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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 1,027 records · Page 57
All sourcesNASA NTRSDOE OSTI
DOE OSTI2015

Simulation of the elementary evolution operator with the motional states of an ion in an anharmonic trap

Following a recent proposal of L. Wang and D. Babikov [J. Chem. Phys. 137, 064301 (2012)], we theoretically illustrate the possibility of using the motional states of a Cd{sup +} ion trapped in a slightly anharmonic potential to simulate the single-particle time-dependent Schrödinger equation. The simulated wave packet is discretized on a spatial grid and the grid points are mapped on the ion motional states which define the qubit network. The localization probability at each grid point is obtained from the population in the corresponding motional state. The quantum gate is the elementary evolution operator corresponding to the time-dependent Schrödinger equation of the simulated system. The corresponding matrix can be estimated by any numerical algorithm. The radio-frequency field which is able to drive this unitary transformation among the qubit states of the ion is obtained by multi-target optimal control theory. The ion is assumed to be cooled in the ground motional state, and the preliminary step consists in initializing the qubits with the amplitudes of the initial simulated wave packet. The time evolution of the localization probability at the grids points is then obtained by successive applications of the gate and reading out the motional state population. The gate field is always identical for a given simulated potential, only the field preparing the initial wave packet has to be optimized for different simulations. We check the stability of the simulation against decoherence due to fluctuating electric fields in the trap electrodes by applying dissipative Lindblad dynamics.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2020

Performance Evaluation of a Two-Dimensional Flood Model on Heterogeneous High-Performance Computing Architectures

This paper describes the implementation of a two-dimensional hydrodynamic flood model with two different numerical schemes on heterogeneous high-performance computing architectures. Both schemes were able to solve the nonlinear hyperbolic shallow water equations using an explicit upwind first-order approach on finite differences and finite volumes, respectively, and were conducted using MPI and CUDA. Four different test cases were simulated on the Summit supercomputer at Oak Ridge National Laboratory. Both numerical schemes scaled up to 128 nodes (768 GPUs) with a maximum 98.2x speedup of over 1 GPU. The lowest run time for the 10 day Hurricane Harvey event simulation at 5 meter resolution (272 million grid cells) was 50 minutes. GPUDirect communication proved to be more convenient than the standard communication strategy. Both strong and weak scaling are shown.

Sharif, Md Bulbul↗
DOE OSTI2020

Feasibility Analysis of Converter-Interfaced Combined Heat and Power System

As a promising new design concept, the converter-interfaced combined heat and power (CHP) system is coupled to the bulk grid through a rectifier and a grid-ready tied inverter. Compared to the traditional directly-coupled CHP system, it removes the requirement for oversizing the CHP generator, limits the short-circuit contribution of the generator and simplifies the grid integration process of CHP system. This paper evaluates the economic benefits of this concept by calculating the annualized Return-on-Investment (ROI) and comparing it to the directly-coupled system. The economic analysis includes timeseries simulations to compute energy transactions with the bulk grid as well as sizing the equipment to calculate the capital and operational costs. Obtained results indicate that in majority of user cases evaluated, the converter-interfaced CHP systems can provide better ROI than directly-coupled systems. Given the additional technical benefits provided by inverter-based distributed energy resources (DERs), the proposed concept is proved to be technically viable and economically feasible.

03 NATURAL GAS↗
DOE OSTI2014

Binary black hole accretion from a circumbinary disk: Gas dynamics inside the central cavity

We present the results of two-dimensional (2D) hydrodynamical simulations of circumbinary disk accretion using the finite-volume code DISCO. This code solves the 2D viscous Navier-Stokes equations on a high-resolution moving mesh which shears with the fluid flow, greatly reducing advection errors in comparison with a fixed grid. We perform a series of simulations for binary mass ratios in the range 0.026 ≤ q ≤ 1.0, each lasting longer than a viscous time so that we reach a quasi-steady accretion state. In each case, we find that gas is efficiently stripped from the inner edge of the circumbinary disk and enters the cavity along accretion streams, which feed persistent 'mini disks' surrounding each black hole. We find that for q ≳ 0.1, the binary excites eccentricity in the inner region of the circumbinary disk, creating an overdense lump which gives rise to enhanced periodicity in the accretion rate. The dependence of the periodicity on mass ratio may provide a method for observationally inferring mass ratios from measurements of the accretion rate. We also find that for all mass ratios studied, the magnitude of the accretion onto the secondary is sufficient to drive the binary toward larger mass ratio. This suggests a mechanism for biasing mass-ratio distributions toward equal mass.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2019

High-Resolution Regional Wave Hindcast for the U.S. Alaska Coast

Regional long-term wave hindcast with state-of-art third-generation models is essential for characterization of regional wave resources. This report summarizes modeling efforts for the simulation of the wave climate along southern Alaska, which used an unstructured, nested-grid modeling approach that incorporates a global-regional nested grid using WAVEWATCH III ® and the high-resolution SWAN (Simulating Waves Nearshore) model. Wave resource and wave bulk parameters were simulated for a 32-year period from 1979 to 2010 and were subsequently validated with wave buoy data in the model domain. Error statistics of model skills were calculated at all buoy stations. Overall, model results, both resource and bulk parameters, match observations well. The model hindcast was able to reproduce the seasonal variation of the sea state with large waves that occur in the winter and early spring months when wind forcing is strong and the calm sea state during the summer when wind forcing is weak. The hindcast also considers the effect of sea ice on wave growth, which affects the southern Bering Sea. The hindcast results, including resource and bulk parameters, were archived at every model grid point for the entire model domain at three-hour intervals. In addition, spectral results were saved at National Data Buoy Center buoy stations and selected virtual buoy locations at hourly intervals. The nested-grid modeling framework employed in this study provides a powerful and efficient modeling approach for accurately simulating wave climate at regional and long-term temporal scales with sufficiently fine resolutions in the nearshore region.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2013

Modeling aerosols and their interactions with shallow cumuli during the 2007 CHAPS field study

The Weather Research and Forecasting model coupled with chemistry (WRF-Chem) is used to simulate relationships between aerosols and clouds in the vicinity of Oklahoma City during the June 2007 Cumulus Humilis Aerosol Processing Study (CHAPS). The regional scale simulation completed using 2 km horizontal grid spacing evaluates four important relationships between aerosols and shallow cumulus clouds observed during CHAPS. First, the model reproduces the trends of higher nitrate volume fractions in cloud droplet residuals compared to interstitial non-activated aerosols, as measured using the Aerosol Mass Spectrometer. Comparing simulations with cloud chemistry turned on and off, we show that nitric acid vapor uptake by cloud droplets explains the higher nitrate content of cloud droplet residuals. Second, as documented using an offline code, both aerosol water and other inorganics (OIN), which are related to dust and crustal emissions, significantly affect predicted aerosol optical properties. Reducing the OIN content of wet aerosols by 50% significantly improves agreement of model predictions with measurements of aerosol optical properties. Third, the simulated hygroscopicity of aerosols is too high as compared to their hygroscopicity derived from cloud condensation nuclei and particle size distribution measurements, indicating uncertainties associated with simulating size-dependent chemical composition and treatment of aerosol mixing state within the model. Fourth, the model reasonably represents the observations of the first aerosol indirect effect where pollutants in the vicinity of Oklahoma City increase cloud droplet number concentrations and decrease the droplet effective radius. While previous studies have often focused on cloud-aerosol interactions in stratiform and deep convective clouds, this study highlights the ability of regional-scale models to represent some of the important aspects of cloud-aerosol interactions associated with fields of short-lived shallow cumuli.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2021

Grid-Integrated Electric Mobility Model (GEM) v1.0

Transportation is the fastest-growing source of greenhouse gas (GHG) emissions and energy consumption globally. The convergence of shared mobility, vehicle automation, and electrification has the potential to drastically reduce transportation impacts, but requires careful integration with rapidly evolving electricity systems. We have developed the GEM Model (Grid-Integrated Electric Mobility) to examine these interactions with a U.S.-wide simulation framework encompassing private electric vehicles (EVs); shared automated EVs (SAEVs); charging infrastructure; controlled EV charging; and a grid economic dispatch model to simulate mobility futures exclusively using EVs. We find that an SAEV fleet 9% the size of today's active vehicles can satisfy trip demand with only 2.6 million chargers (0.2 per EV). Controlled EV charging can also reduce electricity demand variability, significantly reducing GHG emissions and decreasing solar curtailment by about one-third. While private EVs with uncontrolled charging would reduce GHG emissions by 53% compared to gasoline vehicles, SAEVs could achieve a 70% reduction.

Sheppard, Colin↗
DOE OSTI2016

Investigation of CO 2 capture using solid sorbents in a fluidized bed reactor: Cold flow hydrodynamics

Both experimental tests and numerical simulations were conducted to investigate the fluidization behavior of a solid CO 2 sorbent with a mean diameter of 100 μm and density of about 480 kg/m, which belongs to Geldart's Group A powder. A carefully designed fluidized bed facility was used to perform a series of experimental tests to study the flow hydrodynamics. Numerical simulations using the two-fluid model indicated that the grid resolution has a significant impact on the bed expansion and bubbling flow behavior. Due to the limited computational resource, no good grid independent results were achieved using the standard models as far as the bed expansion is concerned. In addition, all simulations tended to under-predict the bubble size substantially. Effects of various model settings including both numerical and physical parameters have been investigated with no significant improvement observed. The latest filtered sub-grid drag model was then tested in the numerical simulations. Compared to the standard drag model, the filtered drag model with two markers not only predicted reasonable bed expansion but also yielded realistic bubbling behavior. As a result, a grid sensitivity study was conducted for the filtered sub-grid model and its applicability and limitation were discussed.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2024

Impacts of Topography-Based Subgrid Scheme and Downscaling of Atmospheric Forcing on Modeling Land Surface Processes in the Conterminous US

The effects of small-scale topography-induced land surface heterogeneity are not well represented in current Earth System Models (ESMs). In this study, a new topography-based subgrid structure referred to as topographic units (TGU) designed to better capture subgrid topographic effects, and methods to downscale atmospheric forcing to the land TGUs have been implemented in the Energy Exascale Earth System Model (E3SM) Land Model (ELM). Effects of the subgrid scheme and downscaling methods on ELM simulated land surface processes are evaluated over the conterminous United States (CONUS). For this purpose, ELM simulations are performed using two configurations without (NoD ELM) and with (D ELM) downscaling, both using TGUs derived for the 0.5-degree grids and the same land surface parameters. Simulations using the two ELM configurations are compared over the CONUS domain, regional levels, and at observational sites (e.g., SNOTEL). The CONUS-level results suggest that D ELM simulates more snowfall and snow water equivalent (SWE), higher runoff, and less ET during spring and summer. Regional-level results suggest more pronounced impacts of downscaling over regions dominated by higher elevation TGUs and regions with maximum precipitation occurring during cool seasons. Results at the SNOTEL sites suggest that D ELM has superior capability of reproducing the observed SWE at 83% of the sites, with more pronounced performance over topographically heterogeneous TGUs with their maximum precipitation occurring during cool seasons. The results highlight the importance of improving representation of small-scale surface heterogeneity in ESMs and motivate future research to understand their effects on land-atmosphere interactions, streamflow, and water resources management over mountainous regions.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2025

Techno-Economic Analysis of Data-Driven and Transactive Approaches for Resilience Enhancement

As extreme weather events lead to more frequent power outages, understanding and enhancing grid resilience is critical to mitigating economic losses and non-energy impacts from service disruptions. Here, this study introduces a novel techno-economic analysis framework for evaluating resilience enhancement mechanisms. The framework combines grid response modeling with a co-simulation approach and valuation methodology to provide a comprehensive assessment. We apply this framework to a realistic case study of the Texas grid during Winter Storm Uri in February 2021. Two advanced resilience strategies are analyzed: a data-driven rolling outage mechanism and a transactive energy (TE) based allocation scheme. The rolling outage scheme selectively serves customers based on real-time curtailment needs, while the TE scheme allows customers to trade energy allocations according to their preferences. Our findings show that both the rolling outage and TE schemes significantly outperform conventional methods (i.e. controlled outages) by reducing the amount of energy not supplied to customers by 41% and 64%, respectively. These approaches also enhance flexibility and customer satisfaction, while improving energy utilization for greater resilience. Additionally, they maintain thermal comfort about 3.5 times better and substantially lower customer risk exposure. A key contribution of this study is addressing both utility and customer perspectives while considering both energy and non-energy impacts. The techno-economic analysis indicates that implementing these resilience enhancement strategies would incur an additional 1.1Bto1.6B in utility costs but has the potential to avoid 17.3Bto18B of customer losses as compared to existing solutions, thereby underscoring the value of investing in advanced resilience, as it provides significant societal benefits to customers.

42 ENGINEERING↗
DOE OSTI2024

Electrification Options for Multi-Family Water Heating in Cold Climates - Final Report

In multi-family buildings, large water storage tanks in centralized domestic hot water (DHW) systems can serve as thermal energy storage (TES) batteries to mitigate grid impact. These systems offer demand shift and efficiency benefits, significantly reducing peak power consumption, particularly in cold climates. This study evaluates the load-shifting benefits of a centralized heat pump water heater (HPWH) system equipped with a CO2 heat pump in multi-family buildings through simulation. The heat pump system and water storage tank are sized using design-day sizing. A finite-element-based stratified tank model and CO2 heat pump performance map from a commercial DHW product are used. Annual simulations are conducted to assess the benefits of the centralized DHW system for energy efficiency improvements, load shifting, and emission reductions. These simulations incorporate utility tariffs and marginal grid emission data from Los Angeles and Chicago. In Los Angeles, using a water tank as a thermal battery achieves 7.4% utility cost savings and 10.2% emission reduction. In Chicago, compared to HPWH conventional operation without preheating, TES-enabled central HPWH provides 15% utility cost savings and 13% emission reduction. The case study demonstrates that the demand reduction potential of central CO2 HPWHs is significant in cold climate regions.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗
DOE OSTI2022

GIST (Grid Impedance Scan Tool) [SWR-22-73]

NREL has developed GIST (Grid Impedance Scan Tool) to scan the impedance response of inverter-based resources such as land-based and offshore wind power plants, solar power plants, etc., from their electromagnetic transient simulation models to evaluate their impact on grid stability. GIST can scan impedance response of inverter-based resources from vendor-supplied black-box simulation models without requiring internal proprietary details, enabling detailed stability analysis of power systems with high levels of inverter-based generation.

Shah, Shahil↗
DOE OSTI2011

Summary of Results for Converging Shock Wave Problems

The purpose of this note is to provide a brief overview of an attempt to simulate a Guderley-like imploding shock problem in xRAGE. Prior to this study, the following have been completed with respect to the Guderley problem itself: A canonical definition for use with ASC codes has been proposed (LA-UR-11-02765); 1D simulations with spherical symmetry on uniform grids have been performed, with associated spatial convergence analysis. The xRAGE code showed near 1st order convergence for this problem in the initial studies (LA-UR-10-06435); A version of the Guderley problem as been added to the xRAGE regression test suite. More recently, a large number of simulations have been performed for the Guderley problem (and a similar problem) using xRAGE’s (v. 1009.02) AMR capability.

Mathematics & Computing(97)↗
DOE OSTI2020

20% of US electricity from wind will have limited impacts on system efficiency and regional climate

Abstract Impacts from current and future wind turbine (WT) deployments necessary to achieve 20% electricity from wind are analyzed using high resolution numerical simulations over the eastern USA. Theoretical scenarios for future deployments are based on repowering (i.e. replacing with higher capacity WTs) thus avoiding competition for land. Simulations for the contemporary climate and current WT deployments exhibit good agreement with observed electricity generation efficiency (gross capacity factors (CF) from simulations = 45–48%, while net CF for WT installed in 2016 = 42.5%). Under the scenario of quadrupled installed capacity there is a small decrease in system-wide efficiency as indicated by annual mean CF. This difference is approximately equal to that from the two simulation years and may reflect saturation of the wind resource in some areas. WT modify the local near-surface climate in the grid cells where they are deployed. The simulated impact on near-surface climate properties at both the regional and local scales does not increase with increasing WT installed capacity. Climate impacts from WT are modest compared to regional changes induced by historical changes in land cover and to the global temperature perturbation induced by use of coal to generate an equivalent amount of electricity.

17 WIND ENERGY↗
DOE OSTI2018

Enrichment methods for inflow turbulence generation in the atmospheric boundary layer

Here, we investigate the feasibility of introducing synthetic turbulence into finite-domain large-eddy simulations (LES) of the wind plant operating environment. This effort is motivated by the need for a robust mesoscale-to-microscale coupling strategy in which a microscale (wind plant) simulation is driven by mesoscale data without any resolved microscale turbulence. A neutrally stratified atmospheric boundary layer was simulated in an LES with 10-m grid spacing. We show how such a fully developed turbulence field may be reproduced with spectral enrichment starting from an under-resolved coarse LES field (with 20-m and 40-m grid spacing). The velocity spectra of the under-resolved fields are enriched by superimposing a fluctuating velocity field calculated by two turbulence simulators: TurbSim and Gabor Kinematic Simulation. Both forms of enrichment accurately simulated the autospectra of all three velocity components at high wavenumbers, with agreement between the enriched fields and the full-resolution LES observed at 400 m from the inflow boundary. In contrast, the spectra of the unenriched fields reached the same fully developed state at four times the downstream distance.

17 WIND ENERGY↗
DOE OSTI2022

Impact of Advection Schemes on Tracer Interrelationships in Large-Eddy Simulations of Deep Convection

This study investigates the preservation of tracer interrelationships during advection in large-eddy simulations of an idealized deep convective cloud, which is particularly relevant to chemistry, aerosol, and cloud microphysics models. Employing the Cloud Model 1, advection is represented using third-, fifth-, and seventh-order weighted essentially non-oscillatory schemes. As a simplified analogy for cloud hydrometeors and aerosols, several inert passive tracers following linear and nonlinear relationships are initialized after the cloud reaches ~6-km depth. Numerical mixing in the simulated turbulent convective clouds leads to significant deviations from the initial nonlinear relationships between tracers. In these simulations, a considerable fraction of the grid points where the tracers’ nonlinear relationships are altered from advection are classified as unrealistic (e.g., ~13% for the environmental tracers on average), including errors from range-preserving unmixing and overshooting. Errors in the sum of three tracers are also relatively large, ranging between ~1% and 16% for 5% of the grid points in and near the cloud. The magnitude of unrealistic mixing and errors in the sum of three tracers generally increase with the order of accuracy of the advection scheme. These results are consistent across model grid spacings ranging from 50 to 200 m, and across three different flow realizations for each combination of grid spacing and advection scheme tested. Tests employing a previously proposed scalar normalization procedure show substantially reduced errors in the sum of three tracers with a relatively small negative impact on other tracer relationships. This analysis, therefore, suggests efficacy of the normalization procedure when applied to turbulent three-dimensional cloud simulations.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2021

Mesoscale Convective Systems in a Superparameterized E3SM Simulation at High Resolution

Accurately representing mesoscale convective systems (MCSs) is crucial to simulating the energy and water cycles in global climate models. Using a novel MCS identification and tracking algorithm applied to observations and model simulations, we evaluate how well the Energy Exascale Earth System Model simulates MCSs over the central US. Simulations performed by E3SM at 25 km grid spacing with (SP-E3SM) and without (E3SM) superparameterization are compared and evaluated against observations using multiple metrics highlighting important MCS characteristics. Compared to E3SM, SP-E3SM better simulates MCS number and MCS precipitation amount, diurnal cycle, propagation, and the probability distribution of precipitation rate in both spring and summer. The improvement from SP is partly contributed by improvement in simulating the large-scale environments, featuring enhanced atmospheric low-level moisture and larger moisture transport to the central US relative to E3SM. However, SP-E3SM still underestimates MCS precipitation amount, particularly in summer. This underestimation is closely related to the negative bias in MCS precipitation intensity, although the drier environments simulated during summer also contributes to underestimation of MCS frequency. Without SP, the larger bias in MCS precipitation amount is closely related to the negative bias in MCS frequency, while the substantial dry bias in the large-scale environments also contributes to underestimation of MCS intensity. Our results suggest that SP improves MCS simulation by improving modeling of the large-scale environments and convection initiation, which are both major limiting factors in E3SM even at 25 km grid spacing where deep convection is represented by a cumulus parameterization.

54 ENVIRONMENTAL SCIENCES↗