modulated by stem density and the synchrony between overstory and understory communities” and “Mycorrhizal associations of tree species influence soil nitrogen dynamics via effects on soil acid–base chemistry”. Four csv files are included along with a dataset. The dataset features chemical soil properties for a single sampling campaign within the 25 Ha Lilly-Dickey Woods Smithsonian Forest Global Earth Observatory (ForestGEO) plot in South Central Indiana, USA (ldw_dat_raw.csv). Also included are separate files focused on pH (pH_data.csv), carbon and nitrogen (CN_data.csv), and nitrification rates (Nitrification_data.csv). These variables are commonly associated with the tree-mycorrhizal dominance of forest stands. In these data subsets, each soil variable was matched to a 10 meter radius neighborhood wherein metrics of tree-mycorrhizal dominance (basal area, stem count, importance value, etc.) were calculated. Models between these soil variables and dominance metrics were used to investigate how different assessments of mycorrhizal associated nutrient economies (MANE) capture these relationships. This research was performed as a part of the Smithsonian ForestGEO project. This data package can be used to explore spatial variability in soil chemistry within a mature hardwood forest, or it can be combined with the included tree data, other fine-scale spatial information, or other tree inventory data for the site to evaluate how soil chemistry varies with tree community composition or edaphic or topographic properties.

Craig, Matthew [ORNL] (ORCID:0000000288907920)↗
DOE OSTI2015

SOLAR SPECTRAL IRRADIANCE, SOLAR ACTIVITY, AND THE NEAR-ULTRA-VIOLET

The previous calculations of the Solar Spectral Irradiance (SSI) by the Solar Radiation Physical Modeling, version 2 system, are updated in this work by including new molecular photodissociation cross-sections of important species, and many more levels and lines in its treatment of non-LTE radiative transfer. The current calculations including the new molecular photodissociation opacities produce a reduced over-ionizaton of heavy elements in the lower chromosphere and solve the problems with prior studies of the UV SSI in the wavelength range 160–400 nm and now reproduce the available observations with much greater accuracy. Calculations and observations of the near-UV at 0.1 nm resolution and higher are compared. The current set of physical models includes four quiet-Sun and five active-region components, from which radiance is computed for ten observing angles. These radiances are combined with images of the solar disk to obtain the SSI and Total Solar Irradiance and their variations. The computed SSI is compared with measurements from space at several nm resolution and agreement is found within the accuracy level of these measurements. An important result is that the near-UV SSI increase with solar activity is significant for the photodissociation of ozone in the terrestrial atmosphere because a number of highly variable upper chromospheric lines overlap the ozone Hartley band.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2015

Coolant density and control blade history effects in extended BWR burnup credit - 14494

Oak Ridge National Laboratory and the US Nuclear Regulatory Commission have initiated a multiyear project to investigate the application of burnup credit (BUC) for boiling water reactor (BWR) fuel in storage and transportation casks. This project includes two phases. The first phase investigates the applicability of peak reactivity methods currently used for spent fuel pools to spent fuel storage and transportation casks and the validation of reactivity (k{sub eff}) calculations and predicted spent fuel compositions. The second phase focuses on extending BUC beyond peak reactivity. This paper documents work performed to date investigating some aspects of extended BUC. The technical basis for application of peak reactivity methods to BWR fuel in storage and transportation systems is presented in a companion paper. Two reactor operating parameters are being evaluated to establish an adequate basis for extended BWR BUC: (1) the effect of axial void profile and (2) the effect of control blade utilization during operation. A detailed analysis of core simulator data for one cycle of a modern operating BWR plant was performed to determine the range of void profiles and the variability of the profile experienced during irradiation. Although a single cycle does not provide complete data, the data obtained are sufficient to determine the primary effects and to identify conservative modeling approaches. These data were used in a study of the effect of axial void profile. The first stage of the study was determination of the necessary moderator density temporal fidelity in depletion modeling. After the required temporal fidelity was established, multiple void profiles were used to examine the effect on cask reactivity. The results of these studies are being used to develop recommendations for conservatively modeling the void profile effects for BWR depletion calculations. The second operational parameter studied was control blade history. Control blades are inserted in various locations and at varying degrees during BWR operation based on the core loading pattern. When present during depletion, control blades harden the neutron spectrum locally because they displace the moderator and absorb thermal neutrons. The investigation of the effect of control blades on post operational cask reactivity is documented herein, as is the effect of multiple (continuous and intermittent) exposure periods with control blades inserted. The coupled effects of control blade presence on power density, void profile, or burnup profile will be addressed in future work. (authors)

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗
DOE OSTI2016

Magnon–phonon coupling and implications for charge-density wave states and superconductivity in cuprates

The mechanism of high-temperature superconductivity of copper oxides (cuprates) remains unsolved puzzle in condensed matter physics. The cuprates represent extremely complicated system, showing fascinating variety of quantum phenomena and rich phase diagram as a function of doping. In the suggested “superconducting glue” mechanisms, phonon and spin excitations are invoked most frequently, and it appears that only spin excitations cover the energy scale required to justify very high transition temperature T c ~ 165 K (as in mercury-based triple layer cuprates compressed to 30 GPa). It appears that pressure is quite important variable helping to boost the T c record by almost 30°. Pressure may be also considered as a clean tuning parameter, helping to understand the underlying balance of various energy scales and ordered states in cuprates. In this paper, a review of mostly our work on cuprates under pressure will be given, with the emphasis on the interactions between phonon and spin excitations. Furthermore, it appears that there is a strong coupling between superexchange interaction and stretching in-plane oxygen vibrations, which may give rise to a variety of complex phenomena, including the charge-density wave state intertwined with superconductivity and attracting a lot of interest recently.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2019

Measurement of the Crab Nebula Spectrum Past 100 TeV with HAWC

In this study, we present TeV gamma-ray observations of the Crab Nebula, the standard reference source in ground-based gamma-ray astronomy, using data from the High Altitude Water Cherenkov (HAWC) Gamma-Ray Observatory. In this analysis we use two independent energy estimation methods that utilize extensive air shower variables such as the core position, shower angle, and shower lateral energy distribution. In contrast, the previously published HAWC energy spectrum roughly estimated the shower energy with only the number of photomultipliers triggered. This new methodology yields a much-improved energy resolution over the previous analysis and extends HAWC's ability to accurately measure gamma-ray energies well beyond 100 TeV. The energy spectrum of the Crab Nebula is well fit to a log-parabola shape $\left(\tfrac{{dN}}{{dE}}={\phi }_{0}{\left(E/7\mathrm{TeV}\right)}^{-\alpha -\beta \mathrm{ln}\left(E/7\mathrm{TeV}\right)}\right)$ with emission up to at least 100 TeV. For the first estimator, a ground parameter that utilizes fits to the lateral distribution function to measure the charge density 40 m from the shower axis, the best-fit values are ${\phi }_{o}=(2.35\pm {0.04}_{-0.21}^{+0.20})\times {10}^{-13}$ (TeV cm 2 s) -1 , $\alpha =2.79\pm {0.02}_{-0.03}^{+0.01}$, and $\beta =0.10\pm {0.01}_{-0.03}^{+0.01}$. For the second estimator, a neural network that uses the charge distribution in annuli around the core and other variables, these values are ${\phi }_{o}=(2.31\pm {0.02}_{-0.17}^{+0.32})\times {10}^{-13}$ (TeV cm 2 s) -1 , $\alpha =2.73\pm {0.02}_{-0.02}^{+0.03}$, and β = 0.06 ± 0.01 ± 0.02. The first set of uncertainties is statistical; the second set is systematic. Both methods yield compatible results. Finally, these measurements are the highest-energy observation of a gamma-ray source to date.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2016

Coupled Neutron and Gamma Heating Calculation Based on VARIANT Nodal Transport Method

Accurate determination of temperature distributions in fuel pins and duct walls is essential for fuel-pin performance and assembly bowing analyses. Currently, the multi-assembly, sub-channel analysis code SE2-ANL is used in thermalhydraulic analysis of sodium cooled fast reactors (SFR). SE2- ANL is interfaced with the DIF3D/GAMSOR/DIF3D procedure for coupled neutron and gamma heating calculations, developed at Argonne National Laboratory (ANL). In this procedure, the neutron flux distribution is first calculated using the finite-difference diffusion theory option of the DIF3D code. Using the neutron flux solution, the GAMSOR code computes the gamma source distribution for the subsequent gamma flux calculation with DIF3D. However, in the current heating calculation scheme, the neutron and gamma flux calculations are limited to six triangular meshes per hexagonal assembly. In addition, the pin power distributions are estimated by assuming that the power distribution within an assembly is separable in the radial and axial directions. In each assembly, the axial power profile is obtained by averaging the power densities of six triangular meshes at each axial mesh interval. The radial power profile is evaluated at a single axial mesh (e.g., at the core mid-plane) by approximating the neutron and gamma flux distributions by a linear or quadratic polynomial of two variables x and y, depending on the polynomial order specified by the user. The coefficients of the linear and quadratic polynomials are determined by the least squares fit of six and 24 triangular mesh fluxes, respectively. Furthermore, the total heat generation rate in an assembly duct wall is simply determined by a user-specified fraction of the total gamma heating within that assembly. With the advancement of computer technology, the nodal transport theory code VARIANT is routinely used in core design analyses of SFR instead of DIF3D. It is therefore necessary to develop a new heating calculation procedure based on VARIANT neutron and gamma transport calculations. In this study, a new, coupled neutron and gamma heating calculation scheme has been developed to determine the pin power distributions more accurately by eliminating the aforementioned limitations of the current procedure. For this, the GAMSOR code has been extended to generate the intra-nodal gamma source distribution to be consistent with the trial functions of VARIANT. In the new heating calculation procedure, the neutron flux distribution is determined first by solving an eigenvalue transport problem using VARIANT. The obtained neutron flux is then used in GAMSOR to calculate the gamma source distribution. Using this gamma source distribution, the gamma flux distribution is determined by solving a fixed-source transport problem using VARIANT again. Using the computed neutron and gamma flux distributions, the power distribution in each fuel pin and duct wall is determined using a new utility code CURVE, which has been developed to evaluate the VARIANT flux solution at each fuel pin position and along the duct mid-wall. For each pin segment contained in a VARIANT node, the axial power shape is represented as a quadratic profile. The performance of the new heating calculation scheme based on VARIANT transport solutions has been tested against the existing method of SE2-ANL, using the ABR-1000 metal core design. The gamma source distribution and the assembly, fuel pin and duct wall power distributions were calculated and compared. (authors)

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗
DOE OSTI2016

Temperature dependent simulation of diamond depleted Schottky PIN diodes

Diamond is considered as an ideal material for high field and high power devices due to its high breakdown field, high lightly doped carrier mobility, and high thermal conductivity. The modeling and simulation of diamond devices are therefore important to predict the performances of diamond based devices. In this context, we use Silvaco{sup ®} Atlas, a drift-diffusion based commercial software, to model diamond based power devices. The models used in Atlas were modified to account for both variable range and nearest neighbor hopping transport in the impurity bands associated with high activation energies for boron doped and phosphorus doped diamond. The models were fit to experimentally reported resistivity data over a wide range of doping concentrations and temperatures. We compare to recent data on depleted diamond Schottky PIN diodes demonstrating low turn-on voltages and high reverse breakdown voltages, which could be useful for high power rectifying applications due to the low turn-on voltage enabling high forward current densities. Three dimensional simulations of the depleted Schottky PIN diamond devices were performed and the results are verified with experimental data at different operating temperatures.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2016

PROTOPLANETARY DISK HEATING AND EVOLUTION DRIVEN BY SPIRAL DENSITY WAVES

Scattered light imaging of protoplanetary disks often reveals prominent spiral arms, likely excited by massive planets or stellar companions. Assuming that these arms are density waves, evolving into spiral shocks, we assess their effect on the thermodynamics, accretion, and global evolution of the disk. We derive analytical expressions for the direct (irreversible) heating, angular momentum transport, and mass accretion rate induced by disk shocks of arbitrary amplitude. These processes are very sensitive to the shock strength. We show that waves of moderate strength (density jump at the shock ΔΣ/Σ ∼ 1) result in negligible disk heating (contributing at the ∼1% level to the energy budget) in passive, irradiated protoplanetary disks on ∼100 au scales, but become important within several au. However, shock heating is a significant (or even dominant) energy source in disks of cataclysmic variables, stellar X-ray binaries, and supermassive black hole binaries, heated mainly by viscous dissipation. Mass accretion induced by the spiral shocks is comparable to (or exceeds) the mass inflow due to viscous stresses. Protoplanetary disks featuring prominent global spirals must be evolving rapidly, in ≲0.5 Myr at ∼100 au. A direct upper limit on the evolution timescale can be established by measuring the gravitational torque due to the spiral arms from the imaging data. We find that, regardless of their origin, global spiral waves must be important agents of the protoplanetary disk evolution. They may serve as an effective mechanism of disk dispersal and could be related to the phenomenon of transitional disks.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2017

Characterizing near-surface elemental layering on Mars using gamma-ray spectroscopy: A proof-of-principle experiment

Gamma-ray spectroscopy investigations characterize the chemical composition of planetary surfaces by measuring element-characteristic gamma rays with energies of ~100 keV to ~9 MeV. Over this energy range, the mean free path of a gamma ray varies from about 1 to 25 cm, therefore gamma-ray measurements sample subsurface composition. Many elements emit gamma rays at multiple, often widely spaced energies, so gamma-ray measurements can in principle also be used to identify depth-dependent variations in subsurface composition. We report results from laboratory measurements and radiation transport modeling designed to demonstrate this capability. The laboratory measurements verified the presence of depth-dependent gamma-ray signatures, and were then used to benchmark radiation transport simulations that were used to model realistic Mars-like scenarios. The models indicate that compositionally distinct subsurface deposits, buried to depths of ~80 cm (125 g/cm 2 ), can be identified using gamma-ray measurements. Going beyond identification to characterization (burial depth, relative composition of the layers) of the deposits requires knowledge of the vertical and horizontal variability in the water content of the near-surface surface materials, the local Galactic Cosmic Ray environment (magnitude and energy distribution), the depth-dependent neutron flux, gamma-ray production cross sections, and knowledge of the composition and column density of the atmosphere. The results of our experiments and models provided a basis for examining the utility of using orbiter- and lander-based gamma-ray measurements to identify subsurface deposits on Mars.

42 ENGINEERING↗
DOE OSTI2023

Simulated impact of fill tube geometry on recent high-yield implosions at the National Ignition Facility

Inertial confinement fusion capsules fielded at the National Ignition Facility are filled with deuterium and tritium fuel by means of a fill tube. The fill tube introduces a low-density pathway into the fuel region of the capsule that allows high Z contaminant to invade the hot spot during the course of the implosion. A recent series of nominally identical high-yield implosions on the NIF has exhibited significant variability in performance. We evaluate the impact of the fill tube in these implosions computationally to determine whether variations in fill tube geometry could have contributed to this variability. The main contrast between the fill tube geometry in the six shots was the outer diameter of the capsule bore hole, a conical hole into which the fill tube is inserted. In our simulations, the geometry of the bore hole can play a significant role in the development of nonlinear flows seeded by the fill tube. Additionally, we find that the amount of space between the bore hole and the fill tube is the primary factor that determines the amount of contaminant jetted into the hot spot by the fill tube and, in turn, the level of yield reduction due to the fill tube in our simulations. As a consequence, some capsules with 5 μm fill tubes are predicted to outperform capsules with 2 μm fill tubes. We also find that micrometer-scale changes to bore hole size can impact fusion yields by up to four times near the ignition threshold. Nevertheless, simulation trends do not reproduce experimental yield trends, suggesting that the fill tube geometry was not the primary factor contributing to the observed variability in performance and that the fill tube could be masking sensitivity to other asymmetries such as other micrometer-scale capsule defects like voids that were not included in our simulations.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2021

Diurnal observations of basal stem CO2 efflux in three canopy dominant trees in the central Amazon

We explored mechanisms responsible for disturbance-induced shifts in carbon metabolism in forests north of Manaus, Brazil (S2º 38' 17", W60º 09' 25"), using data from a selective logging experiment (BIONTE). BIONTE (the BIOmass and NuTrient Experiment) selective logging treatments were initiated in the mid-1980s and comprised variable removal of commercial tree (not total) species basal area (T1 =32%, T2 = 42%, T3 = 69%), and control plots with no logging (T0). Raw data including tree base diameter (Db), CO2 concentration versus time inside a static stem chamber, and wood density were used to derive stem respiration rates (Rw), wood production rates (Pw), and wood carbon use efficiency (CUE). Changes in tree base diameter (Db; measured at 1.3 m height, or above the buttresses) was used to calculate wood production for individual trees (Pw). Wood density enabled calculation of stem growth rate in the same units as stem respiration (mmol C m-2 s-1). Four trees were randomly selected from five tree growth rate classes for each treatment block, for a total of 20 trees per treatment block, or 80 trees total from the BIONTE plots. Each of the 80 trees selected for the Rw study were outfitted with dendrometer bands (da Silva et al. 2002). Stem respiration was measured using the method described in Chambers et al. (2004). Briefly, an infra-red gas analyzer (LiCor 820) was operated as a closed dynamic chamber with a flow rate of 1.0 L min-1. Polyvinyl chloride (PVC) semi-cylindrical chambers (250–400 mL) were secured to the tree stem near the dendrometer bands using nylon straps. The measurement interval spanned 1–2 min, and the CO2 flux from the stem of each tree was quantified using the enclosed stem area and slope of the stem CO2 concentration versus time.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2016

A comprehensive archival Chandra search for X-ray emission from ultracompact dwarf galaxies

We present the first comprehensive archival study of the X-ray properties of ultracompact dwarf (UCD) galaxies, with the goal of identifying weakly accreting central black holes in UCDs. Our study spans 578 UCDs distributed across 13 different host systems, including clusters, groups, fossil groups, and isolated galaxies. Of the 336 spectroscopically confirmed UCDs with usable archival Chandra imaging observations, 21 are X-ray-detected. Imposing a completeness limit of L{sub X}>2×10{sup 38} erg s{sup −1}, the global X-ray detection fraction for the UCD population is ∼3%. Of the 21 X-ray-detected UCDs, seven show evidence of long-term X-ray time variability on the order of months to years. X-ray-detected UCDs tend to be more compact than non-X-ray-detected UCDs, and we find tentative evidence that the X-ray detection fraction increases with surface luminosity density and global stellar velocity dispersion. The X-ray emission of UCDs is fully consistent with arising from a population of low-mass X-ray binaries (LMXBs). In fact, there are fewer X-ray sources than expected using a naive extrapolation from globular clusters. Invoking the fundamental plane of black hole activity for SUCD1 near the Sombrero galaxy, for which archival Jansky Very Large Array imaging at 5 GHz is publicly available, we set an upper limit on the mass of a hypothetical central black hole in that UCD to be ≲10{sup 5}M{sub ⊙}. While the majority of our sources are likely LMXBs, we cannot rule out central black holes in some UCDs based on X-rays alone, and so we address the utility of follow-up radio observations to find weakly accreting central black holes.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2016

Variable radio emission from the young stellar host of a hot jupiter

We report the discovery of variable radio emission associated with the T Tauri star, V830 Tau, which was recently shown to host a hot Jupiter companion. Very Large Array observations at a frequency of 6 GHz reveal a detection on 2011 May 1 with a flux density 919 ± 26 μJy, along with non-detections in two other epochs at <66 and <150 μJy. Additionally, Very Long Baseline Array observations include one detection and one non-detection at comparable sensitivity, demonstrating that the emission is nonthermal in origin. The emission is consistent with the gyro-synchrotron or synchrotron mechanism from a region with a magnetic field ≳30 G and is likely driven by an energetic event such as magnetic reconnection that accelerated electrons. With the limited data we have, we are not able to place any constraint on the relationship between the radio emission and the rotational or orbital properties of V830 Tau. This is the first detection of radio emission from a non-degenerate star known to host an exoplanet.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2017

An Error-Entropy Minimization Algorithm for Tracking Control of Nonlinear Stochastic Systems with Non-Gaussian Variables

This paper presents an error-entropy minimization tracking control algorithm for a class of dynamic stochastic system. The system is represented by a set of time-varying discrete nonlinear equations with non-Gaussian stochastic input, where the statistical properties of stochastic input are unknown. By using Parzen windowing with Gaussian kernel to estimate the probability densities of errors, recursive algorithms are then proposed to design the controller such that the tracking error can be minimized. The performance of the error-entropy minimization criterion is compared with the mean-square-error minimization in the simulation results.

Entropy↗
DOE OSTI2017

The impacts of oceanic deep temperature perturbations in the North Atlantic on decadal climate variability and predictability

Decadal climate predictability in the North Atlantic is largely related to ocean low frequency variability, whose sensitivity to initial conditions is not very well understood. Recently, three-dimensional oceanic temperature anomalies optimally perturbing the North Atlantic Mean Temperature (NAMT) have been computed via an optimization procedure using a linear adjoint to a realistic ocean general circulation model. The spatial pattern of the identified perturbations, localized in the North Atlantic, has the largest magnitude between 1000 and 4000 m depth. In the present study, the impacts of these perturbations on NAMT, on the Atlantic meridional overturning circulation (AMOC), and on climate in general are investigated in a global coupled model that uses the same ocean model as was used to compute the three-dimensional optimal perturbations. In the coupled model, these perturbations induce AMOC and NAMT anomalies peaking after 5 and 10 years, respectively, generally consistent with the ocean-only linear predictions. To further understand their impact, their magnitude was varied in a broad range. For initial perturbations with a magnitude comparable to the internal variability of the coupled model, the model response exhibits a strong signature in sea surface temperature and precipitation over North America and the Sahel region. The existence and impacts of these ocean perturbations have important implications for decadal prediction: they can be seen either as a source of predictability or uncertainty, depending on whether the current observing system can detect them or not. In fact, comparing the magnitude of the imposed perturbations with the uncertainty of available ocean observations such as Argo data or ocean state estimates suggests that only the largest perturbations used in this study could be detectable. This highlights the importance for decadal climate prediction of accurate ocean density initialisation in the North Atlantic at intermediate and greater depths.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2021

Metallofullerene photoswitches driven by photoinduced fullerene-to-metal electron transfer

We report on the discovery and detailed exploration of the unconventional photo-switching mechanism in metallofullerenes, in which the energy of the photon absorbed by the carbon cage π-system is transformed to mechanical motion of the endohedral cluster accompanied by accumulation of spin density on the metal atoms. Comprehensive photophysical and electron paramagnetic resonance (EPR) studies augmented by theoretical modelling are performed to address the phenomenon of the light-induced photo-switching and triplet state spin dynamics in a series of Y x Sc 3-x N@C 80 (x = 0–3) nitride clusterfullerenes. Variable temperature and time-resolved photoluminescence studies revealed a strong dependence of their photophysical properties on the number of Sc atoms in the cluster. All molecules in the series exhibit temperature-dependent luminescence assigned to the near-infrared thermally-activated delayed fluorescence (TADF) and phosphorescence. The emission wavelengths and Stokes shift increase systematically with the number of Sc atoms in the endohedral cluster, whereas the triplet state lifetime and S 1 –T 1 gap decrease in this row. For Sc 3 N@C 80 , we also applied photoelectron spectroscopy to obtain the triplet state energy as well as the electron affinity. Spin distribution and dynamics in the triplet states are then studied by light-induced pulsed EPR and ENDOR spectroscopies. The spin–lattice relaxation times and triplet state lifetimes are determined from the temporal evolution of the electron spin echo after the laser pulse. Well resolved ENDOR spectra of triplets with a rich structure caused by the hyperfine and quadrupolar interactions with 14 N, 45 Sc, and 89 Y nuclear spins are obtained. The systematic increase of the metal contribution to the triplet spin density from Y 3 N to Sc 3 N found in the ENDOR study points to a substantial fullerene-to-metal charge transfer in the excited state. These experimental results are rationalized with the help of ground-state and time-dependent DFT calculations, which revealed a substantial variation of the endohedral cluster position in the photoexcited states driven by the predisposition of Sc atoms to maximize their spin population.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2017

Evaluation of the National Solar Radiation Database (NSRDB): 1998-2015

This paper validates the performance of the physics-based Physical Solar Model (PSM) data set in the National Solar Radiation Data Base (NSRDB) to quantify the accuracy of the magnitude and the spatial and temporal variability of the solar radiation data. Achieving higher penetrations of solar energy on the electric grid and reducing integration costs requires accurate knowledge of the available solar resource. Understanding the impacts of clouds and other meteorological constituents on the solar resource and quantifying intra-/inter-hour, seasonal, and interannual variability are essential for accurately designing utility-scale solar energy projects. Solar resource information can be obtained from ground-based measurement stations and/or from modeled data sets. The availability of measurements is scarce, both temporally and spatially, because it is expensive to maintain a high-density solar radiation measurement network that collects good quality data for long periods of time. On the other hand, high temporal and spatial resolution gridded satellite data can be used to estimate surface radiation for long periods of time and is extremely useful for solar energy development. Because of the advantages of satellite-based solar resource assessment, the National Renewable Energy Laboratory developed the PSM. The PSM produced gridded solar irradiance -- global horizontal irradiance (GHI), direct normal irradiance (DNI), and diffuse horizontal irradiance -- for the NSRDB at a 4-km by 4-km spatial resolution and half-hourly temporal resolution covering the 18 years from 1998-2015. The NSRDB also contains additional ancillary meteorological data sets, such as temperature, relative humidity, surface pressure, dew point, and wind speed. Details of the model and data are available at https://nsrdb.nrel.gov. The results described in this paper show that the hourly-averaged satellite-derived data have a systematic (bias) error of approximately +5% for GHI and less than +10% for DNI; however, the scatter (root mean square error [RMSE]) difference is higher for the hourly averages.

14 SOLAR ENERGY↗