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At least 1,009 records · Page 56

Direct numerical simulations of turbulent reacting flows with shock waves and stiff chemistry using many-core/GPU acceleration

Compressible reacting flows may display sharp spatial variation related to shocks, contact discontinuities or reactive zones embedded within relatively smooth regions. The presence of such phenomena emphasizes the relevance of shock-capturing schemes such as the weighted essentially non-oscillatory (WENO) scheme as an essential ingredient of the numerical solver. However, these schemes are complex and have more computational cost than the simple high-order compact or non-compact schemes. In this paper, we present the implementation of a seventh-order, minimally-dissipative mapped WENO (WENO7M) scheme in a newly developed direct numerical simulation (DNS) code called KAUST Adaptive Reactive Flows Solver (KARFS). In order to make efficient use of the computer resources and reduce the solution time, without compromising the resolution requirement, the WENO routines are accelerated via graphics processing unit (GPU) computation. The performance characteristics and scalability of the code are studied using different grid sizes and block decomposition. Furthermore, the performance portability of KARFS is demonstrated on a variety of architectures including NVIDIA Tesla P100 GPUs and NVIDIA Kepler K20X GPUs. In addition, the capability and potential of the newly implemented WENO7M scheme in KARFS to perform DNS of compressible flows is also demonstrated with model problems involving shocks, isotropic turbulence, detonations and flame propagation into a stratified mixture with complex chemical kinetics.

97 MATHEMATICS AND COMPUTING↗

Integrated Multi-Scale Data Analytics and Machine Learning for the Distribution Grid and Building-to-Grid Interface

This white paper introduces the application of advanced data analytics to the modernized grid. In particular, we consider the field of machine learning and where it is both useful, and not useful, for the particular field of the distribution grid and buildings interface. While analytics, in general, is a growing field of interest, and often seen as the golden goose in the burgeoning distribution grid industry, its application is often limited by communications infrastructure, or lack of a focused technical application. Overall, the linkage of analytics to purposeful application in the grid space has been limited. In this paper we consider the field of machine learning as a subset of analytical techniques, and discuss its ability and limitations to enable the future distribution grid and the building-to-grid interface. To that end, we also consider the potential for mixing distributed and centralized analytics and the pros and cons of these approaches. Machine learning is a subfield of computer science that studies and constructs algorithms that can learn from data and make predictions and improve forecasts. Incorporation of machine learning in grid monitoring and analysis tools may have the potential to solve data and operational challenges that result from increasing penetration of distributed and behind-the-meter energy resources. There is an exponentially expanding volume of measured data being generated on the distribution grid, which, with appropriate application of analytics, may be transformed into intelligible, actionable information that can be provided to the right actors – such as grid and building operators, at the appropriate time to enhance grid or building resilience, efficiency, and operations against various metrics or goals – such as total carbon reduction or other economic benefit to customers. While some basic analysis into these data streams can provide a wealth of information, computational and human boundaries on performing the analysis are becoming significant, with more data and multi-objective concerns. Efficient applications of analysis and the machine learning field are being considered in the loop.

24 POWER TRANSMISSION AND DISTRIBUTION↗

A multifidelity method for a nonlocal diffusion model

Nonlocal models feature a finite length scale, referred to as the horizon, such that points separated by a distance smaller than the horizon interact with each other. Such models have proven to be useful in a variety of settings. However, due to the reduced sparsity of discretizations, they are also generally computationally more expensive compared to their local differential equation counterparts. In this work, we introduce a multifidelity Monte Carlo method that combines the high-fidelity nonlocal model of interest with surrogate models that use coarser grids and/or smaller horizons and thus have lower fidelities and lower costs. Using the multifidelity method, the overall computational cost of uncertainty quantification is reduced without compromising accuracy. It is shown for a one-dimensional nonlocal diffusion example that speedups of up to two orders of magnitude can be achieved using the multifidelity method to estimate the expectation of an output of interest.

97 MATHEMATICS AND COMPUTING↗

Data–Driven Velocity Model Evaluation Using K–Means Clustering

In this work, we develop a data-driven clustering method to evaluate a velocity model using surface wave velocity dispersion. This is done by first computing theoretical dispersion curves for 1-D velocity profiles of all the grid locations and then splitting the resulting dispersion curves into a certain number of groups via the K-means clustering. The observed dispersion curves are also clustered following the same procedure and the velocity model is assessed by comparing the spatial patterns obtained for the observed and synthetic data sets. The method is applied to evaluate two community velocity models in southern California, CVM-S4.26 and CVM-H15.1, using phase velocity maps derived for 3–16 s Rayleigh waves. We found a good correlation in the spatial distribution of clusters between the result of CVM-S4.26 and that of the observed data, suggesting that the CVM-S4.26 fits the observed dispersion maps better than the CVM-H15.1 in terms of features extracted from the clustering analysis.

58 GEOSCIENCES↗

Market optimization and technoeconomic analysis of hydrogen-electricity coproduction systems

Decarbonization efforts across North America, Europe, and beyond rely on variable renewable energy sources such as wind and solar, as well as alternative fuels, such as hydrogen, to support the sustainable energy transition. These advancements have prompted a need for more flexibility in the electric grid to complement non-dispatchable energy sources and increased demand from electrification. Integrated energy systems are well suited to provide this flexibility, but conventional technoeconomic modeling paradigms neglect the time-varying dynamic nature of the grid and thus undervalue resource flexibility. In this work, we develop a computational optimization framework for dynamic market-based technoeconomic comparison of integrated energy systems that coproduce low-carbon electricity and hydrogen (e.g., solid oxide fuel cells, solid oxide electrolysis) against technologies that only produce electricity (e.g., natural gas combined cycle with carbon capture) or only produce hydrogen. Our framework starts with rigorous physics-based process models, built in the open-source Institute for the Design of Advanced Energy Systems (IDAES) modeling and optimization platform, for six energy process concepts. Using these rigorous models and a workflow to optimally design each technology, the framework is shown to be capable of evaluating new and emerging technologies in varying energy markets under a plethora of future scenarios (i.e., renewables penetration, carbon tax, etc.). Ultimately, our framework finds that solid oxide fuel cell-based coproduction systems achieve positive profits for 85% of the analyzed market scenarios. From these market optimization results, we use multivariate linear regression (R 2 values up to 0.99) to determine which electricity price statistics are most significant to predict the optimized annual profit of each system. The proposed framework provides a powerful tool for directly comparing flexible, multi-product energy process concepts to help discern optimal technology and integration options.

08 HYDROGEN↗

Inferring adversarial behaviour in cyber‐physical power systems using a Bayesian attack graph approach

Abstract Highly connected smart power systems are subject to increasing vulnerabilities and adversarial threats. Defenders need to proactively identify and defend new high‐risk access paths of cyber intruders that target grid resilience. However, cyber‐physical risk analysis and defense in power systems often requires making assumptions on adversary behaviour, and these assumptions can be wrong. Thus, this work examines the problem of inferring adversary behaviour in power systems to improve risk‐based defense and detection. To achieve this, a Bayesian approach for inference of the Cyber‐Adversarial Power System (Bayes‐CAPS) is proposed that uses Bayesian networks (BNs) to define and solve the inference problem of adversarial movement in the grid infrastructure towards targets of physical impact. Specifically, BNs are used to compute conditional probabilities to queries, such as the probability of observing an event given a set of alerts. Bayes‐CAPS builds initial Bayesian attack graphs for realistic power system cyber‐physical models. These models are adaptable using collected data from the system under study. Then, Bayes‐CAPS computes the posterior probabilities of the occurrence of a security breach event in power systems. Experiments are conducted that evaluate algorithms based on time complexity, accuracy and impact of evidence for different scales and densities of network. The performance is evaluated and compared for five realistic cyber‐physical power system models of increasing size and complexities ranging from 8 to 300 substations based on computation and accuracy impacts.

Sahu, Abhijeet↗

Actinide opacities for modelling the spectra and light curves of kilonovae

ABSTRACT We extend previous ab initio calculations of lanthanide opacities to include a complete set of actinide opacities for use in the modelling of kilonova (KN) light curves and spectra. Detailed, fine-structure line features are generated using the configuration-interaction approach. These actinide opacities display similar trends to those observed for lanthanide opacities, such as the lighter actinides producing higher opacity than the heavier ones for relevant conditions in the dynamical ejecta. A line-binned treatment is employed to pre-compute opacity tables for 14 actinide elements (89 ≤ Z ≤ 102) over a grid of relevant temperatures and densities. These tabular opacities will be made publicly available for general usage in KN modelling. We demonstrate the usefulness of these opacities in KN simulations by exploring the sensitivity of light curves and spectra to different actinide abundance distributions that are predicted by different nuclear theories, as well as to different choices of ejecta mass and velocity. We find very little sensitivity to the two considered distributions, indicating that opacities for actinides with Z ≥ 99 do not contribute strongly. On the other hand, a single actinide element, protactinium, is found to produce faint spectral features in the far-infrared at late times (5–7 d post merger). More generally, we find that the choice of ejecta mass and velocity have the most significant effect on KN emission for this study.

79 ASTRONOMY AND ASTROPHYSICS↗

Big Data Analytic for Cascading Failure Analysis

With the challenges of increased grid dynamics and more variability of power generation from renewable energy sources, rapidly increasing complexity in the grid model, and abundant data from measurements and simulations, the requirements for computational analysis have also increased dramatically. Power system operators and engineers need to analyze more scenarios, extract meaningful information from a larger set of data, and respond more quickly when faced with these new challenges for large-scale applications, such as contingency analysis. This paper proposes a novel big data analysis approach for power system cascading analysis, prevention, and remediation. The developed techniques will be capable of cascading analysis, better assessment of the system’s vulnerability level, as well as proposing potential remediation. Case studies using IEEE 118-bus system and a 500-bus system, with a comparison against a commercial tool, validate the advantages of the developed big data approach: accurate prediction, and more importantly, faster and effective correction actions.The developed techniques could be further used for other power system applications.

big data, cascading analysis, corrective action, m↗

Oineus v1.0

A library for multi-threaded computation of persistence diagrams. The algorithm for computing persistence diagrams in a lock-free manner was published in the 'Towards Lock-free Persistent Homology' (D. Morozov, A. Nigmetov, Brief Announcement: SPAA 2020); it scales better than the only other shared-memory parallel implementation of persistent homology computation PHAT. Library includes python bindings to compute persistence diagrams and their vectorizations for lower-star filtrations on grid data. It is intended to be used by scientists working on Topological Data Analysis and its applications in different areas.

Nigmetov, Arnur↗

Collaborative Project: High-resolution Global Modeling of the Effects of Subgrid-Scale Clouds and Turbulence on Precipitating Cloud Systems

We proposed to implement, test, and evaluate recently developed turbulence parameterizations, using a wide variety of methods and modeling frameworks together with observations including ARM data. We have successfully tested three different turbulence parameterizations in versions of the Community Atmosphere Model: CLUBB, SHOC, and IPHOC. All three produce significant improvements in the simulated climate. CLUBB will be used in CAM6, and also in ACME. SHOC is being tested in the NCEP forecast model. In addition, we have achieved a better understanding of the strengths and limitations of the PDF-based parameterizations of turbulence and convection.

54 ENVIRONMENTAL SCIENCES↗

VOLTTRON™: Tech-to-Market Best-Practices Guide for Small- and Medium-Sized Commercial Buildings

VOLTTRON™ is an open-source distributed control and sensing platform developed by Pacific Northwest National Laboratory for the U.S. Department of Energy. It was developed to be used by the Office of Energy Efficiency and Renewable Energy to support transactive controls research and deployment activities. VOLTTRON is designed to be an overarching integration platform that could be used to bring together vendors, users, and developers and enable rapid application development and testing. The platform is designed to support modern control strategies, including the use of agent- and transaction-based controls. It also is designed to support the management of a wide range of applications, including heating, ventilation, and air-conditioning systems; electric vehicles; and distributed-energy and whole-building loads. This report was completed as part of the Building Technologies Office’s Technology-to-Market Initiative for VOLTTRON’s Market Validation and Business Case Development efforts. The report provides technology-to-market guidance and best practices related to VOLTTRON platform deployments and commercialization activities for use by entities serving small- and medium-sized commercial buildings. The report characterizes the platform ecosystem within the small- and medium-sized commercial building market and articulates the value proposition of VOLTTRON for three core participants in this ecosystem: 1) platform owners/adopters, 2) app developers, and 3) end-users. The report also identifies key market drivers and opportunities for open platform deployments in the small- and medium-sized commercial building market. Possible pathways to the market are described—laboratory testing to market adoption to commercialization. We also identify and address various technical and market barriers that could hinder deployment of VOLTTRON. Finally, we provide “best practice” tech-to-market guidance for building energy-related deployment efforts serving small- and medium-sized commercial buildings.

97 MATHEMATICS AND COMPUTING↗

Final Report - Subcontract B6183769

During my visit to LLNL during July 5{15, 2016, we worked on linear system solvers. The two level hierarchical solver that initiated our study was developed to solve linear system arising from hp adaptive finite element calculations, and is implemented in the PLTMG software package, version 12 [1]. This preconditioner typically requires 3-20% of the space used by the stiffness matrix for higher order elements. It has multigrid like convergence rates for a wide variety of PDEs (self-adjoint positive definite elliptic equations, convection dominated convection-diffusion equations, and highly inde nite Helmholtz equations, among others). The convergence rate is not independent of the polynomial degree p as p ! 1, but but remains strong for p 9, which is the highest polynomial degree allowed in PLTMG, due to limitations of numerical quadrature formulae. A more complete description of the method and some numerical experiments illustrating its effectiveness appear in [2]. Like traditional geometric multilevel methods, this scheme relies on extensive knowledge of the underlying finite element space in order to construct both the smoother and the coarse grid correction components.

97 MATHEMATICS AND COMPUTING↗

Subcontract B635525 (Final Report)

During my visits to LLNL July 8–12 and July 22–26, 2019, I worked on linear system solvers. The two level hierarchical solver that initiated our study was developed to solve linear systems arising from $\textit{hp}$ adaptive finite element calculations, and is implemented in the $\textit{PLTMG}$ software package, version 13. This preconditioner typically requires 3–20% of the space used by the stiffness matrix for higher order elements. It has multigrid like convergence rates for a wide variety of PDEs (self-adjoint positive definite elliptic equations, convection dominated convection-diffusion equations, and highly indefinite Helmholtz equations, among others). The convergence rate is not independent of the polynomial degree $\textit{p}$ as $\textit{p} → ∞$, but remains strong for $\textit{p}$ ≤ 9, which is the highest polynomial degree allowed in $\textit{PLTMG}$, due to limitations of the numerical quadrature rules implemented in the soft- ware package. A more complete description of the method and some numerical experiments illustrating its effectiveness appear in. Like traditional geometric multilevel methods, this scheme relies on knowledge of the underlying finite element space in order to construct the smoother and the coarse grid correction.

97 MATHEMATICS AND COMPUTING↗

Cambium Documentation: Version 2020

This is the documentation for the 2020 version of Cambium. Cambium is a tool that assembles structured data sets of simulated hourly cost and operational data for modeled futures of the U.S. electric sector with metrics designed to be useful for long-term decision-making. In this documentation, we define the metrics reported in Cambium databases and document the Cambium-specific methods for calculating those metrics.

24 POWER TRANSMISSION AND DISTRIBUTION↗

Cybersecurity in Photovoltaic Plant Operations

This paper provides practical information for PV plant operators regarding cybersecurity. Plans to integrate photovoltaic generation into utility systems requires that cybersecurity be considered in every aspect- from customer data to business information to plant monitoring and control operations. This paper describes the types of threats encountered in operation of PV plants; challenges faced by photovoltaic plant operators in implementing cybersecurity; cybersecurity standards that apply to photovoltaic plant operations; cybersecurity response plans and recommended best practices to ensure photovoltaic plant cybersecurity.

14 SOLAR ENERGY↗

GridAPPS-D™ at Three: Milestones on the Road to Advanced Distribution Functionality

Since the project’s inception in 2016, the GridAPPS-D team at PNNL has worked closely with its partners in industry and academia—as well as its advisory board of leading utilities—to develop the platform and the supporting resources. Here are some of the milestones, highlights, and achievements during the first three years of the project that set the stage to mature the platform and establish a robust GridAPPS-D ecosystem to realize and share the benefits more broadly among utilities.

24 POWER TRANSMISSION AND DISTRIBUTION↗