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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 1,387 records · Page 77
All sourcesNASA NTRSDOE OSTI
DOE OSTI2014

High energy gain in three-dimensional simulations of light sail acceleration

The dynamics of radiation pressure acceleration in the relativistic light sail regime are analysed by means of large scale, three-dimensional (3D) particle-in-cell simulations. Differently to other mechanisms, the 3D dynamics leads to faster and higher energy gain than in 1D or 2D geometry. This effect is caused by the local decrease of the target density due to transverse expansion leading to a “lighter sail.” However, the rarefaction of the target leads to an earlier transition to transparency limiting the energy gain. A transverse instability leads to a structured and inhomogeneous ion distribution.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2021

Evaluation of Energy Storage Potential of Unconventional Shale Reservoirs Using Numerical Simulation of Cyclic Gas Injection

Compressed air energy storage (CAES) stores energy as compressed air in underground formations, typically salt dome caverns. When electricity demand grows, the compressed air is released through a turbine to produce electricity. CAES in the US is limited to one plant built in 1991, due in part to the inherent risk and uncertainty of developing subsurface storage reservoirs. As an alternative to CAES, we propose using some of the hundreds of thousands of hydraulically fractured horizontal wells to store energy as compressed natural gas in unconventional shale reservoirs. To store energy, produced or “sales” natural gas is injected back into the formation using excess electricity and is later produced through an expander to generate electricity. To evaluate this concept, we performed numerical simulations of cyclic natural gas injection into unconventional shale reservoirs using cmg-gem commercial reservoir modeling software. We tested short-term (diurnal) and long-term (seasonal) energy storage potential by modeling well injection and production gas flowrates as a function of bottom-hole pressure. First, we developed a conceptual model of a single fracture stage in an unconventional shale reservoir to characterize reservoir behavior during cyclic injection and production. Next, we modeled cyclic injection in the Marcellus shale gas play using published data. Results indicate that Marcellus unconventional shale reservoirs could support both short- and long-term energy storage at capacities of 100–1000 kWe per well. The results indicate that energy storage in unconventional shale gas wells may be feasible and warrants further investigation.

25 ENERGY STORAGE↗
DOE OSTI2017

Status Report on Modelling and Simulation Capabilities for Nuclear-Renewable Hybrid Energy Systems

This report summarizes the current status of the modeling and simulation capabilities developed for the economic assessment of Nuclear-Renewable Hybrid Energy Systems (N-R HES). The increasing penetration of variable renewables is altering the profile of the net demand, with which the other generators on the grid have to cope. N-R HES analyses are being conducted to determine the potential feasibility of mitigating the resultant volatility in the net electricity demand by adding industrial processes that utilize either thermal or electrical energy as stabilizing loads. This coordination of energy generators and users is proposed to mitigate the increase in electricity cost and cost volatility through the production of a saleable commodity. Overall, the financial performance of a system that is comprised of peaking units (i.e. gas turbine), baseload supply (i.e. nuclear power plant), and an industrial process (e.g. hydrogen plant) should be optimized under the constraint of satisfying an electricity demand profile with a certain level of variable renewable (wind) penetration. The optimization should entail both the sizing of the components/subsystems that comprise the system and the optimal dispatch strategy (output at any given moment in time from the different subsystems). Some of the capabilities here described have been reported separately in [1, 2, 3]. The purpose of this report is to provide an update on the improvement and extension of those capabilities and to illustrate their integrated application in the economic assessment of N-R HES.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2014

Simulated galaxy interactions as probes of merger spectral energy distributions

We present the first systematic comparison of ultraviolet-millimeter spectral energy distributions (SEDs) of observed and simulated interacting galaxies. Our sample is drawn from the Spitzer Interacting Galaxy Survey and probes a range of galaxy interaction parameters. We use 31 galaxies in 14 systems which have been observed with Herschel, Spitzer, GALEX, and 2MASS. We create a suite of GADGET-3 hydrodynamic simulations of isolated and interacting galaxies with stellar masses comparable to those in our sample of interacting galaxies. Photometry for the simulated systems is then calculated with the SUNRISE radiative transfer code for comparison with the observed systems. For most of the observed systems, one or more of the simulated SEDs match reasonably well. The best matches recover the infrared luminosity and the star formation rate of the observed systems, and the more massive systems preferentially match SEDs from simulations of more massive galaxies. The most morphologically distorted systems in our sample are best matched to the simulated SEDs that are close to coalescence, while less evolved systems match well with the SEDs over a wide range of interaction stages, suggesting that an SED alone is insufficient for identifying the interaction stage except during the most active phases in strongly interacting systems. This result is supported by our finding that the SEDs calculated for simulated systems vary little over the interaction sequence.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2013

Comparison of Moist Static Energy and Budget between the GCM-Simulated Madden–Julian Oscillation and Observations over the Indian Ocean and Western Pacific

The moist static energy (MSE) anomalies and MSE budget associated with the Madden–Julian oscillation (MJO) simulated in the Iowa State University General Circulation Model (ISUGCM) over the Indian and Pacific Oceans are compared with observations. Different phase relationships between MJO 850-hPa zonal wind, precipitation, and surface latent heat flux are simulated over the Indian Ocean and western Pacific, which are greatly influenced by the convection closure, trigger conditions, and convective momentum transport (CMT). The moist static energy builds up from the lower troposphere 15–20 days before the peak of MJO precipitation, and reaches the maximum in the middle troposphere (500–600 hPa) near the peak of MJO precipitation. The gradual lower-tropospheric heating and moistening and the upward transport of moist static energy are important aspects of MJO events, which are documented in observational studies but poorly simulated in most GCMs. The trigger conditions for deep convection, obtained from the year-long cloud resolving model (CRM) simulations, contribute to the striking difference between ISUGCM simulations with the original and modified convection schemes and play the major role in the improved MJO simulation in ISUGCM. Additionally, the budget analysis with the ISUGCM simulations shows the increase in MJO MSE is in phase with the horizontal advection of MSE over the western Pacific, while out of phase with the horizontal advection of MSE over the Indian Ocean. However, the NCEP analysis shows that the tendency of MJO MSE is in phase with the horizontal advection of MSE over both oceans.

GCM-simulated↗
DOE OSTI2020

Performance estimation of resonance-enhanced dual-buoy wave energy converter using coupled time-domain simulation

This article presents the modeling methodology and performance evaluation of the resonance-enhanced dual-buoy WEC (Wave Energy Converter) by HEM (hydrodynamic & electro-magnetic) fully-coupled-dynamics time-domain-simulation program. The numerical results are systematically compared with the authors’ 1/6-scale experiment. With a direct-drive linear generator, the WEC consists of dual floating cylinders and a moon-pool between the cylinders, which can utilize three resonance phenomena from moon-pool dynamics as well as heave motions of inner and outer buoys. The contact and friction between the two buoys observed in the experiment are also properly modeled in the time-domain simulation by the Coulomb-friction model. Moon-pool resonance peaks significantly exaggerated in linear potential theory are empirically adjusted through comparisons with measured values. A systematic comparative study between the simulations and experiments with and without PTO (power-take-off) is conducted, and the relative heave displacements/velocities and power outputs are well matched. Then, parametric studies are carried out with the simulation program to determine optimum generator parameters. The performance with various wave conditions is also assessed.

16 TIDAL AND WAVE POWER↗
DOE OSTI2021

Deriving Simulation Parameters for Storage-Type Water Heaters Using Ratings Data Produced from the Uniform Energy Factor Test Procedure: Preprint

Building energy modeling (BEM) is commonly used to estimate the energy usage of residential buildings. Uses for BEM include calculating home energy ratings, demonstrating compliance with performance-based energy codes, and establishing whether designs meet voluntary program requirements, such as ENERGY STAR® qualified homes. BEM requires simulating subsystems within the building, including storage-type water heaters. To properly simulate the in-situ performance of residential storage water heaters, it is necessary to determine key water heater parameters, including the overall heat loss coefficient (UA) and conversion efficiency (?c) of the water heater, based on the rated efficiency of the water heater. The testing procedure and rating standard for residential water heaters have recently changed: the new rating standard provides a Uniform Energy Factor (UEF) rather than the Energy Factor (EF) used previously. This paper discusses how to derive the necessary model parameters from the ratings data produced from the latest test procedure.

30 DIRECT ENERGY CONVERSION↗
DOE OSTI2021

Incorporating Residential Smart Electric Vehicle Charging in Home Energy Management Systems

Electric vehicles (EVs) are expected to drastically increase residential electricity consumption and could provide a significant source of flexible demand. Aggregating smart EV charge controllers with other smart home devices through a home energy management system can lead to more optimal outcomes that benefit homeowners, utilities, and grid operators. Control strategies should consider occupant convenience by accounting for the need for fully charged EVs near the EV departure time. In this paper, we develop an EV charging framework that accounts for occupant convenience using OCHRE, a residential energy model, and foresee, a home energy management system. We simulate a community with high EV penetration and show that integrated, smart EV charging reduces peak demand and smooths night-time energy consumption. Simulation results show that the proposed control strategy nearly eliminates peak period EV charging and reduces the daily peak demand from EVs by 23%.

ADVANCED PROPULSION SYSTEMS,ENERGY CONSERVATION, C↗
NASA NTRS2018

Recent Developments in the Code RITRACKS (Relativistic Ion Tracks)

The code RITRACKS (Relativistic Ion Tracks) was developed to simulate detailed stochastic radiation track structures of ions of different types and energies. Many new capabilities were added to the code during the recent years. Several options were added to specify the times at which the tracks appear in the irradiated volume, allowing the simulation of dose-rate effects. The code has been used to simulate energy deposition in several targets: spherical, ellipsoidal and cylindrical. More recently, density changes as well as a spherical shell were implemented for spherical targets, in order to simulate energy deposition in walled tissue equivalent proportional counters. RITRACKS is used as a part of the new program BDSTracks (Biological Damage by Stochastic Tracks) to simulate several types of chromosome aberrations in various irradiation conditions. The simulation of damage to various DNA structures (linear and chromatin fiber) by direct and indirect effects has been improved and is ongoing. Many improvements were also made to the graphic user interface (GUI), including the addition of several labels allowing changes of units. A new GUI has been added to display the electron ejection vectors. The parallel calculation capabilities, notably the pre- and post-simulation processing on Windows and Linux machines have been reviewed to make them more portable between different systems. The calculation part is currently maintained in an Atlassian Stash® repository for code tracking and possibly future collaboration.

Plante, Ianik↗
DOE OSTI2018

First-Principles and Thermodynamic Simulation of Elastiс Stress Effect on Energy of Hydrogen Dissolution in Alpha Iron

Mobile hydrogen, when dissolving in metals, redistributes due to the density gradients and elastic stresses, and enables destruction processes or phase transformations in local volumes of a solvent metal. It is rather important in solid state physics to investigate these interactions. The first-principle calculations performed in terms of the density functional theory, are used for thermodynamic simulation of the elastic stress effect on the energy of hydrogen dissolution in α-Fe crystal lattice. The paper presents investigations of the total energy of Fe–H system depending on the lattice parameter. As a result, the relation is obtained between the hydrogen dissolution energy and stress. A good agreement is shown between the existing data and simulation results. The extended equation is suggested for the chemical potential of hydrogen atom in iron within the local stress field. Two parameters affecting the hydrogen distribution are compared, namely local stress and phase transformations.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2016

Coupled wave-packets for non-adiabatic molecular dynamics: a generalization of Gaussian wave-packet dynamics to multiple potential energy surfaces

Accurate simulation of the non-adiabatic dynamics of molecules in excited electronic states is key to understanding molecular photo-physical processes. Here we present a novel method, based on a semiclassical approximation, that is as efficient as the commonly used mean field Ehrenfest or ad hoc surface hopping methods and properly accounts for interference and decoherence effects. This novel method is an extension of Heller's thawed Gaussian wave-packet dynamics that includes coupling between potential energy surfaces. By studying several standard test problems we demonstrate that the accuracy of the method can be systematically improved while maintaining high efficiency. The method is suitable for investigating the role of quantum coherence in the non-adiabatic dynamics of many-atom molecules.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2022

Optimization control technology for building energy conservation

A simulation processor generates and stores a simulation model based on conditions associated with a physical structure, such as a building. A neural network processor implements a neural network, having an input layer coupled to receive sensor data from the structure and having an output layer coupled to supply control signals to the at least one electrically operable environmental control device. The neural network is trained using the simulation model. A particle swarm optimization processor programmed to receive the simulation results and perform particle swarm optimization, ascertains optimal parameters for controlling the at least one electrically operable environmental control device and supplies these optimal parameters to the neural network processor. The neural network processor uses the optimal parameters supplied by the particle swarm optimization processor to further train the neural network.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗
DOE OSTI2020

Dark Energy Studies with LSST using the Photon Simulator (Final Report)

This grant funded the development and dissemination of the Photon Simulator (PhoSim) for the purpose of studying dark energy at high precision with the upcoming Large Synoptic Survey Telescope (LSST) astronomical survey. The work was in collaboration with the Dark Energy Science Collaboration (DESC). Several detailed physics improvements were made in the optics, atmosphere and sensor, a number of validation studies were performed, and a significant number of usability features were implemented. Future work in DESC will use PhoSim as the image simulation tool for data challenges used by the analysis groups.

79 ASTRONOMY AND ASTROPHYSICS↗
NASA NTRS1974

Energy cascade in large-eddy simulations of turbulent fluid flows

The derivation of smoothed or filtered momentum and continuity equations for large-scale, energy-containing eddies is considered. Questions regarding the energy loss of large-scale turbulence are discussed along with aspects of turbulent diffusion of a passive scalar. It is found that the large-scale fluctuations satisfy filtered or averaged momentum and continuity equations. An averaging of the nonlinear advection term yields two terms.

Leonard, A.↗
DOE OSTI2021

Probing High-Pressure Structural Evolution in Polyurea with In Situ Energy-Dispersive X-ray Diffraction and Molecular Dynamics Simulations

Polyurea, an elastomer with a phase-segregated microstructure, has been proven as an effective coating in defense applications. To gain a more complete understanding of the high-pressure atomic-level morphology of these phases and to validate molecular dynamics (MD) simulations, multi-angle energy-dispersive X-ray diffraction experiments were performed in situ up to pressures of ~6 GPa at room temperature. Structure factors were obtained and compared to MD simulations with an average error of less than 5% between major peak positions. The first sharp diffraction peak shifted from 4.56 Å to lower d-spacing with pressure, indicating compression between hard segments. This was further supported by the behavior of a peak at ~3.86 Å from the pair distribution function (PDF), suspected to represent π-stacking and separation between soft segments. Compression within the hard segments themselves is minimal as low-r peaks in the PDF are not greatly affected by pressure.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2014

SU-E-I-67: X-Ray Fluorescence for Energy Response Calibration of a Photon Counting Detector: A Simulation Study

Purpose: To investigate the feasibility of energy calibration and energy response characterization of a photon counting detector using x-ray fluorescence. Methods: A comprehensive Monte Carlo simulation study was done to investigate the influence of various geometric components on the x-ray fluorescence measurement. Different materials, sizes, and detection angles were simulated using Geant4 Application for Tomographic Emission (GATE) Monte Carlo package. Simulations were conducted using 100 kVp tungsten-anode spectra with 2 mm Al filter for a single pixel cadmium telluride (CdTe) detector with 3 × 3 mm2 in detection area. The fluorescence material was placed 300 mm away from both the x-ray source and the detector. For angular dependence measurement, the distance was decreased to 30 mm to reduce the simulation time. Compound materials, containing silver, barium, gadolinium, hafnium, and gold in cylindrical shape, were simulated. The object size varied from 5 to 100 mm in diameter. The angular dependence of fluorescence and scatter were simulated from 20° to 170° with an incremental step of 10° to optimize the fluorescence to scatter ratio. Furthermore, the angular dependence was also experimentally measured using a spectrometer (X-123CdTe, Amptek Inc., MA) to validate the simulation results. Results: The detection angle between 120° to 160° resulted in more optimal x-ray fluorescence to scatter ratio. At a detection angle of 120°, the object size did not have a significant effect on the fluorescence to scatter ratio. The experimental results of fluorescence angular dependence are in good agreement with the simulation results. The Kα and Kβ peaks of five materials could be identified. Conclusion: The simulation results show that the x-ray fluorescence procedure has the potential to be used for detector energy calibration and detector response characteristics by using the optimal system geometry.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗
DOE OSTI2017

Recent Advancements in the Numerical Simulation of Surface Irradiance for Solar Energy Applications: Preprint

This paper briefly reviews the National Renewable Energy Laboratory's recent efforts on developing all-sky solar irradiance models for solar energy applications. The Fast All-sky Radiation Model for Solar applications (FARMS) utilizes the simulation of clear-sky transmittance and reflectance and a parameterization of cloud transmittance and reflectance to rapidly compute broadband irradiances on horizontal surfaces. FARMS delivers accuracy that is comparable to the two-stream approximation, but it is approximately 1,000 times faster. A FARMS-Narrowband Irradiance over Tilted surfaces (FARMS-NIT) has been developed to compute spectral irradiances on photovoltaic (PV) panels in 2002 wavelength bands. Further, FARMS-NIT has been extended for bifacial PV panels.

14 SOLAR ENERGY↗
DOE OSTI2018

Recent Advancements in the Numerical Simulation of Surface Irradiance for Solar Energy Applications

This paper briefly reviews the National Renewable Energy Laboratory's recent efforts to develop all-sky solar irradiance models for solar energy applications. The Fast All-sky Radiation Model for Solar applications (FARMS) uses the simulation of clear-sky transmittance and reflectance and a parameterization of cloud transmittance and reflectance to rapidly compute broadband irradiances on horizontal surfaces. The accuracy of FARMS is comparable to that of two-stream approximation, but it is approximately 1,000 times faster. A FARMS for Narrowband Irradiance over Tilted surfaces (FARMS-NIT) has been developed to compute spectral irradiances on photovoltaic (PV) panels in 2,002 wavelength bands. FARMS-NIT has been extended to bifacial PV panels by accounting for solar radiation reaching the backside of a PV panel.

14 SOLAR ENERGY↗