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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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At least 991 records · Page 55

Kinetic Isotope Effects: Interpretation and Prediction Using Degrees of Rate Control

Kinetic isotope effects (KIEs) have been used for decades in catalysis research as a tool for clarifying reaction mechanisms. Significant primary kinetic isotope effects have usually been interpreted as being a result of isotope substitution at a site of bond breaking (or forming) in the rate-determining step in the reaction mechanism. However, quantitative analysis of the magnitude of the KIE in complex multistep reaction mechanisms is seldom reported. We prove here that the logarithm of the rate ratio for two isotopes is the weighted average over all species in the mechanism of their standard-state free energy difference between the two isotopes, divided by RT. The weighting factor is the degree of rate control (DRC) for that species (e.g., transition state, intermediate, reactant) when the rate is measured separately for each isotope. It is instead the degree of selectivity ratio control (DSRC) when the KIE is measured as the product selectivity in a parallel competition between two isotopes within the same reactant molecule. Since only a few species have non-zero DRCs (or DSRCs) for most reactions, only these few contribute to this weighted average and the KIE. We show that this provides a simple way to interpret and quantitatively predict kinetic isotope effects that is powerful in the insights it provides, allowing one to evaluate directly which species contribute most to the KIE. By applying it to H/D KIEs in several example mechanisms, we further show that the traditional way of interpreting KIEs that focuses only on the rate-determining step can easily lead to misunderstanding of KIE and the reaction mechanism. Finally, this highlights the importance to consider the effect of isotope substitution on the energies of all species with large DRCs (i.e, those whose energies are kinetically relevant). This method also offers opportunities for quantitative validation of mechanism-based microkinetic models.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Improving BA Control Performance Through Advanced Regulation Requirements Prediction

The paper presents a comprehensive approach to predict balancing authority (BA) regulation requirements in order to improve BAs control performance. The proposed probabilistic approach takes into account multiple uncertain and time dependent factors affecting the system balance (e.g., wind and solar generation, electrical loads). A set of methods to predict the regulation has been developed: (1) probabilistic analysis of regulation requirements with respect to time of the day, (2) linear or nonlinear regression models linking regulation requirements to different influencing factors, (3) adopting time series forecasting techniques (e.g., autoregressive integrated moving average (ARIMA)) to account for temporal continuity and auto-correlation in the regulation requirements data. Proposed methodology has been tested and validated using actual California Independent System Operator (ISO) data.

Solar Generation, Wind Generation, Area Control Er↗

Simulation of 4D RNAV in the terminal area

A terminal area control concept based on 4D RNAV (3D plus time) has been developed to take full advantage of STOL aircrafts' unique performance capabilities. The 4D RNAV concept involves an airborne system, a ground system and a protocol for information exchange between aircraft and ground. The function of the airborne system is to synthesize the curved three dimensional (3D) flight path, to predict and control the landing time (4D) and to generate flight director or autopilot commands. The airborne system assumes the ground system will specify the 3D path and assign a conflict-free landing time. A real time simulation of this concept has been developed to evaluate its effectiveness for terminal areas control of STOL aicraft. Key elements of the simulation are a computer graphics traffic display, a scheduling display and a keyboard language for issuing controller commands to simulated aircraft. Initial results and planned experiments are described.

Tobias, L.↗

Controls-structures-electromagnetics interaction program

A technology development program is described involving Controls Structures Electromagnetics Interaction (CSEI) for large space structures. The CSEI program was developed as part of the continuing effort following the successful kinematic deployment and RF tests of the 15 meter Hoop/Column antenna. One lesson learned was the importance of making reflector surface adjustment after fabrication and deployment. Given are program objectives, ground based test configuration, Intelsat adaptive feed, reflector shape prediction model, control experiment concepts, master schedule, and Control Of Flexible Structures-II (COFS-II) baseline configuration.

Grantham, William L.↗

The Heuristic Dynamic Programming Approach in Boost Converters

In this study, a heuristic dynamic programming controller is proposed to control a boost converter. Conventional controllers such as proportional-integral-derivative (PID) or proportional-integral (PI) are designed based on the linearized small-signal model near the operating point. Therefore, the performance of the controller during the start-up, the load change, or the input voltage variation is not optimal since the system model changes by varying the operating point. The heuristic dynamic programming controller optimally controls the boost converter by following the approximate dynamic programming. The advantage of the HDP is that the neural network-based characteristic of the proposed controller enables boost converters to easily cope with large disturbances. An HDP with a well-trained critic and action networks can perform as an optimal controller for the boost converter. To compare the effectiveness of the traditional PI-based and the HDP boost converter, the simulation results are provided.

24 POWER TRANSMISSION AND DISTRIBUTION↗

System identification requirements for high-bandwidth rotorcraft flight control system design

The application of system identification methods to high-bandwidth rotorcraft flight control system design is examined. Flight test and modeling requirements are illustrated using flight test data from a BO-105 hingeless rotor helicopter. The proposed approach involves the identification of nonparametric (transfer function and state space) model identification. Results for the BO-105 show the need for including coupled body/rotor flapping and lead-lag dynamics in the identification model structure to allow the accurate prediction of control ssytem bandwidth limitations.

Tischler, Mark B.↗

Progress on Optimizing Wind Farms and Rotor Designs Using Adjoints

Modern wind plants are increasingly tasked with multiple performance objectives. In addition to designing plants that maximize power output and minimize the levelized cost of energy (LCOE), the design and operation of wind plants is increasingly influenced by challenges regarding grid integration of variable generation renewables. This places a growing emphasis on making wind plants more controllable and predictable. WindSE is a Reynolds-averaged Navier-Stokes (RANS) model designed around analytical gradient and adjoint methods, with the ability to capture terrain-induced effects, as shown in Figure 1. The recent addition of an unsteady solver with an actuator line method (ALM) and ongoing work to enable massively parallel optimizations gives it a unique niche to explore coupled plant-level controls and design problems. This code is an open source python package built on the FEniCS framework that utilizes fast, parallel PETSc solvers to model fluid flow throughout wind-farm scale domains. Two recent studies performed using WindSE demonstrate the capability to optimize under a wide variety of flow conditions and objective functions. In the first, we present an optimization focused on modifying the layout of a wind farm with a fixed number of turbines for maximum total power output [1]. This study highlights the ability to quickly perform simulations using the steady Navier-Stokes solver combined with rotors represented as actuator disks while also stressing the importance of capturing terrain-induced effects. Gradient-based optimization using the RANS equations is viable due to the inclusion of efficiently computed adjoint derivatives. We interpret the physical results of the optimal layout and also discuss the computational cost of scaling to larger problems. In the second study, we present the capabilities of the unsteady Navier-Stokes solver, where rotor-blade profiles represented by actuator lines are optimized to enhance wake steering effects and overall power production [2]. We quantify the wind plant performance gains obtained from this type of simultaneous control co-design optimization as compared to optimizing the blade design and yaw independently. Figure 2 shows the differences between a baseline two-turbine system and an optimized system where we fine-tune the blade chord profile. Results and challenges from each study are quickly summarized and used to motivate the current development efforts within WindSE. Current and future work is focused on enabling higher-resolution studies with more degrees of freedom through parallelization of both the simulation and optimization algorithms. We present benchmarking results to show that WindSE performs well in both weak- and strong-scaling tests and further demonstrate that the optimizer obtains the same convergence rates in both shared- and distributed-memory environments. Using larger wind farms, we can study deep-array effects within an optimization context, allowing the use of objective functions that have been previously unstudied. As an example, we present ongoing work on a blockage metric which characterizes the loss of available kinetic energy due to wake effects from multiple upstream turbines.

adjoint optimization↗

Energy Consumption and Cost Reduction of Future Light-Duty Vehicles through Advanced Vehicle Technologies: A Modeling Simulation Study Through 2050

The U.S. Department of Energy’s (DOE’s) Vehicle Technologies Office (VTO) and Hydrogen and Fuel Cell Technologies Office (HFTO) aim to develop sustainable, affordable and efficient technologies for transportation of goods and people. Translating investments in advanced transportation component technologies and powertrains to estimate vehicle-level fuel savings potential is critical for understanding DOE’s impact. In this work, we simulated technologies funded by VTO and HFTO for light duty vehicles. The simulations were performed across: Multiple powertrain configurations (i.e., conventional, power-split, extended-range electric vehicle, battery electric drive, and fuel-cell vehicles), Vehicle classes (i.e., compact car, midsize car, small sport utility vehicle [SUV], midsize SUV, and pickup trucks); and Fuels (i.e., gasoline, diesel, hydrogen, and battery electricity). These various technologies are assessed for six different timeframes: laboratory years 2015, 2020, 2025, 2030, and 2045. A delay of 5 years is assumed between laboratory year and model year (year technology is introduced into production). Finally, uncertainties are included for both technology performance and cost aspects by considering two cases: Low case, aligned with DOE technology manager estimates of expected original equipment manufacturer (OEM) improvements based on regulations, business as usual; and High case, aligned with aggressive technology advancements based on R&D targets developed through support by VTO & HFTO. These scenarios are not intended as predictions of future performances. The energy and cost impact of different technologies were estimated using Autonomie (www.autonomie.net), Argonne vehicle system simulation tool. Autonomie is a state-of-the-art vehicle system simulation tool used to assess the energy consumption, performance and cost of multiple advanced vehicle technologies across classes (from light to heavy duty), powertrains (from conventional to HEVs, FCEVs, PHEVs and BEVs), components and control strategies. Autonomie is packaged with a complete set of vehicle models for a wide range of vehicle classes, powertrain configurations and component technologies, including vehicle level and component level controls. These controls were developed and calibrated using dynamometer test data. Autonomie has been used to support a wide range of studies including analyzing various component technologies, sizing powertrains components for different vehicle requirements, comparing the benefits of powertrain configurations, optimizing both heuristic and route based vehicle energy control and predicting transportation energy use when paired with a traffic modeling tool such as POLARIS. This report documents the assumptions and estimates the vehicle-level energy consumption benefits and associated technology costs for the various types of light duty vehicles. All details of vehicle assumptions and simulation results are available in the spreadsheets accompanying this report.

33 ADVANCED PROPULSION SYSTEMS↗

Deforestation reshapes land-surface energy-flux partitioning

Land-use and land-cover change significantly modify local land-surface characteristics and water/energy exchanges, which can lead to atmospheric circulation and regional climate changes. In particular, deforestation accounts for a large portion of global land-use changes, which transforms forests into other land cover types, such as croplands and grazing lands. Many previous efforts have focused on observing and modeling land–atmosphere–water/energy fluxes to investigate land–atmosphere coupling induced by deforestation. However, interpreting land–atmosphere–water/energy-flux responses to deforestation is often complicated by the concurrent impacts from shifts in land-surface properties versus background atmospheric forcings. In this study, we used 29 paired FLUXNET sites, to improve understanding of how deforested land surfaces drive changes in surface-energy-flux partitioning. Each paired sites included an intact forested and non-forested site that had similar background climate. We employed transfer entropy, a method based on information theory, to diagnose directional controls between coupling variables, and identify nonlinear cause–effect relationships. Transfer entropy is a powerful tool to detective causal relationships in nonlinear and asynchronous systems. The paired eddy covariance flux measurements showed consistent and strong information flows from vegetation activity (gross primary productivity (GPP)) and physical climate (e.g. shortwave radiation, air temperature) to evaporative fraction (EF) over both non-forested and forested land surfaces. More importantly, the information transfers from radiation, precipitation, and GPP to EF were significantly reduced at non-forested sites, compared to forested sites. We then applied these observationally constrained metrics as benchmarks to evaluate the Energy Exascale Earth System Model (E3SM) land model (ELM). ELM predicted vegetation controls on EF relatively well, but underpredicted climate factors on EF, indicating model deficiencies in describing the relationships between atmospheric state and surface fluxes. Moreover, changes in controls on surface energy flux partitioning due to deforestation were not detected in the model. We highlight the need for benchmarking model simulated surface-energy fluxes and the corresponding causal relationships against those of observations, to improve our understanding of model predictability on how deforestation reshapes land surface energy fluxes.

54 ENVIRONMENTAL SCIENCES↗

Hot, cold, or just right? An infrared biometric sensor to improve occupant comfort and reduce overcooling in buildings via closed-loop control

To improve occupant comfort and save energy in buildings, we have developed a closed-loop air conditioning (AC) sensor-controller that predicts occupant thermal sensation from the thermographic measurement of skin temperature distribution, then uses this information to reduce overcooling (cooling-energy overuse that discomforts occupants) by regulating AC output. Taking measures to protect privacy, it combines thermal-infrared (TIR) and color (visible spectrum) cameras with machine vision to measure the skin-surface temperature profile. Since the human thermoregulation system uses skin blood flow to maintain thermoneutrality, the distribution of skin temperature can be used to predict warm, neutral, and cool thermal states. We conducted a series of human-subject thermal-sensation trials in cold-to-hot environments, measuring skin temperatures and recording thermal sensation votes. We then trained random-forest classification machine-learning models (classifiers) to estimate thermal sensation from skin temperatures or skin-temperature differences. The estimated thermal sensation was input to a proportional integral (PI) control algorithm for the AC, targeting a sensation level between neutral and warm. Our sensor-controller includes a sensor assembly, server software, and client software. The server software orients the cameras and transmits images to the client software, which in turn assesses occupant skin temperature distribution, estimates occupant thermal sensation, and controls AC operation. A demonstration conducted in a conference room in an office building near Houston, TX showed that our system reduced overcooling, decreasing AC load by 42% when the room was occupied while improving occupant comfort (fraction of “comfortable” votes) by 15 percentage points.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

Distinguishability of Radially Directed Energy and Particle Flux in the TJ-II Heliac: Controlling Transport by Feedback-Phasing Experiments

This project supported a U.S. contribution to the TJ-II stellarator research program focused on distinguishing radially directed particle transport from energy transport in magnetized fusion plasmas. The motivating physics issue is that turbulent particle flux and turbulent heat or energy flux are not necessarily locked together: changes in density, electron temperature, plasma potential, and electric-field fluctuations can produce different phase relationships and therefore different radial fluxes. Resolving these relationships is important for understanding improved-confinement behavior, transport-barrier-like regimes, and the broader ability to predict and control confinement in stellarators and related toroidal devices.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Developing ML/AI Methods for High-Throughput Characterization of Multiple-Sensor Streams of Tokamak Dynamics for High-Speed Control (Final Report)

This project evaluated and developed new mathematical and algorithmic techniques capable of handling (in real-time) the growing amounts of data generated by modern fusion research. While existing numerical linear algebra (NLA) methods provide the backbone to classical data analysis and algorithms, these methods fundamentally do not port to distributed architectures nor do they allow low-latency data reduction for control. Motivated by the needs for modern fusion reactors, this project explored and implemented new numerical methods to characterize plasma dynamics, respond in real-time to discharge evolution, and to process massive-scale data accurately and rapidly more fully. This project links expertise in multiple-sensor diagnostics of tokamak plasma dynamics from Columbia University’s Plasma Physics Laboratory with expertise in massive-scale data reduction and extreme data control algorithms at Columbia University’s Data Science Institute. This interdisciplinary project (i) applied machine learning methods, (ii) implemented a properly-trained neural-network for very fast processing of high-speed plasma videography, and (ii) developed the applied mathematical methods, based on randomized-NLA (rNLA) routines, for data analysis, reduction, and real-time control. The Columbia University High Beta Tokamak-Extended Pulse (HBT-EP) facility provided data to test new algorithms and partnership with Columbia University's Data Sciences Institute evaluated the broader use of new algorithms for many challenging control applications.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Control Effector Unsaturation Modification to the Cascading Generalized Inverse Control Allocation Algorithm

Control allocation has sufficiently progressed such that it is used in front-line fighter aircraft such as the F-18Superhornet and the F-35 Joint Strike Fighter. Published literature shows the F-35 utilizes Nonlinear Dynamic Inversion in conjunction with an Effector Blender that incorporates the Cascading Generalized Inverse control allocation algorithm. While the Cascading Generalized Inverse algorithm is one of the premier generalized inverse methods, it does suffer from three deficiencies. In particular, it suffers from an inability to achieve some desired outcomes, it intermittently provides non-optimal solutions and generally fails to preserve moment direction near maximal achievable moments. An effector unsaturation method based on a Scalar Difference Quadratic was first introduced and implemented on the iterative Prediction Method control allocation algorithm which was shown to consistently achieve optimal (weighted) control allocation solutions throughout the entire Attainable Moment Set while preserving desired moment direction. In this paper, the shortcomings of the Cascading Generalized Inverse algorithm are addressed by augmenting the baseline algorithm with Scalar Difference Quadratic unsaturation identification and location at each iteration. Numerical case studies demonstrate that the Modified Cascading Generalized Inverse algorithm resolves the aforementioned deficiencies.

Michael J Acheson↗

In situ edge engineering in two-dimensional transition metal dichalcogenides

Exerting synthetic control over the edge structure and chemistry of two-dimensional (2D) materials is of critical importance to direct the magnetic, optical, electrical, and catalytic properties for specific applications. Here in this study, we directly image the edge evolution of pores in Mo 1-x W x Se 2 monolayers via atomic-resolution in situ scanning transmission electron microscopy (STEM) and demonstrate that these edges can be structurally transformed to theoretically predicted metastable atomic configurations by thermal and chemical driving forces. Density functional theory calculations and ab initio molecular dynamics simulations explain the observed thermally induced structural evolution and exceptional stability of the four most commonly observed edges based on changing chemical potential during thermal annealing. Finally, the coupling of modeling and in situ STEM imaging in changing chemical environments demonstrated here provides a pathway for the predictive and controlled atomic scale manipulation of matter for the directed synthesis of edge configurations in Mo 1-x W x Se 2 to achieve desired functionality.

36 MATERIALS SCIENCE↗

System identification requirements for high-bandwidth rotorcraft flight control system design

The application of system identification methods to high-bandwidth rotorcraft flight control system design is examined. Flight test and modeling requirements are illustrated using flight test data from a BO-105 hingeless rotor helicopter. The proposed approach involves the identification of nonparametric frequency-response models followed by parametric (transfer funtion and state space) model identification. Results for the BO-105 show the need for including coupled body/rotor flapping and lead-lag dynamics in the identification model structure to allow the accurate prediction of control system bandwidth limitations. Lower-order models are useful for estimating nominal control system performance only when the flight data used for the identification are band-limited to be consistent with the frequency range of applicability of the model. The flight test results presented in this paper are consistent with theoretical studies by previous researchers.

Tischler, Mark B.↗

Development and Implementation of a Hardware In-the-Loop Test Bed for Unmanned Aerial Vehicle Control Algorithms

Successful prediction and management of battery life using prognostic algorithms through ground and flight tests is important for performance evaluation of electrical systems. This paper details the design of test beds suitable for replicating loading profiles that would be encountered in deployed electrical systems. The test bed data will be used to develop and validate prognostic algorithms for predicting battery discharge time and battery failure time. Online battery prognostic algorithms will enable health management strategies. The platform used for algorithm demonstration is the EDGE 540T electric unmanned aerial vehicle (UAV). The fully designed test beds developed and detailed in this paper can be used to conduct battery life tests by controlling current and recording voltage and temperature to develop a model that makes a prediction of end-of-charge and end-of-life of the system based on rapid state of health (SOH) assessment.

Battery Testbed↗

Validation of the Fault Ride-Through Response of a Generic EMT Inverter Model by Laboratory Testing

This paper presents the validation of the fault ride-through response of a large-scale inverter model using laboratory testing of a commercial inverter. First, we present the generic inverter model specifications. The generic inverter control is developed based on the fault ride-through response performance requirements of IEEE Std 2800-2022 for inverter-based resources. Next, we present laboratory tests that emulate voltages at the inverter terminal resulting from balanced and unbalanced faults on the transmission system. The tests are performed on a commercia12.2 MVA battery storage inverter at the U.S. National Renewable Energy Laboratory. Comparisons of the model's response to the laboratory measurements show the generic model presented can predict the controlled response of the commercial equipment. The differences between the model's response and the laboratory measurements during the initial transient at fault inception are discussed.

fault ride-through↗

Prediction of Cooling Curves for Controlled Unidirectional Solidification Under the Influence of Shrinkage: A Semi-analytical Approach

Quality of casting products can be significantly improved by controlling the crystal growth rate. Both dendritic and equiaxed grain structures depend strongly on crystal growth rate along the crystallographic direction. Uncontrolled solidification processes may lead to the formation of porous and columnar material with an extremely non-homogeneous composition distribution. These undesirable micro-structures can be avoided by adopting an optimal cooling rate (K/s) during the crystal growth. The present work focuses on determining suitable cooling curves to obtain desired unidirectional crystal growth rates, by implementing a semi-analytical model. Here, we defined cooling curve as the time history of temperature evolution at the cold boundary. The proposed semi-analytical heat transfer model is diffusion driven and accounts for shrinkage effect during solidification. The proposed model is found capable of predicting cooling curves for prescribed interface velocities. The model is self-sufficient in validating itself by means of solving inverse and forward problems. The cooling curve prediction by the model is validated by using it as the transient boundary condition for an existing enthalpy updating scheme-based numerical model. The proposed model is also applied to empirical data reported in literature, to validate the model against experimental results. All the validations showcased excellent fit. The proposed model will facilitate controlled unidirectional crystal growth rate by providing cooling rate (K/s) as an input for the experiments involving directional solidification.

36 MATERIALS SCIENCE↗