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DOE OSTI2022

Scalable Predictive Control and Optimization for Grid Integration of Large-Scale Distributed Energy Resources

Integrating a large number of distributed energy resources (DERs) into the power grid needs a scalable power balancing method. We formulate the power balancing problem as a look-ahead optimization problem to be solved sequentially by a power distribution system aggregator based on a model predictive control (MPC) framework. Solving large-scale look-ahead control problems requires proper configuration of the control steps. In this paper, to solve large-scale control problems, we propose a variable time granularity where control time steps nearby the current control step have finer resolutions. The aggregator objective includes maximization of power production revenue and minimization of power purchasing expense, renewable power curtailment, and mileage costs for energy storage and electric vehicle (EV) charging stations while satisfying system capacity and operational constraints. The control problem is formulated as a mixed-integer linear program (MILP) and solved using the XpressMP solver. We perform simulations considering a copper plate representation of a large distribution network consisting of 2507 devices (control-lable DERs), including curtailable photovoltaics (PVs), energy storage batteries, EV charging stations, and buildings with heating, ventilation, and air conditioning units (HVACs). We show the effectiveness of the proposed approach in managing DERs interactively for maximum energy trading profit and local supply-demand power balancing. Finally, we demonstrate that the proposed method outperforms other benchmark controllers regarding computation time without compromising operational performance.

DER↗

DOE OSTI2022

Virtual Infrastructure Twins: Software Testing Platforms for Computing-Instrument Ecosystems

Science ecosystems are being built by federating computing systems and instruments located at geographically distributed sites over wide-area networks. These computing-instrument ecosystems are expected to support complex workflows that incorporate remote, automated AI-driven science experiments. Their realization, however, requires various designs to be explored and software components to be developed, in order to support the orchestration of distributed computations and experiments. It is often too expensive, infeasible, or disruptive for the entire ecosystem to be available during the typically long software development and testing periods. We propose a Virtual Infrastructure Twin (VIT) of the ecosystem that emulates its network and computing components, and incorporates its instrument software simulators. It provides a software environment nearly identical to the ecosystem to support early development and testing, and design space exploration. We present a brief overview of previous digital infrastructure twins that culminated in the VIT concept, including (i) the virtual science network environment for developing software-defined networking solutions, and (ii) the virtual federated science instrument environment for testing the federation software stack and remote instrument control software. We briefly describe VITs for Nion microscope steering and access to GPU systems.

Rao, Nageswara↗

DOE OSTI2023

Virtual Infrastructure Twins: Software Testing Platforms for Computing-Instrument Ecosystems

Rao, Nageswara↗

DOE OSTI2023

A parallel p ‐adaptive discontinuous Galerkin method for the Euler equations with dynamic load‐balancing on tetrahedral grids

Abstract A novel p ‐adaptive discontinuous Galerkin (DG) method has been developed to solve the Euler equations on three‐dimensional tetrahedral grids. Hierarchical orthogonal basis functions are adopted for the DG spatial discretization while a third order TVD Runge‐Kutta method is used for the time integration. A vertex‐based limiter is applied to the numerical solution in order to eliminate oscillations in the high order method. An error indicator constructed from the solution of order and is used to adapt degrees of freedom in each computational element, which remarkably reduces the computational cost while still maintaining an accurate solution. The developed method is implemented with under the Charm++ parallel computing framework. Charm++ is a parallel computing framework that includes various load‐balancing strategies. Implementing the numerical solver under Charm++ system provides us with access to a suite of dynamic load balancing strategies. This can be efficiently used to alleviate the load imbalances created by p ‐adaptation. A number of numerical experiments are performed to demonstrate both the numerical accuracy and parallel performance of the developed p ‐adaptive DG method. It is observed that the unbalanced load distribution caused by the parallel p ‐adaptive DG method can be alleviated by the dynamic load balancing from Charm++ system. Due to this, high performance gain can be achieved. For the testcases studied in the current work, the parallel performance gain ranged from 1.5× to 3.7×. Therefore, the developed p ‐adaptive DG method can significantly reduce the total simulation time in comparison to the standard DG method without p ‐adaptation.

97 MATHEMATICS AND COMPUTING↗

DOE OSTI2019

ADP-Based Home Energy Management System: A Case Study Using Dynamo: Preprint

This paper explores Home Energy Management System (HEMS) algorithms to minimize household cost while maintaining comfort when faced with uncertain weather, and demand. Specifically, we consider a HEMS that optimizes forward looking schedules for a home's heating, ventilation, and air conditioning (HVAC); water heater (WH); and electric vehicle (EV) charging while considering uncertainty in outside temperature, hot water usage, and non-controllable load (NCL). We adopt a Dynamic Programming (DP) formulation and utilize the Dynamic programming for Adaptive Modeling and Optimization (DYNAMO) toolkit to implement DP and approximate dynamic programming (ADP) algorithms. Simulation results under a single tariff plan compare the quality of the solution generated by ADP to that of DP, and show significant improvement in computation time while maintaining acceptable solution accuracy.

24 POWER TRANSMISSION AND DISTRIBUTION↗

DOE OSTI2020

Perturbation-Based Diagnosis of False Data Injection Attack Using Distributed Energy Resources

Modern smart grid relies on various sensor measurements for its operational control. In a successful false data injection attack, the attacker manipulates the measurements from the grid sensors such that undetected errors are introduced into the estimates of the system parameters leading to catastrophic situations. This paper proposes a novel perturbation based false data injection attack detection mechanism that utilizes inverter based distributed energy resources (DERs) to create low magnitude perturbation signal in the distribution system voltage that is inconsequential to the normal grid operation. Two voltage sensitivity analysis based algorithms are designed to identify the optimal set of DERs that can create the voltage perturbation signal of desired magnitude. An analytical method of voltage sensitivity analysis is used to compute the magnitude of voltage perturbation signal at each node in a computationally efficient manner. Then, a detection mechanism is developed that checks for the presence of the perturbation sequence in each sensor measurement. A sensor measurement is deemed authentic if the voltage perturbation signal is present in the data. In case of sensor malfunction or cyber-attack, the perturbation signal will not be present in the measurement data. Performance of the proposed attack detection mechanism is validated via simulation of the IEEE 69 bus test system.

24 POWER TRANSMISSION AND DISTRIBUTION↗

DOE OSTI2019

Nonlocal Flocking Dynamics: Learning the Fractional Order of PDEs from Particle Simulations

Flocking refers to collective behavior of a large number of interacting entities, where the interactions between discrete individuals produce collective motion on the large scale. We employ an agent-based model to describe the microscopic dynamics of each individual in a flock, and use a fractional partial differential equation (fPDE) to model the evolution of macroscopic quantities of interest. The macroscopic models with phenomenological interaction functions are derived by applying the continuum hypothesis to the microscopic model. Instead of specifying the fPDEs with an ad hoc fractional order for nonlocal flocking dynamics, we learn the effective nonlocal influence function in fPDEs directly from particle trajectories generated by the agent-based simulations. We demonstrate how the learning framework is used to connect the discrete agent-based model to the continuum fPDEs in one- and two-dimensional nonlocal flocking dynamics. In particular, a Cucker–Smale particle model is employed to describe the microscale dynamics of each individual, while Euler equations with nonlocal interaction terms are used to compute the evolution of macroscale quantities. The trajectories generated by the particle simulations mimic the field data of tracking logs that can be obtained experimentally. They can be used to learn the fractional order of the influence function using a Gaussian process regression model implemented with the Bayesian optimization. We show in one- and two-dimensional benchmarks that the numerical solution of the learned Euler equations solved by the finite volume scheme can yield correct density distributions consistent with the collective behavior of the agent-based system solved by the particle method. Furthermore, the proposed method offers new insights into how to scale the discrete agent-based models to the continuum-based PDE models, and could serve as a paradigm on extracting effective governing equations for nonlocal flocking dynamics directly from particle trajectories.

97 MATHEMATICS AND COMPUTING↗

DOE OSTI2020

Model-Free Dynamic Voltage Control of Distributed Energy Resource (DER)-Based Microgrids

In this paper, we present a new control technique for sustaining dynamic voltage stability by effective reactive power control and coordination of distributed energy resources (DERs) in microgrids. The proposed control technique is based on model-free control (MFC), which has shown successful operation and improved performance in different domains and applications. This paper presents its first use in the voltage stability of a microgrid setting employing multiple synchronous generator (SG)-based and power electronic (PE)-based DERs. MFC is a computationally efficient, data-driven control technique that does not require modelling of the different components and disturbances in the power system. It is utilized as an online controller to achieve the dynamic voltage stability of a microgrid system under different disturbances and fault conditions. A 21-bus microgrid system fed by multiple DERs is considered as a case study and the overall dynamic voltage stability is investigated using time-domain dynamic simulations. Numerical results show that the proposed MFC provides improvements on the dynamic load bus voltage profiles and requires less computational time as compared to the traditional enhanced microgrid voltage stabilizer (EMGVS) scheme. Due to its simplicity and low computational requirement, MFC can be easily implemented in resource-constrained computing devices such as smart inverters.

24 POWER TRANSMISSION AND DISTRIBUTION↗

NASA NTRS2005

VERSE - Virtual Equivalent Real-time Simulation

Distributed real-time simulations provide important timing validation and hardware in the- loop results for the spacecraft flight software development cycle. Occasionally, the need for higher fidelity modeling and more comprehensive debugging capabilities - combined with a limited amount of computational resources - calls for a non real-time simulation environment that mimics the real-time environment. By creating a non real-time environment that accommodates simulations and flight software designed for a multi-CPU real-time system, we can save development time, cut mission costs, and reduce the likelihood of errors. This paper presents such a solution: Virtual Equivalent Real-time Simulation Environment (VERSE). VERSE turns the real-time operating system RTAI (Real-time Application Interface) into an event driven simulator that runs in virtual real time. Designed to keep the original RTAI architecture as intact as possible, and therefore inheriting RTAI's many capabilities, VERSE was implemented with remarkably little change to the RTAI source code. This small footprint together with use of the same API allows users to easily run the same application in both real-time and virtual time environments. VERSE has been used to build a workstation testbed for NASA's Space Interferometry Mission (SIM PlanetQuest) instrument flight software. With its flexible simulation controls and inexpensive setup and replication costs, VERSE will become an invaluable tool in future mission development.

virtual real time↗

NASA NTRSDate not supplied

Distributed Sensing and Computer Vision Methods for Advanced Air Mobility Approach and Landing

Advanced Air Mobility (AAM) aircraft require precision approach and landing systems (PALS) in several types of environments such as urban, suburban, and rural. It is difficult to implement current state-of-the-art methods approved for automated approach and landing for AAM operations. However, existing technology and systems that use vision, IR, radar, and GPS methods provide baseline perception and sensing requirements for AAM aircraft approach and landing. This paper focuses on vision-based PAL and computer vision feature correspondence methods to demonstrate a baseline navigation system while adhering to the Federal Aviation Administration requirements and regulations. The coplanar algorithm determines pose estimation, which feeds into an Extended Kalman filter that combines IMU with vision to create a sensor fusion navigation solution for GPS-denied environments. The state estimate leads to glideslope and localizer error computations, which will be pertinent for designing and deriving guidance laws and control laws for AAM PALS. The IMU and vision navigation solution provides promising simulation results for AAM PALS. This paper builds on previous work by incorporating high fidelity simulations with computer graphics rendering to demonstrate a distributed sensor network to track an AAM aircraft during approach and landing to compare with the aircraft's onboard navigation solution.

Evan Kawamura↗

DOE OSTI2019

Sparse, iterative simulation methods for one-dimensional laminar flames

Sparse, iterative simulation methods for one-dimensional laminar flames are proposed. The resulting steady and unsteady flame solvers exploit approximate Jacobians to greatly reduce the computational cost associated with matrix operations. The constant, non-unity Lewis number assumption is introduced to further reduce the computational cost. The solvers are also parallelized to reduce time-to-solution on distributed memory computer systems. Computed laminar flame speeds and species profiles for a range of chemical mechanisms (from 10 to 2878 species) are compared against a well-validated commercial code and are found to be consistent within solver tolerances. The computation times of both the unsteady and steady solutions increase only linearly with the number of species, which is a significant improvement over the quadratic or cubic scaling of existing steady-state flame solvers. For the largest mechanism tested, the steady-state flame solver is two orders of magnitude faster than commonly-used codes. The use of an approximate Jacobian is shown to reduce the rate of convergence for the steady-state solver, but does not significantly affect the domain of convergence. The steady-state solver with approximate Jacobian is thus well suited for computationally efficient laminar flame speed sweeps with large kinetic mechanisms.

42 ENGINEERING↗

DOE OSTI2021

RAPID

Parallel computer code for the simulator for dynamics of power systems which has the capability to initiate the system and create different faults for the dynamic analysis. The code is based on time-parallel method (Parareal) with Adaptive Method Reduction (AMR). The coarse solvers for the Parareal algorithm include several Semi Analytical Solution methods. Also, Integrated simulation of coupled transmission and distribution systems can be studied.

Simunovic, Srdjan [Oak Ridge National Lab. (ORNL),↗

NASA NTRS1990

NASA-UCLA Workshop on Computational Techniques in Identification and Control of Flexible Flight Structures, Lake Arrowhead, CA, Nov. 2-4, 1989, Proceedings

The present conference on the identification and control of flexible flight structures with computational techniques encompasses existing and planned testbeds, modeling techniques, adaptive control, and numerical computation and simulation. Specific issues addressed include the NASA/MFSC ground test facility, an active control test on the NASA Minimast, the Astrex testbed for large precision space structures, the dynamic analysis of truss-beam modeling, combined structure-controls-integrated optimization, distributed parameter modeling applicable to the control of flexible flight structures, and approaches to nonclassically damped dynamic systems. Also addressed are adaptive control concepts, techniques for vibration and decentralized slew maneuver control, the discretization of second-order-in-time differential equations which are applicable to nonlinear wave problems, the finite-dimensional approximations of Riccati equations, and numerical simulations of actively controlled space structures.

Balakrishnan, A. V.↗

DOE OSTI2026

Neural operator transformers capture bifurcating drift-wave turbulence in fusion plasma simulations

Self-consistent modeling of turbulence-driven transport is critical for optimizing confinement in magnetically confined fusion plasmas, such as tokamaks and stellarators. In particular, capturing the long-term co-evolution of turbulence, flow, and background plasma profiles remains computationally challenging. Direct numerical simulation of these multiscale, highly nonlinear processes is often demanding and impractical for real-time control or design optimization. To address this bottleneck, we investigate transformer-based neural operator partial differential equation surrogates for emulating the dynamics of drift-wave turbulence bifurcation mediated by zonal flows, using the modified Hasegawa–Wakatani (MHW) model as a prototypical system. We find that the finetuned neural operator model has excellent performance in capturing the multi-spatiotemporal-scales of MHW turbulence bifurcation and is robust to testing on rare and out-of-distribution dynamics. Specifically, we demonstrate that a single unified model accurately predicts both quasi-steady-state turbulence and a wide range of dynamical transition processes, such as nonlinear saturation, spontaneous suppression of turbulence, and the emergence of macroscopic zonal flows, over time horizons vastly exceeding the local turbulence correlation time. This computationally efficient approach establishes a strong foundation for fast, AI-based modeling of complex, multiscale phenomena in magnetized fusion plasmas.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

DOE OSTI2022

Multiscale simulation of integrated energy system and electricity market interactions

Accelerating the deep decarbonization of the world's electric grids requires the coordination of complex energy systems and infrastructures across timescales from seconds to decades. Here, we present a new multiscale simulation framework that integrates process- and grid-centric modeling paradigms to better design, operate, and control integrated energy systems (IESs), which combine multiple technologies, in wholesale energy markets. Traditionally, IESs are analyzed with a process-centric paradigm such as levelized cost of electricity (LCOE) or annualized net revenue, ignoring important interactions with electricity markets. This framework explicitly models the complex interactions between an IES's bidding, scheduling, and control decisions and the energy market's clearing and settlement processes, while incorporating operational uncertainties. Through two case studies, we show the importance of understanding and quantifying complex resource-grid interactions. In case study 1, we demonstrate that optimized bidding from one resource shifts the profit distribution for all energy systems in the market. This result suggests new and more flexible IES technologies can disrupt the economics of all market participants, possibly leading to accelerated retirements of less flexible resources. Interestingly, the optimized bidding has little impact on grid-level aggregate statistics, such as total generation costs and renewable penetration rate. While aggregate modeling strategies may remain valid under some IES adoption scenarios for analysis focused on regional outcomes, direct comparisons of IES technologies at specific locations without considering these interactions may lead to misleading or incorrect conclusions. In case study 2, we consider the design and flexible operation of IESs that hybridize conventional generators with energy storage. Through a sensitivity analysis, we find that as the size of the storage system increases, the total number of start-ups for coal- and natural gas-based IESs reduced by 25% and 33.6%, and the total thermal generator ramping (i.e., mileage) reduced by 86.5% and 62.5%, respectively. This shows the primary benefit of storage may not be reduced operational costs (which do not change significantly) but fewer start-ups and less ramping, which may greatly simplify the design, operation, and control of carbon capture systems. The new modeling and optimization capabilities from this work enable the coupling of rigorous, dynamic process models with grid-level production cost models to quantitatively identify the nuanced interdependencies across these vast timescales that must be addressed to realize clean, safe, and secure energy production. Moreover, the proposed general multiscale simulation framework is applicable to all IES technologies and can be easily extended to consider other energy carriers (e.g., hydrogen, ammonia) and energy infrastructures (e.g., natural gas pipelines).

24 POWER TRANSMISSION AND DISTRIBUTION↗

DOE OSTI2019

Reconfigurable and Dynamic Distribution Systems Enabled Using Self-Sustainable Minimal-Microgrids with Region Based Stability Guarantees

In this paper, a reconfigurable and dynamic distribution system is designed using self-sustainable minimal-microgrids (min-MGs). Particularly, multiple dynamic microgrids are implemented by aggregating local min-MGs in a controllable way to facilitate service restoration at critical grid infrastructures, especially during severe power outages (e.g., those induced by natural disasters). These dynamic microgrids are implemented surrounding inverter interfaced distributed energy resources (DERs) to pick up local critical loads. Stable transient process during neighboring microgrid disconnection and resynchronization is realized by involving additional control terms in the secondary control level. Meanwhile, in order to ensure a stable operation with dynamic topology change, a computationally efficient region-based stability assessment approach is developed to ensure stability guarantees of each inverter dominated min-MG with potential changes of external grids modeled as disturbances. In contrast to conventional point-by-point stability evaluation approaches, the proposed region-based stability analysis can intuitively exhibit the feasible region comprised of stable operating points and identify sufficient stability margin to tolerate disturbances of dynamic system topology variations. Theoretical analysis is verified using simulation in MATLAB/Simulink.

distribution systems↗

DOE OSTI2022

ReNew100: Reliable Power System Operation with 100% Renewable Generation

The ReNew100 project has developed and demonstrated an operator support system (OSS) to operate power systems with 100% renewable power generation from inverter-based resources (IBRs) like wind and solar that significantly reduces the risk of widespread power outages in a simulated operational environment at Technology Readiness Level (TRL) 6. The OSS achieves resilient operation for power systems under changing operation modes including varying combinations of conventional and renewable generation, including cases with 100% renewable generation from wind and solar IBRs. The OSS continuously monitors the N-1 security of the power system, which refers to the ability of the power systems to survive single outages of power system elements, like the loss of a generator or a power line, without causing widespread power outages beyond those expected and planned for. If the OSS identifies that the system is not N-1 secure, an automatic Controller Parameter Optimization (CoPO) developed within Renew100 is activated to optimize the N-1 security of the system by tuning controller parameters within different assets like batteries, wind, and solar plants. The core innovation of ReNew100 is the development of this CoPO as well as the demonstration of the OSS for a real-time simulation of the Hawai'i Island power system. Moreover, Renew100 has developed new model calibration techniques for dynamic power system models and demonstrated them for Hawai'i Island.

24 POWER TRANSMISSION AND DISTRIBUTION↗

DOE OSTI2024

Scaling Ensembles of Data-Intensive Quantum Chemical Calculations for Millions of Molecules

Deep learning models are efficient computational tools that can accelerate the inverse design of molecules with desired functional properties by generating predictions at a fraction of the time required by traditional quantum chemical approaches. To ensure that a model maintains accuracy and transferability across broad regions of the chemical space explored during the inverse design, it must be trained on massively large volumes of simulation data. This requires running large-scale ensemble quantum chemical calculations on high-performance computing (HPC) systems for data collection. However, the efficient execution of such large ensemble calculations and the management of large volumes of output data require tools that can judiciously utilize computational resources and manage metadata overhead on the file system. Therefore, we present a high-performance, scalable, ensemble management framework for performing data-intensive quantum chemical electronic structure calculations for organic molecules. This framework provides abstractions to plug different ab initio, first principles, and first principles-based semi-empirical methods and executes them efficiently at large scale on HPC systems. It dynamically distributes tasks to resources and uses tiered storage for managing large collections of files. We employed this framework to process over ten million organic molecules and generate open-source datasets that provide UV-vis absorption spectra by running time-dependent density-functional tight-binding calculations. It is the largest database containing molecular optical spectra that were simulated with quantum chemical methods in a consistent manner.

Mehta, Kshitij↗