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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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All sourcesNASA NTRSDOE OSTI
DOE OSTI2023

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

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

Rao, Nageswara↗
DOE OSTI2017

Early implementation of digital upgrades on simulators - 347

An important aspect of successful Nuclear Power Plant (NPP) digital control system upgrade projects is to upgrade the Operator Training Simulator (OTS) or a related Engineering Simulator (ES), prior to installation of the Distributed Control System (DCS) on the plant allowing for early testing of the digital controls/HMI and for early training of the plant operators while maintaining OTS configuration management (i.e. OTS in sync with the plant's current design). Experience has shown that early implementation of digital upgrades on the OTS and/or an ES can reduce plant startup duration (related to digital systems commissioning) and ensure operators are proficient with the new digital systems to ensure safe and reliable plant operation. Including simulators in the design process offers many benefits including early identification of design deficiencies, testing deficiency fixes, developing and validating plant procedures and supporting human factors engineering, to name a few. Implementing digital upgrades on the OTS is also a regulatory requirement driven by the ANSI/ANS-3.5-2009 standard (Nuclear Power Plant Simulators for Use in Operator Training and Examination) if the new DCS affects actions to be taken by the plant operator in the main control room. This paper presents the benefits of implementing digital upgrades on the OTS and/or ES prior to plant implementation. The various simulator implementation strategies (stimulation, emulation, simulation or a hybrid solution) and selection factors are discussed. The paper also covers four (4) case studies demonstrating how digital upgrades can be implemented on simulators. The first case study covers the implementation of a Siemens offgas Programmable Logic Controller (PLC) system on the Enrico Fermi OTS (Michigan). The second case study covers the implementation of a GE main generator excitation system on the Cernavoda OTS (Romania). The third case study covers the implementation of a Siemens main feedwater control system on the Callaway OTS and ES (Missouri). The final case study covers the implementation of the non-safety related and safety related DCS on the Nuclear New Build (NNB) Hongyanhe Phase I dual-purpose OTS/ES (China). (authors)

22 GENERAL STUDIES OF NUCLEAR REACTORS↗
DOE OSTI2026

Irradiation of UC1+x kernels using the MiniFuel vehicle: Microstructure, phase analysis, and initial post-irradiation examination

Uranium carbide is a candidate fuel form for a wide range of advanced reactors, including larger Generation IV reactors as well as small modular reactors and microreactors. However, its commercial deployment timeline faces challenges via traditional qualification approaches. To address this issue, an accelerated fission rate irradiation test was performed to collect basic fuel performance data to inform fuel performance models and potential future integral tests. Hyperstoichiometric UC (UC1+x) kernels were irradiated in the High Flux Isotope Reactor using the MiniFuel irradiation vehicle. The test matrix spanned two temperature regimes (700 °C and 800 °C) and burnup levels (1.8 % FIMA and 2.8 % FIMA). Between 21 and 63 kernels were tested at each unique temperature and burnup condition. As-fabricated microstructural analysis revealed a multiphase composition with UC, UC2, UC2−y, and U-C-O bearing phases for the irradiated kernels. Following irradiation, fission gas release, swelling, and microstructures were analyzed. Measured fission gas release was below 5 % for all irradiation conditions, reaching a maximum at the highest temperature and burnup condition. A binary swelling response was observed; the lower burnup and temperature conditions resulted in negligible swelling, but the higher burnup and temperature conditions produced significant anisotropic swelling and densification in a subset of kernels. The basic microstructural exams of kernels following irradiation were not capable of showing a correlation between kernels that exhibited excessive swelling and those that did not. Characterization of a subset of samples using the Advanced Photon Source and more detailed microstructural examination of unirradiated kernels revealed that a subset of kernels contained very high UC2 phase fractions. The anomalous swelling response is hypothesized to have been driven by this chemical variation. The results of this irradiation highlight the potential of accelerated fission rate irradiation testing to explore such behaviors and inform the development of fuel specifications.

Adorno Lopes, Denise [ORNL] (ORCID:000900023705987↗
DOE OSTI2018

Beam Diagnostic Challenges for FACET-II

FACET-II, the Facility for Advanced Accelerator Experimental Tests II, is a new accelerator R&D test facility to be constructed at SLAC. It will provide high-energy, high-density electron and positron beams to advance the development of beam driven plasma wakefield acceleration and support a broad range of experiments. The FACET-II beams are expected to have 10 GeV energy, contain 2 nC of charge, have a transverse normalized emittance of 7 microns, be compressed to about 1 micron long and focused to about 6 micron wide at the interaction point. Additionally, the nominal peak current is 20 kA and is expected to fluctuate up to 200 kA. Most experiments desire complete knowledge of the incoming beam parameters on a pulse-to-pulse basis. However, the extreme beam densities and strong fields of the beam current will destroy any diagnostics intercepting the beam in a single shot and impose unique challenges for beam diagnostics. Moreover, non-intercepting diagnostics are desirable to provide feedback for machine setup and characterization. Finally, we need to look beyond conventional diagnostics to seek new solutions for measurements of the high charge, small beam size, short bunch length, and low emittance.

43 PARTICLE ACCELERATORS↗
DOE OSTI2022

Validating Synthetic Galaxy Catalogs for Dark Energy Science in the LSST Era

Large simulation efforts are required to provide synthetic galaxy catalogs for ongoing and upcoming cosmology surveys. These extragalactic catalogs are being used for many diverse purposes covering a wide range of scientific topics. In order to be useful, they must offer realistically complex information about the galaxies they contain. Hence, it is critical to implement a rigorous validation procedure that ensures that the simulated galaxy properties faithfully capture observations and delivers an assessment of the level of realism attained by the catalog. We present here a suite of validation tests that have been developed by the Rubin Observatory Legacy Survey of Space and Time (LSST) Dark Energy Science Collaboration (DESC). We discuss how the inclusion of each test is driven by the scientific targets for static ground-based dark energy science and by the availability of suitable validation data. The validation criteria that are used to assess the performance of a catalog are flexible and depend on the science goals. We illustrate the utility of this suite by showing examples for the validation of cosmoDC2, the extragalactic catalog recently released for the LSST DESC second Data Challenge.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2024

Experimental Study for Validation of Resilient Response of Controls - Thrust 2 Controls Assessment

The focus of this project is to design, execute, and analyze experiments around resilience response. As part of the Resilience through Data-Driven, Intelligently Designed Control (RD2C) initiative, this project builds upon the previously designed control algorithms and experiments. It designs detailed uses cases to test RD2C-developed mitigation schemes in specific realistic scenarios, analyze and save the measurement data sets. Having a high-confidence and consistent data set is crucial for identifying relevant metrics to describe the system resilience in specific real-life-like scenarios of power grid operation.

24 POWER TRANSMISSION AND DISTRIBUTION↗
DOE OSTI2017

Testing the Accuracy of Data-driven MHD Simulations of Active Region Evolution

Models for the evolution of the solar coronal magnetic field are vital for understanding solar activity, yet the best measurements of the magnetic field lie at the photosphere, necessitating the development of coronal models which are “data-driven” at the photosphere. We present an investigation to determine the feasibility and accuracy of such methods. Our validation framework uses a simulation of active region (AR) formation, modeling the emergence of magnetic flux from the convection zone to the corona, as a ground-truth data set, to supply both the photospheric information and to perform the validation of the data-driven method. We focus our investigation on how the accuracy of the data-driven model depends on the temporal frequency of the driving data. The Helioseismic and Magnetic Imager on NASA’s Solar Dynamics Observatory produces full-disk vector magnetic field measurements at a 12-minute cadence. Using our framework we show that ARs that emerge over 25 hr can be modeled by the data-driving method with only ∼1% error in the free magnetic energy, assuming the photospheric information is specified every 12 minutes. However, for rapidly evolving features, under-sampling of the dynamics at this cadence leads to a strobe effect, generating large electric currents and incorrect coronal morphology and energies. We derive a sampling condition for the driving cadence based on the evolution of these small-scale features, and show that higher-cadence driving can lead to acceptable errors. Future work will investigate the source of errors associated with deriving plasma variables from the photospheric magnetograms as well as other sources of errors, such as reduced resolution, instrument bias, and noise.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2019

Estimating surface carbon fluxes based on a local ensemble transform Kalman filter with a short assimilation window and a long observation window: an observing system simulation experiment test in GEOS-Chem 10.1

We developed a carbon data assimilation system to estimate surface carbon fluxes using the local ensemble transform Kalman filter (LETKF) and atmospheric transport model GEOS-Chem driven by the MERRA-1 reanalysis of the meteorological field based on the Goddard Earth Observing System model,version 5 (GEOS-5). This assimilation system is inspired by the method of Kang et al. (2011, 2012), who estimated the surface carbon fluxes in an observing system simulation experiment (OSSE) as evolving parameters in the assimilation of the atmospheric CO 2 , using a short assimilation window of 6 h. They included the assimilation of the standard meteorological variables, so that the ensemble provided a measure of the uncertainty in the CO 2 transport. After proposing new techniques such as “variablelocalization”, and increased observation weights near the surface, they obtained accurate surface carbon fluxes at grid-point resolution. We developed a new version of the local ensemble transform Kalman filter related to the “running-in-place”(RIP) method used to accelerate the spin-up of ensemble Kalman filter (EnKF) data assimilation(Kalnay and Yang, 2010; Wang et al., 2013; Yang et al., 2012). Like RIP, the new assimilation system uses the “no cost smoothing” algorithm for the LETKF (Kalnay et al., 2007b), which allows shifting the Kalman filter solution forward or backward within an assimilation window at no cost. In the new scheme a long “observation window” (e.g., 7 d or longer) is used to design a LETKF ensemble at 7 d. Then, the RIP smoother is used to obtain an accurate final analysis at 1 d. This new approach has the advantage of being based on a short assimilation window, which makes it more accurate,and of having been exposed to the future 7 d observations, which improves the analysis and accelerates the spin-up. The assimilation and observation windows are then shifted forward by 1 d, and the process is repeated.This reduces significantly the analysis error, suggesting that the newly developed assimilation method can be used with other Earth system models,especially in order to make greater use of observations in conjunction with models.

58 GEOSCIENCES↗
DOE OSTI2017

Dynamics of simulated Atlantic upwelling annual cycle in CMIP5 models

As one of the prominent climatic component of tropical climate system, the annual cycle of the equatorial Atlantic cold tongue region has been a subject of significant research. In this work, we examine the fidelity of the key part of the annual cycles, namely, the upwelling annual cycles, from the simulations of the Coupled Model Intercomparison Project Phase 5 (CMIP5). Utilizing the simple framework we have recently developed based on the Zebiak–Cane (ZC) ocean model, we first tested the validity of the simple framework of upwelling as a combination of the local wind–driven Ekman upwelling and nonlocal wind–driven wave upwelling. It is demonstrated that the theoretically reconstructed upwelling annual cycles to large extent are in good agreement with the simulations in these coupled climatic models. Comparing with observations, we show that the semiannual component of the upwelling is systematically too strong. This significant bias is attributable to the dynamic amplification to the wind–driven wave upwelling originated from a less significant bias in the semiannual harmonic component in the central equatorial wind field. The latter is dynamically amplified in the wind–driven wave upwelling owing to its relatively fast time scale. Furthermore, the realistic simulations of equatorial annual cycles may sensitively depend on good simulations of the semiannual harmonic components in equatorial wind fields.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2017

Warming Up Density Functional Theory [Book Chapter]

Density functional theory (DFT) has become the most popular approach to electronic structure across disciplines, especially in material and chemical sciences. In 2016, at least 30,000 papers used DFT to make useful predictions or give insight into an enormous diversity of scientific problems, ranging from battery development to solar cell efficiency and far beyond. The success of this field has been driven by usefully accurate approximations based on known exact conditions and careful testing and validation. In the last decade, applications of DFT in a new area, warm dense matter, have exploded. DFT is revolutionizing simulations of warm dense matter including applications in controlled fusion, planetary interiors, and other areas of high energy density physics. Over the past decade or so, molecular dynamics calculations driven by modern density functional theory have played a crucial role in bringing chemical realism to these applications, often (but not always) in excellent agreement with experiment. This chapter summarizes recent work from our group on density functional theory at nonzero temperatures, which we call thermal DFT. We explain the relevance of this work in the context of warm dense matter, and the importance of quantum chemistry to this regime. We illustrate many basic concepts on a simple model system, the asymmetric Hubbard dimer.

36 MATERIALS SCIENCE↗
DOE OSTI2021

FHOD formin and SRF promote post-embryonic striated muscle growth through separate pathways in C. elegans

Highlights: • Reduced SRF or formin FHOD-1 activity similarly inhibit muscle growth in worms. • Formin does not promote worm SRF-dependent muscle gene transcription. • Proteasome-driven myosin proteolysis is increased in worm muscle lacking formin. Previous work with cultured cells has shown transcription of muscle genes by serum response factor (SRF) can be stimulated by actin polymerization driven by proteins of the formin family. However, it is not clear if endogenous formins similarly promote SRF-dependent transcription during muscle development in vivo. We tested whether formin activity promotes SRF-dependent transcription in striated muscle in the simple animal model, Caenorhabditis elegans. Our lab has shown FHOD-1 is the only formin that directly promotes sarcomere formation in the worm's striated muscle. We show here FHOD-1 and SRF homolog UNC-120 both support muscle growth and also muscle myosin II heavy chain A expression. However, while a hypomorphic unc-120 allele blunts expression of a set of striated muscle genes, these genes are largely upregulated or unchanged by absence of FHOD-1. Instead, pharmacological inhibition of the proteasome restores myosin protein levels in worms lacking FHOD-1, suggesting elevated proteolysis accounts for their myosin deficit. Interestingly, proteasome inhibition does not restore normal muscle growth to fhod-1(Δ) mutants, suggesting formin contributes to muscle growth by some alternative mechanism. Overall, we find SRF does not depend on formin to promote muscle gene transcription in a simple in vivo system.

60 APPLIED LIFE SCIENCES↗
DOE OSTI2016

Deep view of the Large Magellanic Cloud with six years of Fermi -LAT observations

Context. The nearby Large Magellanic Cloud (LMC) provides a rare opportunity of a spatially resolved view of an external star-forming galaxy in -rays. The LMC was detected at 0.1–100 GeV as an extended source with CGRO/EGRET and using early observations with the Fermi-LAT. The emission was found to correlate with massive star-forming regions and to be particularly bright towards 30 Doradus. Aims. Studies of the origin and transport of cosmic rays (CRs) in the Milky Way are frequently hampered by line-of-sight confusion and poor distance determination. The LMC offers a complementary way to address these questions by revealing whether and how the -ray emission is connected to specific objects, populations of objects, and structures in the galaxy. Methods. We revisited the -ray emission from the LMC using about 73 months of Fermi-LAT P7REP data in the 0.2–100 GeV range. We developed a complete spatial and spectral model of the LMC emission, for which we tested several approaches: a simple geometrical description, template-fitting, and a physically driven model for CR-induced interstellar emission. Results. In addition to identifying PSR J0540-6919 through its pulsations, we find two hard sources positionally coincident with plerion N 157B and supernova remnant N 132D, which were also detected at TeV energies with H.E.S.S. We detect an additional soft source that is currently unidentified. Extended emission dominates the total flux from the LMC. It consists of an extended component of about the size of the galaxy and additional emission from three to four regions with degree-scale sizes. If it is interpreted as CRs interacting with interstellar gas, the large-scale emission implies a large-scale population of ~1–100GeV CRs with a density of ~30% of the local Galactic value. On top of that, the three to four small-scale emission regions would correspond to enhancements of the CR density by factors 2 to 6 or higher, possibly more energetic and younger populations of CRs compared to the large-scale population. An alternative explanation is that this is emission from an unresolved population of at least two dozen objects, such as pulsars and their nebulae or supernova remnants. This small-scale extended emission has a spatial distribution that does not clearly correlate with known components of the LMC, except for a possible relation to cavities and supergiant shells. Conclusions. The Fermi-LAT GeV observations allowed us to detect individual sources in the LMC. Three of the newly discovered sources are associated with rare and extreme objects. The 30 Doradus region is prominent in GeV -rays because PSR J0540-6919 and N 157B are strong emitters. The extended emission from the galaxy has an unexpected spatial distribution, and observations at higher energies and in radio may help to clarify its origin. Key words. Gamma

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2018

Broadband anti-reflective coatings for cosmic microwave background experiments

The desire for higher sensitivity has driven ground-based cosmic microwave background (CMB) experiments to employ ever larger focal planes, which in turn require larger reimaging optics. Practical limits to the maximum size of these optics motivates the development of quasi-optically-coupled (lenslet-coupled), multi-chroic detectors. These detectors can be sensitive across a broader bandwidth compared to waveguide-coupled detectors. However, the increase in bandwidth comes at a cost: the lenses (up to ~700 mm diameter) and lenslets (~5 mm diameter, hemispherical lenses on the focal plane) used in these systems are made from high-refractive-index materials (such as silicon or amorphous aluminum oxide) that reflect nearly a third of the incident radiation. In order to maximize the faint CMB signal that reaches the detectors, the lenses and lenslets must be coated with an anti-reflective (AR) material. The AR coating must maximize radiation transmission in scientifically interesting bands and be cryogenically stable. Such a coating was developed for the third generation camera, SPT-3G, of the South Pole Telescope (SPT) experiment, but the materials and techniques used in the development are general to AR coatings for mm-wave optics. The three-layer polytetra uoroethylene-based AR coating is broadband, inexpensive, and can be manufactured with simple tools. The coating is field tested; AR coated focal plane elements were deployed in the 2016-2017 austral summer and AR coated reimaging optics were deployed in 2017-2018.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗
DOE OSTI2018

An Observation Data Driven Simulation and Analysis Framework for Early Stage C. elegans Embryogenesis

Recent developments in cutting-edge live microscopy and image analysis provide a unique opportunity to systematically investigate individual cell’s dynamics as well as simulation-based hypothesis testing. After a summary of data generation and analysis in the observation and modeling efforts related to C. elegans embryogenesis, we develop a systematic approach to model the basic behaviors of individual cells. Next, we present our ideas to model cell fate, division, and movement using 3D time-lapse images within an agent-based modeling framework. Then, we summarize preliminary result and discuss efforts in cell fate, division, and movement modeling. Finally, we discuss the ongoing efforts and future directions for C. elegans embryo modeling, including an inferred developmental landscape for cell fate, a quasi-equilibrium model for cell division, and multi-agent, deep reinforcement learning for cell movement.

3D live images↗
DOE OSTI2023

Double Diffusion Maps and their Latent Harmonics for scientific computations in latent space

In this work, we introduce a data-driven approach to building reduced dynamical models through manifold learning; the reduced latent space is discovered using Diffusion Maps (a manifold learning technique) on time series data. A second round of Diffusion Maps on those latent coordinates allows the approximation of the reduced dynamical models. This second round enables mapping the latent space coordinates back to the full ambient space (what is called lifting); it also enables the approximation of full state functions of interest in terms of the reduced coordinates. In our work, we develop and test three different reduced numerical simulation methodologies, either through pre-tabulation in the latent space and integration on the fly or by going back and forth between the ambient space and the latent space. The data-driven latent space simulation results, based on the three different approaches, are validated through (a) the latent space observation of the full simulation through the Nyström Extension formula, or through (b) lifting the reduced trajectory back to the full ambient space, via Latent Harmonics. Latent space modeling often involves additional regularization to favor certain properties of the space over others, and the mapping back to the ambient space is then constructed mostly independently from these properties; here, we use the same data-driven approach to construct the latent space and then map back to the ambient space.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2018

Wind turbine sensor array for monitoring avian and bat collisions

Assessment of avian and bat collisions with wind turbines is necessary to ensure that the benefits of renewable wind power generation are not outweighed by mortality of protected species. An onboard, integrated multisensor system capable of providing detection of turbine collision events, including taxonomic information, was developed. The conceptual design of a multisensor system including a vibration sensing node, an optics node, and an bioacoustic node with an event–driven trigger architecture was field–tested on utility–scale wind turbines. A pixel density computational model was built to estimate the spatial coverage and target resolution to the optimized configuration for camera placement. Field test results of the vibration node showed that nearly half of the recorded impact events were successfully identified by visual inspection and running short–time Fourier transform on recorded vibration signals. The remaining undetected impact events were masked under background noise due to low impact energy and high background noise of the operating turbine, which result in subsequent low signal–to–noise ratio. Furthermore, our results demonstrate the feasibility of triggering the system through single impact event sensed by vibration sensors.

17 WIND ENERGY↗
DOE OSTI2022

Demonstration of photoreactor platform for on-sun unassisted photoelectrochemical hydrogen generation with tandem III–V photoelectrodes

Photoelectrochemical (PEC) water splitting is a direct solar-driven technology that converts solar energy to storable chemical energy in the form of hydrogen. In addition to semiconductor and catalyst development for improved photoelectrodes, designing reactors for testing and operation of PEC systems under inherently dynamic outdoor solar illumination is necessary to further the commercial viability of PEC technology. Herein, we present a versatile photoreactor system mounted on a solar tracker for outdoor PEC testing and demonstrate unassisted PEC water splitting under real world on-sun conditions. GaInP 2 /GaAs tandem absorber photoelectrodes with a MoS 2 catalyst were fabricated and exhibit >8% solar-to-hydrogen efficiency. On-sun efficiency and stability of the photoelectrodes were characterized on both sunny and partly cloudy days with continuous monitoring of insolation and weather conditions. Furthermore, the versatile photoreactor and outdoor PEC testing capabilities and methods presented here can accelerate the development of other solar fuel generating systems and technologies.

solar fuels↗
DOE OSTI2019

A Data-driven Control Method for Operating the Commercial HVAC Load as a Virtual Battery

Building loads have a great potential to provide ancillary services because of its large power consumption. In order to quantify their flexibility, methods of modeling building loads as virtual battery (VB) have been proposed. The VB model provides an effective way to coordinate building loads and energy storage systems together when providing service to grid. However, after grid send a power signal to VB, the control strategy has not been fully studied to let building consumes this desired amount of power yet. This paper introduces a method to control commercial heating, ventilation, and air conditioning (HVAC) system. First, the thermal model of commercial building is introduced. We then used several data-driven models to approximate this thermal dynamic and the operation of different HVAC components. Base on these data-driven models, we developed a centralized control algorithm to utilize HVAC system consuming the desired amount of power. Finally, we modeled a realistic commercial building in EnergyPlus to test the performance of this proposed control algorithm

Wang, Jiyu↗