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At least 775 records · Page 43

Amorphous ZrCl 4 -Based Superionic Conductor as a Cost-Effective Solid Electrolyte for Batteries

Developing highly conductive and cost-effective solid electrolytes is essential for the commercialization of all-solid-state batteries (ASSBs). Zr-based halide electrolytes hold great promise due to their low estimated cost and high oxidation stability. However, the ionic conductivities of most of them are not high enough to enable moderate- and high-rate cycling of ASSBs. Here, fast ion transport is achieved in a group of cost-effective ZrCl 4 -based electrolytes via a design strategy to create highly disordered amorphous structures. Amorphous Li 0.8 ZrCl 4 (SO 4 ) 0.4 , with a low estimated cost of $21 kg –1 , achieves an ionic conductivity of 1.86 mS cm –1 at 25 °C. It also shows a high oxidation limit of 4.5 V vs Li/Li + and good compatibility with high-voltage cathodes, as demonstrated by the stable cycling of ASSBs (73.7% capacity retention after 1000 cycles at 1 C). Synchrotron X-ray diffraction, pair distribution function analysis, and electrochemical impedance spectroscopy reveal that the outstanding conductivity of these amorphous electrolytes is closely related to their short-range and medium-range ordering, revealing new insights for designing high-performance, cost-effective solid electrolytes.

Zhang, Guangxing [Georgia Institute of Technology,↗

Data from: "Moisture rivals temperature in limiting photosynthesis by trees establishing beyond their cold-edge range limit under ambient and warmed conditions"

This archive contains data files that were used to draw conclusions in “Moisture rivals temperature in limiting photosynthesis by trees establishing beyond their cold-edge range limit under ambient and warmed conditions”, by Moyes et al., 2015. All field research was completed in common garden plots set up as part of the Alpine Treeline Warming Experiment (ATWE) on Niwot Ridge, Colorado, USA.There are two main data file formats in this archive: comma-separated values (.csv), and Microsoft Excel (.xls and .xlsx). .xlsx files can be read using Microsoft Excel and Google Sheets, and .csv files can be read using any simple text editor program, such as TextEdit (Mac) and Notepad (Windows). This .pdf data user’s guide can be read using Adobe Acrobat Reader, or any other compatible software. Seedling photographs and their corresponding leaf area-processed images are available in .jpg/.JPG image format, and can be opened using Preview (Mac) and Photos (Windows). To provide additional spatial context, two types of geospatial files are also published in this data package: ESRI shapefiles (.shp) and .kml files. Shapefiles are compatible with any GIS software able to read the file type (such as QGIS or ESRI’s ArcGIS suite), and .kml files can be opened with Google Earth or Google Maps. Figures 3 and 4 in the publication contain data from Moyes et al. 2013. This publication is cited in the References section in this archive, and data files can be accessed via the Alpine Treeline Warming Experiment project portal on ESS-DIVE. ---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------- Climate change is altering plant species distributions globally, and warming is expected to promote uphill shifts in mountain trees. However, at many cold-edge range limits, such as alpine treelines in the western United States, tree establishment may be colimited by low temperature and low moisture, making recruitment patterns with warming difficult to predict.- We measured response functions linking carbon (C) assimilation and temperature- and moisture-related microclimatic factors for limber pine (Pinus flexilis) seedlings growing in a heating × watering experiment within and above the alpine treeline. We then extrapolated these response functions using observed microclimate conditions to estimate the net effects of warming and associated soil drying on C assimilation across an entire growing season.- Moisture and temperature limitations were each estimated to reduce potential growing season C gain from a theoretical upper limit by 15–30% (c. 50% combined). Warming above current treeline conditions provided relatively little benefit to modeled net assimilation, whereas assimilation was sensitive to either wetter or drier conditions.- Summer precipitation may be at least as important as temperature in constraining C gain by establishing subalpine trees at and above current alpine treelines as seasonally dry subalpine and alpine ecosystems continue to warm.

54 ENVIRONMENTAL SCIENCES↗

Real-Time Measurements of Gas-Phase Medium-Chain Chlorinated Paraffins Reveal Daily Changes in Gas-Particle Partitioning Controlled by Ambient Temperature

Chlorinated paraffins (CPs) are synthetic polychlorinated n-alkanes produced as mixtures of a range of C x Cl y H 2x–y+2 formulas. CPs have numerous industrial applications but are toxic, long-lived, and environmentally ubiquitous with environmental releases occurring throughout their production, use, and disposal. Short-chain chlorinated paraffins (SCCPs, C 10–13 ) have been regulated by the United States Environmental Protection Agency since 2009 and by the Stockholm Convention since 2017. SCCP regulation is expected to cause increased production of medium-chain chlorinated paraffins (MCCPs; C 14–17 ), which are currently under consideration for Stockholm Convention regulations. Thus, there is a need to improve the understanding of MCCP environmental transport, distribution, and fate. Existing measurements are limited in their spatial and temporal coverage. Measurements of CP atmospheric loading are particularly scarce. Historically, these measurements have required long sampling times, obscuring the temporal behavior of atmospheric CPs. We report real-time in situ measurements of 18 gas-phase MCCPs. These measurements were made in the United States Southern Great Plains with nitrate ion chemical ionization mass spectrometry (NO 3 –CIMS). Here, the estimated average lower-limit concentration of MCCPs is on the order of single-digit ng/m 3 . MCCP diel behavior is partially explained by gas-particle partitioning with implications for MCCP transport and lifetimes.

54 ENVIRONMENTAL SCIENCES↗

Characterizing local rooftop solar adoption inequity in the US

Abstract Residential rooftop solar is slated to play a significant role in the changing US electric grid in the coming decades. However, concerns have emerged that the benefits of rooftop solar deployment are inequitably distributed across demographic groups. Previous work has highlighted inequity in national solar adopter deployment and income trends. We leverage a dataset of US solar adopter household income estimates—unique in its size and resolution—to analyze differences in adoption equity at the local level and identify those conditions that yield more equitable solar adoption, with implications for policy strategies to reduce inequities in solar adoption. The solar inequities observed at the national and state levels also exist at more granular levels, but not uniformly so; some US census tracts exhibit less solar inequity than others. Some demographic, solar system, and market characteristics robustly lead to more equitable solar adoption. Our findings suggest that while solar adoption inequity is frequently attributed to the relatively high costs of solar adoption, costs may become less relevant as solar prices decline. Results also indicate that racial diversity and education levels affect solar adoption patterns at a local level. Finally, we find that solar adoption is more equitable in census tracts served by specific types of installers. Future research and policy can explore ways to leverage these findings to accelerate the transition to equitable solar adoption.

14 SOLAR ENERGY↗

MatPhase: Material phase prediction for Li-ion Battery Reconstruction using Hierarchical Curriculum Learning

Li-ion Batteries (LIB), one of the most efficient energy storage devices, are used extensively in many industrial applications. These batteries consist of electrodes that are put together with heterogeneous material compositions. Imaging data of these battery electrodes obtained from X-ray tomography can explain the distribution of material constituents and allow reconstructions to study electron transport pathways. Such reconstructions of material constituents help quantify various associated properties of electrodes (e.g., volume-specific surface area, porosity) which determine the performance of batteries. These images often suffer from low image contrast between multiple material constituents, hence making it difficult for humans to distinguish and characterize these constituents through visual inspection. A minor error in detecting distributions of the material constituents can lead to magnified errors in the calculated parameters of material properties (e.g., porosity). We present MatPhase, a novel hierarchical curriculum learning technique to address the complex task of estimating material constituent distribution in battery electrodes. MatPhase comprises three modules: (i) an uncertainty-aware global model trained to yield inferences conditioned upon global knowledge of material distribution, (ii) a local model to capture relatively more fine-grained (local) distributional signals, (iii) an aggregator model to appropriately fuse the local and global effects towards obtaining the final distribution. On average, MatPhase improves prediction up to 8.5% relative to other sophisticated modeling pipelines and state-of-the-arts (SOTA) object detection models employed in the performance comparison.

Tabassum, Anika↗

Mitochondrial Genomes of the United States Distribution of Gray Fox (Urocyon cinereoargenteus) Reveal a Major Phylogeographic Break at the Great Plains Suture Zone

We examined phylogeographic structure in gray fox (Urocyon cinereoargenteus) across the United States to identify the location of secondary contact zone(s) between eastern and western lineages and investigate the possibility of additional cryptic intraspecific divergences. We generated and analyzed complete mitochondrial genome sequence data from 75 samples and partial control region mitochondrial DNA sequences from 378 samples to investigate levels of genetic diversity and structure through population- and individual-based analyses including estimates of divergence (FST and SAMOVA), median joining networks, and phylogenies. We used complete mitochondrial genomes to infer phylogenetic relationships and date divergence times of major lineages of Urocyon in the United States. Despite broad-scale sampling, we did not recover additional major lineages of Urocyon within the United States, but identified a deep east-west split (~0.8 million years) with secondary contact at the Great Plains Suture Zone and confirmed the Channel Island fox (Urocyon littoralis) is nested within U. cinereoargenteus. Genetic diversity declined at northern latitudes in the eastern United States, a pattern concordant with post-glacial recolonization and range expansion. Beyond the east-west divergence, morphologically-based subspecies did not form monophyletic groups, though unique haplotypes were often geographically limited. Gray foxes in the United States displayed a deep, cryptic divergence suggesting taxonomic revision is needed. Secondary contact at a common phylogeographic break, the Great Plains Suture Zone, where environmental variables show a sharp cline, suggests ongoing evolutionary processes may reinforce this divergence. Follow-up study with nuclear markers should investigate whether hybridization is occurring along the suture zone and characterize contemporary population structure to help identify conservation units. Comparative work on other wide-ranging carnivores in the region should test whether similar evolutionary patterns and processes are occurring.

54 ENVIRONMENTAL SCIENCES↗

Biases in preconstruction estimates of wind plant annual energy production

Estimating the energy yield of a wind plant during the preconstruction phase is a historically difficult task, even with industry improvements in these estimations. We build on prior research comparing the realized energy production of wind plants and their estimated annual energy production P50 values (median energy production), using owner-provided energy production and losses. We produced similar results to prior studies but with a slightly increasing bias of overestimating median energy production (a bias between realized and estimated energy production of −7.4 % to −6.6 %, depending on the scenario, as opposed to −6.7 % to −5.5 % from earlier studies). In addition to assessing annual energy production P50 bias, we compared both the 1-year and the long-term annual energy production P90 and uncertainty energy yield assessment estimates to the observed long-term-corrected energy production. We found that neither the energy yield assessment uncertainty nor the P90 is conservative enough compared to the observed distribution of prediction errors, suggesting significant room for improvement in the energy yield assessment process.

17 WIND ENERGY↗

Microwave scatter and sea state estimation - Two-scale ocean wave models

The efficient estimation of ocean wave-structure parameters with a remote, narrow-beam, pulsed, microwave radar at intermediate incidence angles is discussed. The sea surface is described as the sum of random small- and large-scale structures (waves), the latter the sum of a sinusoid and a random field. It is shown that the small-scale structure is responsible for scattering and that the scatter depends parametrically on the large-scale structure. For the estimation problem it is assumed, reasonably, that the received signal is normally distributed: a relatively simple processor which will efficiently estimate parameters of the sinusoidal structure is illustrated and its performance discussed. A brief comparison is made with a normal incidence system with which the variance of the large-scale random roughness can be estimated.

Harger, R. O.↗

Tri-Level Linear Programming Model for Automatic Load Shedding Using Spectral Clustering

Traditional load shedding schemes can be inadequate in grids with high renewable penetration, leading to unstable events and unnecessary grid islanding. Although for both manual and automatic operating modes load shedding areas have been predefined by grid operators, they have remained fixed, and may be sub-optimal due to dynamic operating conditions. In this work, a distributed tri-level linear programming model for automatic load shedding to avoid system islanding is presented. Preventing islanding is preferred because it reduces the need for additional load shedding besides the disconnection of transmission lines between islands. This is crucial as maintaining the local generation-demand balance is necessary to preserve frequency stability. Furthermore, uneven distribution of generation resources among islands can lead to increased load shedding, causing economic and reliability challenges. This issue is further compounded in modern power systems heavily dependent on non-dispatchable resources like wind and solar. The upper-level model uses complex power flow measurements to determine the system areas to shed load depending on actual operating conditions using a spectral clustering approach. The mid-level model estimates the area system state, while the lower-level model determines the locations and load values to be shed. The solution is practical and promising for real-world applications.

Baquedano-Aguilar, Mario D.↗

Distributed Optimization for Nonrigid Nano-Tomography

Resolution level and reconstruction quality in nano-computed tomography (nano-CT) are in part limited by the stability of microscopes, because the magnitude of mechanical vibrations during scanning becomes comparable to the imaging resolution, and the ability of the samples to resist radiation induced deformations during data acquisition. In such cases, there is no incentive in recovering the sample state at different time steps like in time-resolved reconstruction methods, but instead the goal is to retrieve a single reconstruction at the highest possible spatial resolution and without any imaging artifacts. Here we propose a distributed optimization solver for tomographic imaging of samples at the nanoscale. Our approach solves the tomography problem jointly with projection data alignment, nonrigid sample deformation correction, and regularization. Projection data consistency is regulated by dense optical flow estimated by Farneback's algorithm, leading to sharp sample reconstructions with less artifacts. Synthetic data tests show robustness of the method to Poisson and low-frequency background noise. We accelerated the solver on multi-GPU systems and validated the method on three nano-imaging experimental data sets.

97 MATHEMATICS AND COMPUTING↗

Magnetic helicity as a constraint on coronal dissipation

The Taylor hypothesis has provided a model for the relaxed magnetic configurations of not only laboratory plasmas, but also of astrophysical plasmas. However, energy dissipation is possible only for systems which depart from a strict Taylor state, and hence a parameter describing that departure must be introduced, when the Taylor hypothesis is used to estimate the dissipation. An application of the Taylor hypothesis to the problem of coronal heating provides an insight into this difficult problem. When particular sorts of footpoint motions put energy and helicity in the corona, the conservation of helicity puts a constraint on how much of the energy can be dissipated. However, on considering a random distribution of footpoint motions, this constraint gets washed away, and the Taylor hypothesis is probably not going to play any significant role in the actual calculation of relevant physical quantities in the coronal heating problem.

Choudhuri, Arnab Rai↗

Monitoring of Observation Errors in the Assimilation of Satellite Ozone Data

The stratospheric ozone layer protects life on Earth from the harmful effects of solar ultravioiet radiation. The ozone layer is currently in a fragile state because of depletion caused by man-made chemicals, especially chlorofluorocarbons. The state of the ozone layer is being monitored and evaluated by scientific experts around the world, in order to help policy makers assess the impacts of international protocols that control the production and release of ozone depleting chemicals. Scientists use a variety ozone measurements and models in order to form a comprehensive picture about the current state of the ozone layer, and to predict the future behavior (expected to be a recovery, as the abundance of the depleting chemicals decreases). Among the data sets used, those from satellite-borne instruments have the advantage of providing a wealth of information about the ozone distribution over most of the globe. Several instruments onboard American and international satellites make measurements of the properties of the atmosphere, from which atmospheric ozone amounts are estimated; long-term measurement programs enable monitoring of trends in ozone. However, the characteristics of satellite instruments change in time. For example, the instrument lenses through which measurements are made may deteriorate over time, or the satellite orbit may drift so that measurements over each location are made later and later in the day. These changes may increase the errors in the retrieved ozone amounts, and degrade the quality of estimated ozone amounts and of their variability. Our work focuses on combining the satellite ozone data with global models that capture atmospheric motion and ozone chemistry, using advanced statistical techniques: this is known as data assimilation. Our method provides a three-dimensional global ozone distribution that is consistent with both the satellite measurements and with our understanding of processes (described in the models) that control ozone distribution. Through the monitoring of statistical properties of the agreement between the data and the model, this approach also enables us to detect changes in the quality of ozone data retrieved from satellite-borne instrument measurements. This paper demonstrates that calculations of the changes in satellite data quality, and the impact these changes on the estimates of the global ozone distribution, can assist in maintaining the uniform quality of the satellite ozone data throughout the lifetime of these instruments, thus contributing to our understanding of long-term ozone change.

Stajner, Ivanka↗

Gaseous NH4Cl revisited - A computational investigation of the potential surface and properties

An investigation of the potential surface and properties of the ground state of gaseous NH4Cl is presented. The calculations, which utilize a good basis set and include investigation of the valence correlation effects, result in a description of gaseous NH4Cl as a weakly bound complex with NH3 and HCl structures essentially equivalent to those of the isolated fragments. The charge distributions within the fragments are modifed in the complex, however, and there is a small amount of charge transfer. The results are in reasonable agreement with estimate of D sub 0, super 0 from high temperature mass spectroscopic investigations and vibrational frequencies from matrix experiments. The equilibrium constant for the reversible reaction NH4Cl yields NH3 + HCl indicates that the homogeneous formation of NH4Cl does not represent a significant chemical sink for HCl in the upper atmosphere

Raffenetti, R. C.↗

On-orbit Systems Identification of Flexible Spacecraft Technol., 1984, Pt. 2 p 465-481

Future spacecraft include configurations which are too flexible to be adequately tested prior to flight and which will require on-orbit systems identification to ensure safe operation of the flight control system. The structural dynamics model will evolve and its accuracy will improve in stages as ground tests of full-scale components and replica-scale models are performed. State Space Modeling and Conditional Maximum Likelihood Parameter Estimation methodology can provide the formal probability-based framework for the process of upgrading a model as additional test results are obtained. Although the number of unknown parameters can be reduced by the use of canonical forms for the stability matrix, the number of unknown model parameters quickly becomes unmanageable unless advantage is taken of the relationship of a much fewer number of global model parameters. Distributed parameter systems or partial differential equation models are one way to take advantage of such global parameters to reduce the number of unknown model parameters.

Taylor, L.↗

Stochastic robustness

To carry out stochastic robustness analysis, an expected probability distribution is assigned to each uncertain parameter in the system. The Monte Carlo analysis proceeds by repeatedly assigning shaped random values to each plant parameter, evaluating the stability of performance metric, and performing the binary classification (stable/unstable, etc.). If the system is stable, the state response to a unit disturbance impulse can be propagated to establish whether the response would violate settling time envelopes and whether peak actuator use would violate predetermined maximums. The final estimates of the probability of each form of unacceptable behavior are found by dividing the number of cases in which the overall system had that form of unacceptability by the number of cases run. Stability robustness can be portrayed graphically using the stochastic root locus and by using histograms of parameter values found in the unacceptable cases.

Marrison, C.↗

Estimating β eff from static, late-time Feynman neutron noise measurements

The effective delayed neutron fraction, β eff , is a kinematic parameter describing the contribution of delayed neutrons to the effective multiplication factor, $\kappa$ eff , and is of great interest to the nuclear criticality safety community and beyond. In fact, $\kappa$ eff presently must be inferred (as opposed to directly measured) since variables like β eff must be obtained from simulation, reference tables, or a dynamic or pulsed measurement where the assembly of fissile material is perturbed and not in steady state. Several recent works have proposed neutron noise techniques to estimate β eff from static measurements (such as benchmark experiments). This work experimentally investigates an approach based on looking at late-time (up to thousands of seconds) correlated neutrons in Feynman histograms. This work utilizes measurements of weapons grade plutonium and highly enriched uranium to construct late-time Feynman histograms and investigate a proposed methodology of estimating β eff from a fit of the distribution. Data is shown from both He-3 detectors and an organic scintillator array. This work is preliminary in nature, demonstrating some experimental feasibility and proposing improvements for future investigations.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Probabilistic Hazard Assessment for Tornadoes, Straight-Line Wind, and Extreme Precipitation at the Savannah River Site

Recent data sets for three meteorological phenomena with the potential to inflict damage on SRS facilities – tornadoes, straight-line winds, and heavy precipitation – are analyzed using appropriate statistical techniques to estimate the occurrence probabilities for these events in the future. Summaries of the results for DOE-mandated return periods and comparisons to similar calculations performed in 2013 by Werth et al. (W2013) are given. Using tornado statistics for i) the combined states of Georgia and South Carolina, and ii) a 2⁰ square area surrounding SRS, we calculated the probability per year of any location at SRS being struck by a tornado (the ‘strike’ probability) and the probability that any point will experience winds above set thresholds. The strike probability was calculated to be 7.04E-4 (1 chance in 1420) per year and tornadic wind speeds for DOE mandated return periods of 50,000 years (corresponding to wind design category 3 (WDC-3), and 125,000 years (meeting WDC-4) (USDOE, 2016) were estimated to be 132 mph and 147 mph, respectively. By contrast, default tornado wind speeds taken from ANSI/ANS-2.3-2011 are somewhat higher: 161 mph for return periods of 50,000 years and 173 mph every 125,000 years (ANS, 2011). Although the ANS and the SRS evaluation used the same basic model (Ramsdell and Rishel, 2007), the region defined in ANS 2.3 that encompasses the SRS also includes areas of the Great Plains and lower Midwest, regions with much higher occurrence frequencies of strong tornadoes. The SRS straight-line wind values associated with various return periods were calculated by fitting existing wind data to a GEV1 distribution and extrapolating the values for any return period from the tail of that function. For the DOE mandated return periods, we expect straight-line winds of 117 mph every 2500 years (the required WDC-3 standard) and 125 mph every 6250 years (WDC-4) at any point within the SRS. These values are similar to those from the ANS-2.3-2011 report, which has wind speeds of 125mph and 133 mph for return periods of 2500 years and 6250 years, respectively. For extreme precipitation, we compared the fits of two different theoretical extreme-value distributions and applied the one that fit the data best for each of several accumulation periods. The DOE mandated 6-hr accumulated rainfall for return periods of 10,000 years (corresponding to precipitation design category 3 (PDC-3) and 25,000 years (PDC-4) were estimated as 9.1 inches and 10.1 inches, respectively. For the 24-hr rainfall return periods of 10,000 years and 25,000 years, total rainfall estimates were 12.02 inches and 13.17 inches, respectively, higher than comparable values provided in the W2013 report.

54 ENVIRONMENTAL SCIENCES↗

Trajectory Generation for Distributed Electric Propulsion Vehicles with Propeller Synchronization

In this paper, we propose a method for generating dynamically feasible trajectories for an acoustically aware vehicle with propeller phase control. The trajectory generation procedure allows both propeller phase control and navigation objectives to be considered simultaneously. The presented method is demonstrated where the mission objectives are given as a desired position and phase trajectory. From these trajectories, the full desired state of the vehicle is calculated. Furthermore, the control inputs that realize the desired mission objectives are computed. The acoustic performance for the given trajectory is estimated in terms of sound pressure level as a function of tracking performance. The method is demonstrated in simulation, where the vehicle must navigate through an urban environment with both spatial and acoustic constraints. In the presented scenario, the vehicle must follow a given flight path, and can only reduce sound pressure level by changing the propeller phase targets.

acoustically-aware vehicle↗