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At least 559 records · Page 31

Unsupervised learning-enabled pulsed infrared thermographic microscopy of subsurface defects in stainless steel

Metallic structures produced with laser powder bed fusion (LPBF) additive manufacturing method (AM) frequently contain microscopic porosity defects, with typical approximate size distribution from one to 100 microns. Presence of such defects could lead to premature failure of the structure. In principle, structural integrity assessment of LPBF metals can be accomplished with nondestructive evaluation (NDE). Pulsed infrared thermography (PIT) is a non-contact, one-sided NDE method that allows for imaging of internal defects in arbitrary size and shape metallic structures using heat transfer. PIT imaging is performed using compact instrumentation consisting of a flash lamp for deposition of a heat pulse, and a fast frame infrared (IR) camera for measuring surface temperature transients. However, limitations of imaging resolution with PIT include blurring due to heat diffusion, sensitivity limit of the IR camera. We demonstrate enhancement of PIT imaging capability with unsupervised learning (UL), which enables PIT microscopy of subsurface defects in high strength corrosion resistant stainless steel 316 alloy. PIT images were processed with UL spatial–temporal separation-based clustering segmentation (STSCS) algorithm, refined by morphology image processing methods to enhance visibility of defects. The STSCS algorithm starts with wavelet decomposition to spatially de-noise thermograms, followed by UL principal component analysis (PCA), fine-tuning optimization, and neural learning-based independent component analysis (ICA) algorithms to temporally compress de-noised thermograms. The compressed thermograms were further processed with UL-based graph thresholding K-means clustering algorithm for defects segmentation. The STSCS algorithm also includes online learning feature for efficient re-training of the model with new data. For this study, metallic specimens with calibrated microscopic flat bottom hole defects, with diameters in the range from 203 to 76 µm, were produced using electro discharge machining (EDM) drilling. While the raw thermograms do not show any material defects, using STSCS algorithm to process PIT images reveals defects as small as 101 µm in diameter. To the best of our knowledge, this is the smallest reported size of a sub-surface defect in a metal imaged with PIT, which demonstrates the PIT capability of detecting defects in the size range relevant to quality control requirements of LPBF-printed high-strength metals.

36 MATERIALS SCIENCE↗

A Vehicle-to-Grid planning framework incorporating electric vehicle user equilibrium and distribution network flexibility enhancement

The rapid surge in electric vehicle (EV) adoption, coupled with advancements in charging technologies, emphasizes the critical necessity for expanding EV recharging infrastructure. Simultaneously, the Distribution Network (DN) encounters escalating challenges in meeting charging demand during peak traffic periods. Consequently, there is a mounting demand for the deployment of innovative Vehicle-to-Grid (V2G) technologies to augment the DN’s flexibility in power dispatch and alleviate travel costs for EV users. Hence, this paper proposes an EV-user-equilibrium-(UE)-constrained V2G planning framework that enhances flexibility in the DN. The framework aims to ascertain the optimal placement and capacity of EV charging stations (EVCSs) and V2G charging piles within the Transportation Network (TN). It takes into account the equilibrium condition stemming from competitive EV charging and routing behaviors alongside the optimal expansion of DN energy resources to accommodate the electricity supplied by the V2G piles. This study commences by analyzing EV drivers’ travel decisions, considering the influence of charging and V2G pile locations and sizes. Subsequently, we tackle the Traffic Assignment Problem with User Equilibrium (TAP-UE) model to characterize the steady-state traffic flow distribution of EVs. Following this, we formulate the optimization model for the Coordinated Power and Transportation Network (CPTN), which encompasses the optimal expansion of DN facilities and traffic flow regulation under UE conditions. To mitigate the computational complexity associated with the V2G planning model, we introduce a series of linearization methods to obtain a manageable Mixed-Integer Linear Programming (MILP) solution. Finally, to validate the efficacy of our proposed planning framework, we apply it to two test systems, including a real-world case study. Through these case studies, we explore the necessity and potential benefits of V2G technologies.

24 POWER TRANSMISSION AND DISTRIBUTION↗

Phase quantification in low carbon Nb-Mo bearing steel by electron backscatter diffraction technique coupled with kernel average misorientation

Highlights: • The microstructures in a low carbon Nb-Mo bearing steel have been investigated. • EBSD combined with a (KAM) map has been used for quantification. • The effects of step size and kernel size on quantification are systemically discussed. • The result indicates that the kernel size should be close to the sub-structure of the granular bainite. - Abstract: An efficient and accurate method is developed for microstructural quantification of complex phases in a low carbon Nb-Mo bearing steel, of which optical micrographs show that it consists of granular bainite and a small amount of ferrite. Our previous work, proposing a method to measure the misorientation angles via electron backscatter diffraction (EBSD) to differentiate granular bainite and ferrite, has been reported. That method is accurate for phase quantification but laborious for the characterization process. To resolve this difficulty, in this study, EBSD combined with a kernel average misorientation (KAM) map is used for phase characterization. Comparisons are made among KAM maps with different kernel sizes (300 to 600 nm) and various step sizes (100 to 600 nm). It is found that a kernel size close to the sub-structure size of granular bainite (500 nm) is optimal for phase identification, while varied step sizes produce relatively invariant results. Therefore, KAM maps can be used for fast and reliable phase quantification, provided that an appropriate kernel size and a large step size are used.

36 MATERIALS SCIENCE↗

Development of Algal Biomass Yield Improvements in an Integrated Process

Global Algae Innovations (Global Algae) collaborated with TSD Management Associates (TSD), Scripps Institution of Oceanography at the University of California San Diego (SIO), GE Power & Water (GE), Hawaii Bioenergy (HBE), Kuehnle AgroSystems (KAS), Texas AgriLife Research (TALR), and Pacific Northwest National Laboratory (PNNL) to increase algae oil yield and optimize unit operations in order to facilitate commercial development of algal-derived, drop-in transportation fuels. All improvements were viewed through a system-wide techno economic model to ensure the work is focused on and limited to approaches that are scalable to commercially relevant size and compatible with an overall system that is economically viable. The objectives of the proposed project were (i) to develop improved strains and cultivation methods for a 40% increase in algal biofuel intermediate yield; (ii) to develop economical, scalable, low energy pre-processing technologies for harvesting, dewatering, and extraction for an 88% reduction in the downstream processing energy; and (iii) to achieve these improvements in an integrated outdoor system that reduces the projected algae biomass production cost by 58%. All project goals were exceeded, and the project was completed on schedule and budget. Two major technology breakthroughs were achieved. The first breakthrough is an improved cultivation system approach that increases algal productivity by 80% in growth phase while simultaneously reducing the energy use for cultivation by 67%. The second is a harvesting and dewatering technology that reduces energy use by 95-99%, achieves 100% capture efficiency with crystal clear permeate, and produces a 15-20% algae slurry. The harvesting and dewatering technology was commercialized and is now available to the algae industry as the Zobi Harvester®.

09 BIOMASS FUELS↗

Decreasing the Impact–Abrasive Wear of Steel

A new method of assessing the impact–abrasive resistance of steel permits simulation of the impact–abrasive wear with variation in the magnitude and inclination of the impact force, type of abrasive, and its grain size and rate of consumption. The influence of five carbide-forming elements on the properties of the cast and quenched steel is studied: specifically, attention focuses on the abrasion resistance, impact–abrasive resistance, and hardness of the steel. Optimal steel compositions with abrasion resistance and impact–abrasive resistance greater than that of 35GL steel are identified.

42 ENGINEERING↗

M2CT-22IN1202096 Design for Carbon Conversion Product Pathways with Nuclear Power Plant Integration

Coal is a globally abundant resource that historically has been used for power generation via combustion. As the power industry replaces coal with cleaner methods of generation, energy-rich coal could be used in other chemical and fuel applications. This study presents a coal utilization option in which coal combustion is replaced with a carbon-free nuclear power plant and the coal is upgraded to valuable products for a variety of markets. Coal is prepared for conversion first by the pyrolysis process, which will optimize solid, liquid, and gaseous products based on the market size and potential product value, maximizing the monetary value of coal. This process is designed using bituminous coal from the Appalachian region as a basis to provide a pathway to preserve or transition coal-related jobs and create new jobs associated with the clean energy transition. Process modeling in the AspenOne Suite will be used to determine each component’s sensitivities, costs, inputs, and outputs. Dispatch modeling in the FORCE toolset will optimize the entire system and calculate the NPV for the refinery lifetime. Advanced and light-water reactors are considerations to supply the heat, steam, and electricity to the process. This paper focuses on the technical and market analysis used to determine the optimal processes and product pathways for the carbon refinery. Product pathways are on activated carbon, formic acid synthesis, and methanol synthesis for further upgrading to marketable chemical and polymer products.

01 COAL, LIGNITE, AND PEAT↗

M2CT-22IN1202096 Design for Carbon Conversion Product Pathways with Nuclear Power Plant Integration

Coal is a globally abundant resource that historically has been used for power generation via combustion. As the power industry replaces coal with cleaner methods of generation, energy-rich coal could be used in other chemical and fuel applications. This study presents a coal utilization option in which coal combustion is replaced with a carbon-free nuclear power plant and the coal is upgraded to valuable products for a variety of markets. Coal is prepared for conversion first by the pyrolysis process, which will optimize solid, liquid, and gaseous products based on the market size and potential product value, maximizing the monetary value of coal. This process is designed using bituminous coal from the Appalachian region as a basis to provide a pathway to preserve or transition coal-related jobs and create new jobs associated with the clean energy transition. Process modeling in the AspenOne Suite will be used to determine each component’s sensitivities, costs, inputs, and outputs. Dispatch modeling in the FORCE toolset will optimize the entire system and calculate the NPV for the refinery lifetime. Advanced and light-water reactors are considerations to supply the heat, steam, and electricity to the process. This paper focuses on the technical and market analysis used to determine the optimal processes and product pathways for the carbon refinery. Product pathways are on activated carbon, formic acid synthesis, and methanol synthesis for further upgrading to marketable chemical and polymer products.

01 COAL, LIGNITE, AND PEAT↗

Optimization of Binning Parameters in the Feynman Variance-to-Mean Method for Delayed Neutron Reinterrogation [Poster]

The purpose of this work is to determine the optimal input parameters for analyzing active interrogation data that utilizes the physics of the delayed neutron re-interrogation technique. This work compares the signature from an active neutron measurement of a highly enriched uranium (HEU) system to an active background measurement (i.e., without the HEU item in place). In addition, varying analyses of the NoMAD list-mode detector data are performed to determine whether it is preferential to use a particular analysis bin size for producing Feynman histograms, selection of pulses to prevent discrepancies from buildup, or window of time during the pulsed neutron interrogation.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

STITCHES: creating new scenarios of climate model output by stitching together pieces of existing simulations

Abstract. Climate model output emulation has long been attempted to support impact research, mainly to fill in gaps in the scenario space. Given the computational cost of running coupled earth system models (ESMs), which are usually the domain of supercomputers and require on the order of days to weeks to complete a century-long simulation, only a handful of different scenarios are usually chosen to externally force ESM simulations. An effective emulator, able to run on standard computers in times of the order of minutes rather than days could therefore be used to derive climate information under scenarios that were not run by ESMs. Lately, the necessity of accounting for internal variability has also made the availability of initial-condition ensembles, under a specific scenario, important, further increasing the computational demand. At least so far, emulators have been limited to simplified ESM-like output, either seasonal, annual, or decadal averages of basic quantities, like temperature and precipitation, often emulated independently of one another. With this work, we propose a more comprehensive solution to ESM output emulation. Our emulator, STITCHES, uses existing archives of earth system models' (ESMs) scenario experiments to construct ESM-like output under new scenarios or enrich existing initial-condition ensembles, which is what other emulators also aim to do. Importantly, however, STITCHES' output has the same characteristics of the ESM output it sets out to emulate: multivariate, spatially resolved, and high frequency, representing both the forced component and the internal variability around it. STITCHES extends the idea of time sampling – according to which climate outcomes are stratified by the global warming level at which they manifest themselves, irrespective of the scenario and time at which they occur – to the construction of a continuous history of ESM-like output over the whole 21st century, consistent with a 21st-century trajectory of global surface air temperature (GSAT) derived from the scenario that has been chosen as the target of the emulation. STITCHES does so by first splitting the target GSAT trajectory into decade-long windows, then matching each window in turn to a decade-long window within an existing model simulation from the available scenario runs according to its proximity to the target in absolute size of the temperature anomaly and its rate of change. A look-up table is therefore created of a sequence of existing experiment–time-window combinations that, when stitched together, create a GSAT trajectory “similar” to the target. Importantly, we can then stitch together much more than GSAT from these windows, i.e., any output that the ESM has saved for these existing experiment–time-window combinations, at any frequency and spatial scale available in its archive. We show that the stitching does not introduce artifacts in the great majority of cases (we look at temperature and precipitation at monthly frequency and on the native grid of the ESM and at an index of ENSO activity, the Southern Oscillation Index). This is true even if the criteria for the identification of the decades to be stitched together are chosen to work for a smoothed time series of annual GSAT, a result we expect given the larger amount of noise affecting most other variables at finer spatial scales and higher frequencies, which therefore are more “forgiving” of the stitching. We successfully test the method's performance over many ESMs and scenarios. Only a few exceptions surface, but these less-than-optimal outcomes are always associated with a scarcity of the archived simulations from which we can gather the decade-long windows that form the building blocks of the emulated time series. In the great majority of cases, STITCHES' performance is satisfactory according to metrics that reward consistency in trends, interannual and inter-ensemble variance, and autocorrelation structure of the time series stitched together. The method therefore can be used to create ESM-like output according to new scenarios, on the basis of a trajectory of GSAT produced according to that scenario, which could be easily obtained by a simple climate model. It can also be used to increase the size of existing initial-condition ensembles. There are aspects of our emulator that will immediately disqualify it for specific applications, like when climate information is needed whose characteristics result from accumulated quantities over windows of times longer than those used as pieces by STITCHES, droughts longer than a decade for example. But for many applications, we argue that a stitched product can satisfy the climate information needs of impact researchers. STITCHES cannot emulate ESM output from scenarios that result in GSAT trajectories outside of the envelope available in the archive, nor can it emulate trajectories with shapes different from existing ones (overshoots with negative derivative, for example). Therefore, the size and characteristics of the available archives of ESM output are the principal limitations for STITCHES' deployment. Thus, we argue for the possibility of designing scenario experiments within, for example, the next phase of the Coupled Model Intercomparison Project according to new principles, relieved of the need to produce a number of similar trajectories that vary only in radiative forcing strength but more strategically covering the space of temperature anomalies and rates of change.

54 ENVIRONMENTAL SCIENCES↗

Parametric Optimization of Erosive Wear Response of TiAlN-Coated Aluminium Alloy Using Taguchi Method

In this research work, high-velocity oxy-fuel thermal spraying is used to develop TiAlN coatings on AA1050 and AA5083 aluminium alloy substrates. Slurry wear behavior of coatings is evaluated using jet-type test rig. Surface studies were carried out to investigate the potential erosion mechanism. The influence of key parameters identified using the Taguchi analysis is also corroborated with a wear model. The potential mechanism identified by wear model is in excellent convergence with that observed experimentally. Mixed ploughing and cutting, formation of platelets, abrasion grooves and cracks are witnessed as primary mechanisms causing loss of coating. Results indicate that impact velocity is recognized as a highly contributing parameter with contribution ratio of 79.24 and 83.75% followed by impingement angle with contribution ratio of 15.81 and 11.58% for AA1050 and AA5083, respectively. The important sequences of the control parameters are recognized to be impact velocity > impingement angle > erodent feed rate > erodent size for AA1050 and impact velocity > impingement angle > erodent size > erodent feed rate for AA5083. The best possible combination of control parameters for AA1050 and AA5083 to achieve minimal wear rate with respect to impact velocity, erodent size, impingement angle and erodent feed rate is 30 m/s, 225 µm, 30°, 160 g/min and 25 m/s, 150 µm, 30°, 160 g/min, respectively.

36 MATERIALS SCIENCE↗

Mechanochemical method of producing triethoxysilane

A mechanochemical method for synthesis of triethoxysilane from silicon-copper contact mass and ethyl alcohol in the developed vibration reactor is presented. It is shown that the process of a direct alkoxysilane synthesis in the vibro-boiling layer is affected by a series of control parameters such as the ratio between the contact mass and the mass of grinding bodies, the grinding body sizes and their ratios in a polydisperse mixture, power density. Optimization of these parameters allowed us to obtain HSi(OEt){sub 3} with a selectivity of 50% at a silicon conversion of 90% without the use of promoters.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

fPINNs: Fractional Physics-Informed Neural Networks

Physics-informed neural networks (PINNs), introduced, are effective in solving integer-order partial differential equations (PDEs) based on scattered and noisy data. PINNs employ standard feedforward neural networks (NNs) with the PDEs explicitly encoded into the NN using automatic differentiation, while the sum of the mean-squared PDE residuals and the mean-squared error in initial-boundary conditions is minimized with respect to the NN parameters. Here we extend PINNs to fractional PINNs (fPINNs) to solve space-time fractional advection-diffusion equations (fractional ADEs), and we study systematically their convergence, hence explaining both fPINNs and PINNs for the first time. Specifically, we demonstrate their accuracy and effectiveness in solving multidimensional forward and inverse problems with forcing terms whose values are only known at randomly scattered spatio-temporal coordinates (black-box (BB) forcing terms). A novel element of the fPINNs is the hybrid approach that we introduce for constructing the residual in the loss function using both automatic differentiation for the integer-order operators and numerical discretization for the fractional operators. This approach bypasses the difficulties stemming from the fact that automatic differentiation is not applicable to fractional operators because the standard chain rule in integer calculus is not valid in fractional calculus. To discretize the fractional operators, we employ the Grünwald--Letnikov (GL) formula in one-dimensional fractional ADEs and the vector GL formula in conjunction with the directional fractional Laplacian in two- and three-dimensional fractional ADEs. We first consider the one-dimensional fractional Poisson equation and compare the convergence of the fPINNs against the finite difference method (FDM). We present the solution convergence using both the mean L 2 error as well as the standard deviation due to sensitivity to NN parameter initializations. Using different GL formulas we observe first-, second-, and third-order convergence rates for small size training sets but the error saturates for larger training sets. We explain these results by analyzing the four sources of numerical errors due to discretization, sampling, NN approximation, and optimization. The total error decays monotonically (below 10 –5 for a third-order GL formula) but it saturates beyond that point due to the optimization error. We also analyze the relative balance between discretization and sampling errors and observe that the sampling size and the number of discretization points (auxiliary points) should be comparable to achieve the highest accuracy. As we increase the depth of the NN up to certain value, the mean error decreases and the standard deviation increases, whereas the width has essentially no effect unless its value is either too small or too large. We next consider time-dependent fractional ADEs and compare white-box (WB) and BB forcing. We observe that for the WB forcing, our results are similar to the aforementioned cases; however, for the BB forcing fPINNs outperform FDM. Subsequently, we consider multidimensional time-, space-, and space-time-fractional ADEs using the directional fractional Laplacian and we observe relative errors of 10 –3 ~ 10 –4 . Lastly, we solve several inverse problems in one, two, and three dimensions to identify the fractional orders, diffusion coefficients, and transport velocities and obtain accurate results given proper initializations even in the presence of significant noise.

97 MATHEMATICS AND COMPUTING↗

Catalytic water splitting kinetics and optimization

This project was motivated primarily by the opportunity of turning photocatalysis into a cost efficient hydrogen generation method for domestic energy and chemical production, and by the need to provide detailed mechanisms of photocatalytic reactions of broad scientific and technological interest. Specifically, we focused on the development of a new technique for analysis of (photo)catalytic reaction mechanisms to guide photocatalyst design. Our approach was based on applying velocity map imaging (VMI) to surface catalyzed reactions in order to identify photocatalytic reaction products, intermediates, and relate these to photocatalyst composition, dimensions, size and other characteristics. By coupling VMI with other spectroscopic and microstructural characterization, we aimed to reveal the features that limit performance of photocatalysis. As a first step to achieve this goal, we constructed a custom VMI microscope specifically designed for investigation of surface photocatalytic reactions and validated it’s design using a photodissociatinon of MnBr(CO) 5 adsorbed on a metallic surface. Using both 230 nm and 266 nm pulsed laser excitations, we observed that there are likely three main pathways for photodissociation of Mn(CO)5Br: from the gas phase, the surface, and ejected Mn complex from the surface increasing the gas phase concentration.

08 HYDROGEN↗

Lower energy levels and iodine-based material decomposition images increase pancreatic ductal adenocarcinoma conspicuity on rapid kV-switching dual-energy CT

Purpose: Multidetector computed tomography (MDCT) is used in the diagnosis of pancreatic ductal adenocarcinoma (PDAC), but it may be inadequate in some cases. Tumor detection can be improved using rapid kV-switching dual-energy CT (rsDECT) and iodine maps. Our aim this study is to evaluate tumor conspicuity in PDAC cases using rsDECT and iodine maps. Methods: Ninety cases with PDAC were evaluated rsDECT. Tumor contrast (HU) differences, tumor size, CNR (contrast-noise ratio), and noise were measured at 70 keV, individual CNR-energy level, and 45 keV, respectively. Quantitative differences in contrast gain ∆70-CNR and ∆CNR-45 were compared. On iodine maps, the iodine concentration measured in the tumor and parenchyma was normalized to the aorta as normalized iodine concentration (NIC) and compared. Results: The median optimized viewing energy level was 51 keV. The mean ± SD tumor contrast values were 62 ± 20, 115 ± 48, and 152 ± 48 HU (p < 0.001); the largest axial diameters were 36.6 ± 5.1, 37.9 ± 4.2, and 38.3 ± 3.7 mm (p = 0.015); the CNRs were 1.83 ± 0.72, 3.37 ± 0.93, and 2.36 ± 0.56; and the image noise levels were 23.7 ± 6.8, 39.3 ± 11.6, and 59.5 ± 17.2 (p < 0.001) (p < 0.001) for 70 keV, optimized energy level, and 45 keV, respectively. The mean ± SD contrast gain ∆70-CNR was 63 ± 12; and ∆CNR-45 was 31 ± 26 HU (p < 0.001). NIC{sub tumor} and NIC{sub parenchyma} values were 0.62 ± 0.03 and 1.36 ± 0.05 mg/mL, respectively (p = 0.004). Conclusion: The use of low energy levels on rsDECT and iodine maps improves tumor conspicuity. This situation may be help better detection of pancreatic tumors.

62 RADIOLOGY AND NUCLEAR MEDICINE↗

Pt/Ferric Hydroxyphosphate: An Effective Catalyst for the Selective Hydrogenation of α,β-Unsaturated Aldehydes (Ketones) into α,β-Unsaturated Alcohols

Four micro (nano)-sized mesoporous ferric hydroxyphosphates (FHP) are synthesized by a reverse microemulsion-solvothermal method, and then are used as supports to prepare supported Pt catalysts. The mean particle diameter of Pt nanoparticles (NPs) was 4.5–4.6 nm. When the four different Pt/FHP catalysts were used into the hydrogenation of α,β-unsaturated aldehydes (ketones) to their corresponding unsaturated alcohols, Pt/FHP (c) catalyst showed better catalytic performance than the other three partners. Under the optimal experimental conditions, several tested α,β-unsaturated aldehydes could be effectively transformed into corresponding unsaturated alcohols over Pt/FHP (c) catalyst. The catalyst could be recycled and reused several times without activity loss. We propose the stronger interaction between the Pt NPs and ferric ions of the FHP (c) are responsible for its good catalytic performance, and this stronger interaction should be rooted in its enhanced Lewis acid strength.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Layered Li{sub 1+x}(Ni{sub 0.33}Co{sub 0.33}Mn{sub 0.33})O{sub 2} cathode material prepared by microwave assisted solvothermal method for lithium ion batteries

Highlights: • Microwave assisted solvothermal method. • Effect of (0.05–0.2) mol% of excess lithium in layered Li{sub 1+x}(Ni{sub 0.33}Co{sub 0.33}Mn{sub 0.33})O{sub 2}. • Different calcination temperature. • Voltage-cut off optimization. • Conductivity and electrochemical performance correlation. - Abstract: Layered hexagonal structure Li{sub 1+x}(Ni{sub 0.33}Co{sub 0.33}Mn{sub 0.33})O{sub 2} (LNCM) (x = 0, 0.05, 0.1, 0.15 and 0.2 mol%) compounds were prepared by microwave assisted solvothermal method at two different calcination temperature of 850 and 950 °C. The phase purity of the LNCM compounds was confirmed by Rietveld refined XRD pattern, Raman, and HRTEM studies. The average particle sizes were in the submicron range as confirmed by SEM and TEM analysis. Galvanostatic cycling studies were made in various voltage range, 2.5 to 4.4/4.6/4.8 V at a current rate of 0.2 C. Among all the compounds, LNCM prepared at 950 °C (HS3) exhibited an initial discharge capacity of 197 mAh/g and maintained a capacity of 180 mAh/g at the end of 40{sup th} cycle in 2.5–4.6 V window, indicating an excellent capacity retention. HS3 shows the electrical conductivity of 9.31 × 10{sup −6} S/cm, which was higher than all the other compounds and discussed the reason for the improved electrochemical performance.

36 MATERIALS SCIENCE↗

Validation of Microgrid Algorithms using At-Scale Simulation and Emulation Real-Time (ASSERT) Framework

This paper presents a novel framework for validating microgrid algorithms using a At-Scale Simulation and Emulation Real-Time (ASSERT) setup. The proposed universal microgrid validation framework was developed at Advanced Research on Integrated Energy Systems (ARIES) platform at National Renewable Energy Laboratory in Golden, Colorado, USA. As the number of intercommunicating devices grow in power systems, along with more integration of inverter-based resources, developing and validating microgrid operation and control algorithms is becoming complex and time-consuming task. The ASSERT framework is designed to provide a comprehensive, accurate, and efficient solution for validating microgrid algorithms. It combines at-scale simulations and real-time emulation to create a virtual environment that closely mimics the behavior of a physical microgrids which are characteristic of future smart distribution systems, such as: (1) increasing variability in the physical size of new energy technologies; (2) requiring control large numbers of interconnected devices, and (3) integrating diverse technologies that have not previously worked together. The paper describes the technical details of the ASSERT framework, its validation process, and its benefits over traditional validation methods. The framework's ability to validate the performance of various algorithms is demonstrated through a case study, which shows that it can effectively identify the weaknesses of an algorithm and optimize its performance. Overall, the ASSERT framework is a promising tool that can significantly enhance the development and validation of microgrid algorithms, leading to more reliable and efficient microgrid operation.

at-scale↗

An Efficient Bayesian Method for Advancing the Application of Deep Learning in Earth Science

Despite their wide and successful applications, deep learning (DL) models are prone to overfitting for small training datasets, produce a poor predictive performance for uncertain data, and provide point estimations without any indication of the accuracy and credibility. These limitations of the deterministic DL models hinder their effective application in Earth system science where the labelled data are sparse, noisy and incomplete with large uncertainty and where the predictive uncertainty quantification is needed for scientific understanding and policy decision making. Integration of Bayesian inference into DL models adds an estimate of uncertainty and regularization in the predictions. However, traditional Bayesian methods are computationally unaffordable and inflexible for high-dimensional problems, which limits their application to DL systems that typically have millions of model parameters. In this effort, we propose an efficient and general-purpose Bayesian inference method to advance DL model optimization and uncertainty quantification, so as to facilitate the adoption of DL in Earth sciences. In a demonstration, we integrate the proposed Bayesian method with a feedforward neural network (NN) to build a fast-to-evaluate surrogate of the complex Energy Exascale Earth System Land Model for efficient modeling. The formulated Bayesian NN, using a small number of training data, produces an accurate prediction with high credibility, whereas with the same small training size, the deterministic NN cannot yield a reasonable estimation and does not provide confidence information. The proposed Bayesian method is computationally efficient and flexible, capable of integration with diverse network variants such as convolutional NNs and recurrent NNs to advance the application of DL in Earth sciences.

Lu, Dan↗