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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 1,711 records · Page 95
All sourcesNASA NTRSDOE OSTI
DOE OSTI2016

MATLAB/Simulink Framework for Modeling Complex Coolant Flow Configurations of Advanced Automotive Thermal Management Systems

The National Renewable Energy Laboratory's (NREL's) CoolSim MATLAB/Simulink modeling framework was extended by including a newly developed coolant loop solution method aimed at reducing the simulation effort for arbitrarily complex thermal management systems. The new approach does not require the user to identify specific coolant loops and their flow. The user only needs to connect the fluid network elements in a manner consistent with the desired schematic. Using the new solution method, a model of NREL's advanced combined coolant loop system for electric vehicles was created that reflected the test system architecture. This system was built using components provided by the MAHLE Group and included both air conditioning and heat pump modes. Validation with test bench data and verification with the previous solution method were performed for 10 operating points spanning a range of ambient temperatures between -2 degrees C and 43 degrees C. The largest root mean square difference between pressure, temperature, energy and mass flow rate data and simulation results was less than 7%.

30 DIRECT ENERGY CONVERSION↗
DOE OSTI2017

On-Road Validation of a Simplified Model for Estimating Real-World Fuel Economy

On-road fuel economy is known to vary significantly between individual trips in real-world driving conditions. This work introduces a methodology for rapidly simulating a specific vehicle's fuel economy over the wide range of real-world conditions experienced across the country. On-road test data collected using a highly instrumented vehicle is used to refine and validate this modeling approach. Here, model accuracy relative to on-road data collection is relevant to the estimation of 'off-cycle credits' that compensate for real-world fuel economy benefits that are not observed during certification testing on a chassis dynamometer.

33 ADVANCED PROPULSION SYSTEMS↗
DOE OSTI2023

Insights on Nuclear Energy from Long-Term System Models: Inter-Model Comparison Results

A variety of US electric power sector capacity expansion models are used by decision makers and analysts to evaluate competition among generation, transmission, and storage technologies to meeting the demands of the system. CEMs use least-cost optimization to identify optimal portfolios of investments capable of satisfying all specified requirements. While CEMs are a useful tool to inform pathways to meet future needs, projections can differ significantly between tools for apparently similar scenario assumptions. Differences in model structure, scope, and input assumption contribute to this issue. This work compares model response with harmonization between four modeling teams on issues significant to the representation and development of nuclear energy.

capacity expansion model↗
DOE OSTI2014

Bridging the Transition from Mesoscale to Microscale Turbulence in Numerical Weather Prediction Models

With a focus towards developing multiscale capabilities in numerical weather prediction models, the specific problem of the transition from the mesoscale to the microscale is investigated. For that purpose, idealized one-way nested mesoscale to large-eddy simulation (LES) experiments were carried out using the Weather Research and Forecasting model framework. It is demonstrated that switching from one-dimensional turbulent diffusion in the mesoscale model to three-dimensional LES mixing does not necessarily result in an instantaneous development of turbulence in the LES domain. However, very large fetches are needed for the natural transition to turbulence to occur. The computational burden imposed by these long fetches necessitates the development of methods to accelerate the generation of turbulence on a nested LES domain forced by a smooth mesoscale inflow. To that end, four new methods based upon finite amplitude perturbations of the potential temperature field along the LES inflow boundaries are developed, and investigated under convective conditions. Each method accelerated the development of turbulence within the LES domain, with two of the methods resulting in a rapid generation of production and inertial range energy content associated to microscales that is consistent with non-nested simulations using periodic boundary conditions. The cell perturbation approach, the simplest and most efficient of the best performing methods, was investigated further under neutral and stable conditions. Successful results were obtained in all the regimes, where satisfactory agreement of mean velocity, variances and turbulent fluxes, as well as velocity and temperature spectra, was achieved with reference non-nested simulations. In contrast, the non-perturbed LES solution exhibited important energy deficits associated to a delayed establishment of fully-developed turbulence. The cell perturbation method has negligible computational cost, significantly accelerates the generation of realistic turbulence, and requires minimal parameter tuning, with the necessary information relatable to mean inflow conditions provided by the mesoscale solution.

17 WIND ENERGY↗
DOE OSTI2022

Data-Driven Dynamic Modeling in Power Systems: A Fresh Look on Inverter-Based Resource Modeling

Here, this article introduces ways to identify dynamic system models using measurement data. In power system analysis, a static model represents the time-invariant input-output relationship of a system, while a dynamic model describes the behavior of the system over time. For example, how will a system transit from one steady-state operation point to another?

24 POWER TRANSMISSION AND DISTRIBUTION↗
DOE OSTI2014

Evaluation of Cloud-resolving and Limited Area Model Intercomparison Simulations using TWP-ICE Observations. Part 2: Rain Microphysics

Ten 3D cloud-resolving model (CRM) simulations and four 3D limited area model (LAM) simulations of an intense mesoscale convective system observed on January 23-24, 2006 during the Tropical Warm Pool – International Cloud Experiment (TWP-ICE) are compared with each other and with observations and retrievals from a scanning polarimetric radar, co-located UHF and VHF vertical profilers, and a Joss-Waldvogel disdrometer in an attempt to explain published results showing a low bias in simulated stratiform rainfall. Despite different forcing methodologies, similar precipitation microphysics errors appear in CRMs and LAMs with differences that depend on the details of the bulk microphysics scheme used. One-moment schemes produce too many small raindrops, which biases Doppler velocities low, but produces rain water contents (RWCs) that are similar to observed. Two-moment rain schemes with a gamma shape parameter (μ) of 0 produce excessive size sorting, which leads to larger Doppler velocities than those produced in one-moment schemes, but lower RWCs than observed. Two moment schemes also produce a convective median volume diameter distribution that is too broad relative to observations and thus, may have issues balancing raindrop formation, collision coalescence, and raindrop breakup. Assuming a μ of 2.5 rather than 0 for the raindrop size distribution improves one-moment scheme biases, and allowing μ to have values greater than 0 may improve two-moment schemes. Under-predicted stratiform rain rates are associated with under-predicted ice water contents at the melting level rather than excessive rain evaporation, in turn likely associated with convective detrainment that is too high in the troposphere and mesoscale circulations that are too weak. In addition to stronger convective updrafts than observed, limited domain size prevents a large, well-developed stratiform region from developing in CRMs, while a dry bias in ECMWF analyses does the same to the LAMs.

cloud-resolving↗
DOE OSTI2019

Lessons from a large-scale systems dynamics modeling project: the example of the biomass scenario model

The biomass scenario model (BSM) is a dynamic model of the biomass-to-biofuels supply chain in the U.S.A., developed during a multi-year analysis effort conducted by the National Renewable Energy Laboratory (NREL), under sponsorship from the United States Department of Energy (DOE) Bioenergy Technologies Office (BETO). The BSM project, which received the 2018 Applications Award by the International System Dynamics Society, has supported collaborative analyses, developed scenarios for industry development and facilitated stakeholder engagement. We summarize insights gained from the BSM project that may be useful to other large-scale dynamic modeling efforts. We summarize the project focus, the analysis process, key outcomes and observations on successful execution of such a product. Key points include the value of a multidisciplinary team with clear roles, engagement of experts and stakeholders, and use and reuse of simple, modular structures. As a result, the overall effort suggests that these practices may aid long-term, team-focused, multi-stakeholder modeling efforts.

29 ENERGY PLANNING, POLICY, AND ECONOMY↗
DOE OSTI2023

Fast and accurate reduced-order modeling of a MOOSE-based additive manufacturing model with operator learning

One predominant challenge in additive manufacturing (AM) is to achieve specific material properties by manipulating manufacturing process parameters during the runtime. Such manipulation tends to increase the computational load imposed on existing simulation tools employed in AM. The goal of the present work is to construct a fast and accurate reduced-order model (ROM) for an AM model developed within the Multiphysics Object-Oriented Simulation Environment (MOOSE) framework, ultimately reducing the time/cost of AM control and optimization processes. Our adoption of the operator learning (OL) approach enabled us to learn a family of differential equations produced by altering process variables in the laser’s Gaussian point heat source. More specifically, we used the Fourier neural operator (FNO) and deep operator network (DeepONet) to develop ROMs for time-dependent responses. Furthermore, we benchmarked the performance of these OL methods against a conventional deep neural network (DNN)-based ROM. Ultimately, we found that OL methods offer comparable performance and, in terms of accuracy and generalizability, even outperform DNN at predicting scalar model responses. The DNN-based ROM afforded the fastest training time. Furthermore, all the ROMs were faster than the original MOOSE model yet still provided accurate predictions. FNO had a smaller mean prediction error than DeepONet, with a larger variance for time-dependent responses. Unlike DNN, both FNO and DeepONet were able to simulate time series data without the need for dimensionality reduction techniques. Finally, the present work can help facilitate the AM optimization process by enabling faster execution of simulation tools while still preserving evaluation accuracy.

36 MATERIALS SCIENCE↗
DOE OSTI2017

A holographic model for pseudogap in BCS–BEC crossover (I): Pairing fluctuations, double-trace deformation and dynamics of bulk bosonic fluid

We build a holographic model for the pairing fluctuation pseudogap phase in fermionic high temperature superconductivity/superfluidity based on the BCS–BEC crossover scenario. The pseudogap originates from incoherent Cooper pairing and has been observed in recent cold atom experiments. The strength of Cooper pairing and hence the BCS–BEC crossover is controlled by an effective 4-Fermi interaction and we argue that the double-trace deformation for charged scalar operator is a close analog in large N field theories. We employ the double-trace deformed Abelian Higgs model of holographic superconductors and propose that the incoherent fluctuations of the charged scalar in the bulk is the holographic dual of the fluctuating Cooper pairs. Using a Madelung transformation and the velocity-potential formalism, we develop a quantum fluid dynamics as an effective theory for these bulk fluctuations. The new fluid dynamics takes care of the boundary conditions required by AdS/CFT and encodes the vacuum polarization effect in curved spacetime. The pseudogap in conductivity can be related to the plasma oscillation of this bulk fluid.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2018

Modeling the adsorbate coverage distribution over a multi-faceted catalytic grain in the presence of an electric field: O/Fe from first principles

The impact of an external electric field on the concerted behavior of oxygen over a multi-faceted catalytic Fe grain is determined via the interpolation of ab initio models of oxygen adsorption on Fe(100), Fe(110), and Fe(111) in the presence of an external electric field. The application of both negative and positive electric fields weaken the adsorption strength for oxygen on all three surface facets, with Fe(110) experiencing the greatest effect. Kinetic models of a multi-faceted catalytic Fe grain show that the average oxygen coverage over the grain surface is reduced under the influence of both a negative and positive electric field, which are consistent with phase diagram results at comparable pressures. Furthermore, we show that there is a weak synergistic effect between a Pd promoter and a positive electric field on the oxygen adsorption energy, i.e. the Pd promoter and electric field combination weaken the oxygen adsorption energy to a greater degree than the simple addition of both components separately. Overall, the work shows that the application of an applied external electric field may be a useful tool in fine-tuning chemical properties of Fe-based catalysts in hydrodeoxygenation applications.

Bray, Jacob E.↗
DOE OSTI2024

Train small, model big: Scalable physics simulators via reduced order modeling and domain decomposition

Numerous cutting-edge scientific technologies originate at the laboratory scale, but transitioning them to practical industry applications is a formidable challenge. Traditional pilot projects at intermediate scales are costly and time-consuming. An alternative, the pilot-scale model, relies on high-fidelity numerical simulations, but even these simulations can be computationally prohibitive at larger scales. To overcome these limitations, we propose a scalable, physics-constrained reduced order model (ROM) method. The ROM identifies critical physics modes from small-scale unit components, projecting governing equations onto these modes to create a reduced model that retains essential physics details. We also employ Discontinuous Galerkin Domain Decomposition (DG-DD) to apply ROM to unit components and interfaces, enabling the construction of large-scale global systems without data at such large scales. Here this method is demonstrated on the Poisson and Stokes flow equations, showing that it can solve equations about 15–40 times faster with only ~1% relative error. Furthermore, ROM takes one order of magnitude less memory than the full order model, enabling larger scale predictions at a given memory limitation.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2019

Two-tier model reduction of viscoelastically damped finite element models

Transient simulations of linear viscoelastically damped structures necessitate critical computational resources to directly integrate the full-order finite element model with time-stepping algorithms. Traditional modal reduction techniques are not directly applicable to these systems since viscoelastic materials depend on time and frequency. A more appropriate reduction basis is obtained from the nonlinear, complex eigenvalue problem, whose eigenvectors capture the appropriate kinematics and enable frequency-based mode selection; unfortunately, the computational cost is prohibitive for computing these modes from large-scale engineering models. To address this shortcoming, this work proposes a novel two-tier reduction procedure to reduce the upfront cost of solving the complex, nonlinear eigenvalue problem. The first reduction step reduces the full-order model with real mode shapes linearized about various centering frequencies to capture the kinematics over a full range of viscoelastic material behavior (glassy, rubbery, and glass-transition zones). This tier-one reduction preserves time-temperature superposition and allows the equations to depend parametrically on operating temperature. The second-level reduction then solves the complex, nonlinear eigenmode solutions in the tier-one reduced space about a fixed temperature to further reduce the equations-of-motion. The method is demonstrated on a cantilevered sandwich plate to display its accuracy and efficiency in comparison to full-order model predictions.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2014

Comparing cropland net primary production estimates from inventory, a satellite-based model, and a process-based model in the Midwest of the United States

Accurately quantifying the spatial and temporal variability of net primary production (NPP) for croplands is essential to understand regional cropland carbon dynamics. We compared three NPP estimates for croplands in the Midwestern United States: inventory-based estimates using crop yield data from the U.S. Department of Agriculture (USDA) National Agricultural Statistics Service (NASS); estimates from the satellite-based Moderate Resolution Imaging Spectroradiometer (MODIS) NPP product; and estimates from the General Ensemble biogeochemical Modeling System (GEMS) process-based model. The three methods estimated mean NPP in the range of 469–687 g C m -2 yr -1 and total NPP in the range of 318–490 Tg C yr -1 for croplands in the Midwest in 2007 and 2008. The NPP estimates from crop yield data and the GEMS model showed the mean NPP for croplands was over 650 g C m -2 yr -1 while the MODIS NPP product estimated the mean NPP was less than 500 g C m -2 yr -1 . MODIS NPP also showed very different spatial variability of the cropland NPP from the other two methods. We found these differences were mainly caused by the difference in the land cover data and the crop specific information used in the methods. Our study demonstrated that the detailed mapping of the temporal and spatial change of crop species is critical for estimating the spatial and temporal variability of cropland NPP. Finally, we suggest that high resolution land cover data with species–specific crop information should be used in satellite-based and process-based models to improve carbon estimates for croplands.

Biogeochemical model↗
DOE OSTI2019

Modeling Analysis of the Swell and Wind-Sea Climate in the Salish Sea

Accurate model hindcast of wave climate in complex estuarine systems is challenging because high-resolution wave model and wind forcing are required. In this study, a modeling approach using the unstructured-grid Simulating WAves Nearshore and wind product from a high-resolution regional Weather Research and Forecasting hindcast was used to simulate the swell and wind-sea climate in the Salish Sea, a large estuary with many interconnected waterways on the Pacific Northwest coast of North America. The model hindcast was validated with observed data at four wave buoys in the Salish Sea. Spatial distribution and seasonal variations of wave climate in the Salish Sea were analyzed. Of the three major basins in the Salish Sea, the Strait of Juan de Fuca has the largest waves and is dominated by swells propagated from the Pacific Ocean. Significant wave heights in the Strait of Georgia have spatial and seasonal distribution patterns similar to those found in the Strait of Juan de Fuca. Waves in Puget Sound are small and primarily dominated by the wind-sea climate. Strong seasonal variations are observed in the Strait of Juan de Fuca and Strait of Georgia, but there is little seasonality of wave climate in Puget Sound. The high-resolution wave hindcast conducted in this study provides a comprehensive and important data set for better understanding the role of wave climate in coastal processes and natural hazards assessment in the Salish Sea.

wave climate, salish sea, modeling, swell, sea sta↗
DOE OSTI2020

Modeling Extreme Deformations in Lithium Ion Batteries

A simultaneously coupled modeling approach to study the electrochemical and thermal behavior of lithium-ion batteries under large mechanical deformation has been developed. The thermo-electrochemical pseudo-2D (P2D) battery model is coupled with a mechanical material model. Mechanical, thermal, and electrochemical models are implemented as user-defined sub-routines in the commercial multi-physics code LS-DYNA. The mechanical strain experienced by anode, cathode and separator results in thickness and porosity changes in each layer which in turn influences electrochemical behavior. The evolution of concentration profiles and cell potential are studied under different mechanical loading conditions. Internal short-circuits caused by mechanical deformation and corresponding physical behaviors are also elucidated. We discuss the competing effects of improved transport at higher temperature due to the internal short-circuit versus a drop in the effective ionic conductivity and electrolyte diffusivity due to mechanical deformation.

47 OTHER INSTRUMENTATION↗