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At least 217 records · Page 12

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NASA NTRS1992

A numerical investigation of East Coast cyclogenesis during the cold-air damming event of 27-28 February 1982. II - Importance of physical mechanisms

This study presents a series of numerical experiments designed to examine the role of several physical processes on the evolution of and interaction between atmospheric phenomena having different scales, each of which contributed to the development of the storm of February 27-28, 1982 along a Carolina coastal front. The physical processes include: the role of diabatic heating associated with convective and grid-scale precipitation, the role of a thermally direct transverse circulation about the entrance region of a strong polar jet streak, and modification of the marine planetary boundary layer by fluxes of heat and moisture over the Gulf Stream. The diabatic heating associated with precipitation is found to have the most significant impact on storm development. Without latent heating, cyclogenesis does not occur along the Carolina coastal front despite the presence of strong low-level baroclinicity and cyclonic vorticity. A less dramatic but still important relationship is found between storm formation and the other two physical mechanisms.

Lapenta, William M.↗

DOE OSTI2024

Value of abstraction in performance assessment – When is a higher level of detail necessary?

In this study, different approaches in performance assessment (PA) of the long-term safety of a repository for radioactive waste were examined. This investigation was carried out as part of the DECOVALEX-2023 project, an international collaborative effort for research and model comparison. One specific task of the DECOVALEX-2023 project was the Salt Performance Assessment Modelling task (Salt PA), which aimed at comparing various models and methods employed in the performance assessment of deep geological repositories in salt. In the context of the Salt PA task, three distinct teams from SNL (United States), Quintessa Ltd (United Kingdom), and GRS (Germany) examined the consequences of employing different levels of abstractions when modelling the repository's geometry and implementing various features and processes, using the example of a simple hypothetical repository structure in domal salt. Each team applied their own tools: PFLOTRAN (SNL), QPAC (Quintessa) and LOPOS (GRS). These differ essentially regarding numerical concept and degree of detail in the representation of the underlying physical processes. The discussion focused on when simplifications can be appropriately applied and what consequences result from them. Furthermore, it was explored when and if a higher level of fidelity in geometry or physical processes is required.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

DOE OSTI2021

AMReX: Block-structured adaptive mesh refinement for multiphysics applications

Block-structured adaptive mesh refinement (AMR) provides the basis for the temporal and spatial discretization strategy for a number of Exascale Computing Project applications in the areas of accelerator design, additive manufacturing, astrophysics, combustion, cosmology, multiphase flow, and wind plant modeling. AMReX is a software framework that provides a unified infrastructure with the functionality needed for these and other AMR applications to be able to effectively and efficiently utilize machines from laptops to exascale architectures. AMR reduces the computational cost and memory footprint compared to a uniform mesh while preserving accurate descriptions of different physical processes in complex multiphysics algorithms. AMReX supports algorithms that solve systems of partial differential equations in simple or complex geometries and those that use particles and/or particle–mesh operations to represent component physical processes. In this article, we will discuss the core elements of the AMReX framework such as data containers and iterators as well as several specialized operations to meet the needs of the application projects. In addition, we will highlight the strategy that the AMReX team is pursuing to achieve highly performant code across a range of accelerator-based architectures for a variety of different applications.

Zhang, Weiqun↗

NASA NTRS1980

Methods for Monte Carlo simulation of the exospheres of the moon and Mercury

A general form of the integral equation of exospheric transport on moon-like bodies is derived in a form that permits arbitrary specification of time varying physical processes affecting atom creation and annihilation, atom-regolith collisions, adsorption and desorption, and nonplanetocentric acceleration. Because these processes usually defy analytic representation, the Monte Carlo method of solution of the transport equation, the only viable alternative, is described in detail, with separate discussions of the methods of specification of physical processes as probabalistic functions. Proof of the validity of the Monte Carlo exosphere simulation method is provided in the form of a comparison of analytic and Monte Carlo solutions to three classical, and analytically tractable, exosphere problems. One of the key phenomena in moonlike exosphere simulations, the distribution of velocities of the atoms leaving a regolith, depends mainly on the nature of collisions of free atoms with rocks. It is shown that on the moon and Mercury, elastic collisions of helium atoms with a Maxwellian distribution of vibrating, bound atoms produce a nearly Maxwellian distribution of helium velocities, despite the absence of speeds in excess of escape in the impinging helium velocity distribution.

Hodges, R. R., Jr.↗

DOE OSTI2024

Synthesis, Processing, and Use of Isotopically Enriched Epitaxial Oxide Thin Films

Isotopic engineering has emerged as a key approach to study the nucleation, diffusion, phase transitions, and reactions of materials at an atomic level. It aims to uncover mass transport pathways, kinetics, and operational and failure mechanisms of functional materials and devices. Understanding these phenomena leads to deeper insights into important physical processes, such as the transport of ions in energy conversion and storage devices and the role of active sites and supports during heterogeneous catalytic reactions. Likewise, isotopic engineering is being pursued as a means of modifying functionality to enable future technological applications. In this Account, we summarize our recent work employing isotope labeling (e.g., 18 O 2 and 57 Fe) during thin film synthesis and postgrowth processing to reveal growth mechanisms, defect chemistry, and elemental diffusion under working and extreme conditions. Isotope-resolved analysis techniques with nanometer-scale spatial resolution, such as time-of-flight secondary ion mass spectrometry and atom probe tomography, facilitate the accurate quantification of isotopic placement and concentration in our well-defined heterostructures with precisely positioned, isotope-enriched layers. By measuring the nanometer-scale redistribution between natural abundance and isotopically enriched oxygen layers during the deposition of Fe 2 O 3 and Cr 2 O 3 by molecular beam epitaxy, we identified intermixing processes driven by surface adatoms occurring both at the film growth surface and within the first few layers below the surface. Further insights into synthesis mechanisms were gained by studying the tungsten oxide thin films grown by evaporating WO 3 powder in the presence of background 18 O 2 , revealing minimal incorporation of background oxygen during the film formation process. Thermal and radiation-enhanced diffusion in epitaxial Fe and Cr oxides were precisely tracked using 18 O and 57 Fe tracer layers incorporated into model epitaxial oxide thin films. This approach has allowed us to access thermal diffusion behavior at lower temperatures than previously measured, revealing a potential changeover in diffusion mechanism. Understanding radiation-enhanced diffusion in model oxides that represent the surface layers on the structural components of nuclear reactors informs our understanding of their corrosion behavior under irradiation. Isotopic labeling can also provide unique insights into the surface exchange reactions and defect chemistry of electrocatalysts. For instance, tracking the change in 18 O concentration at the surface of an epitaxial LaNiO 3 thin film after the electrocatalytic oxygen evolution reaction revealed the participation of lattice oxygen, confirming a hypothesis that had been proposed previously. Lastly, we highlight a new direction wherein we perform in situ processing studies utilizing isotopic tracers in conjunction with model epitaxial thin films within the atom probe tomography instrument. Additionally, this Account illustrates the great potential of isotopic engineering to enable fundamental mechanistic insights into physical processes and engineer functional properties in epitaxial films, heterostructures, and superlattices.

36 MATERIALS SCIENCE↗

NASA NTRS1986

The synchrotron-maser theory of type II solar radio emission processes - The physical model and generation mechanism

A theory is proposed to explain the generation mechanism of type II solar radio bursts. It is suggested that the shock wave formed at the leading edge of a coronal transient can accelerate electrons. Because of the nature of the acceleration process, the energized electrons can possess a 'hollow-beam' type distribution function. When the electron beam propagates along the ambient magnetic field to lower altitudes and attains larger pitch angles, a synchrotron-maser instability can set in. This instability leads to the amplification of unpolarized or weakly polarized radiation. The present discussion incorporates a model which describes the ambient magnetic field and background plasma by means of MHD simulation. The potential emission regions may be located approximately, according to the time-dependent MHD simulation. Since the average local plasma frequency in the source region can be evaluated from the MHD model, the frequent drift associated with the radiation may be estimated. The result seems to be in good agreement with that derived from observations.

Wu, C. S.↗

DOE OSTI2022

A Dataset of 3D Structural and Simulated Transport Properties of Complex Porous Media

Physical processes that occur within porous materials have wide-ranging applications including - but not limited to - carbon sequestration, battery technology, membranes, oil and gas, geothermal energy, nuclear waste disposal, water resource management. The equations that describe these physical processes have been studied extensively; however, approximating them numerically requires immense computational resources due to the complex behavior that arises from the geometrically-intricate solid boundary conditions in porous materials. Here, we introduce a new dataset of unprecedented scale and breadth, DRP-372: a catalog of 3D geometries, simulation results, and structural properties of samples hosted on the Digital Rocks Portal. The dataset includes 1736 flow and electrical simulation results on 217 samples, which required more than 500 core years of computation. This data can be used for many purposes, such as constructing empirical models, validating new simulation codes, and developing machine learning algorithms that closely match the extensive purely-physical simulation. This article offers a detailed description of the contents of the dataset including the data collection, simulation schemes, and data validation.

3D images↗

NASA NTRS2001

Global MHD Models of the Solar Corona

Global magnetohydrodynamic (MHD) models of the solar corona are computationally intensive, numerically complex simulations that have produced important new results over the past few years. After a brief overview of how these models usually work, I will address three topics: (1) How these models are now routinely used to predict the morphology of the corona and analyze Earth and space-based remote observations of the Sun; (2) The direct application of these models to the analysis of physical processes in the corona and chromosphere and to the interpretation of in situ solar wind observations; and (3) The use of results from global models to validate the approximations used to make detailed studies of physical processes in the corona that are not otherwise possible using the global models themselves.

Suess, S. T.↗

NASA NTRS2004

The Goddard Profiling Algorithm (GPROF): Description and Current Applications

Atmospheric scientists use different methods for interpreting satellite data. In the early days of satellite meteorology, the analysis of cloud pictures from satellites was primarily subjective. As computer technology improved, satellite pictures could be processed digitally, and mathematical algorithms were developed and applied to the digital images in different wavelength bands to extract information about the atmosphere in an objective way. The kind of mathematical algorithm one applies to satellite data may depend on the complexity of the physical processes that lead to the observed image, and how much information is contained in the satellite images both spatially and at different wavelengths. Imagery from satellite-borne passive microwave radiometers has limited horizontal resolution, and the observed microwave radiances are the result of complex physical processes that are not easily modeled. For this reason, a type of algorithm called a Bayesian estimation method is utilized to interpret passive microwave imagery in an objective, yet computationally efficient manner.

Olson, William S.↗

DOE OSTI2023

Understanding the Mechanisms of Self-Organization in Atmospheric Pressure DC Glows

One of the most challenging areas in atmospheric pressure plasmas is controlling uniformity and contact area. Indeed it is this problem which is closely related to scale up that has impeded the widespread applications of these plasmas. The atmospheric pressure plasma glow is a type of atmospheric pressure discharge akin to a traditional low pressure glow particularly when compared with discharge morphology. But this is where the similarities end. Unlike low pressure glows, atmospheric pressure glows do not rely on electrode processes such as secondary electron emission to make the discharge self-sustaining, rather the discharge is sustained by typically processes such as the presence of a resistive layer or through favorable atomic collisional processes such as that which prevail in helium that stabilizes the discharge so that the thermal instability is mitigated. These discharges can feature either solid metal electrodes or geometries where at least one electrode is a liquid water electrolyte. Regardless of the implementation, DC 1 Atm glows are fascinating in that the plasma attachment under certain conditions can self-organize. The attachment surface area therefore changes as a result. Therefore, self-organization could be the key to optimizing plasma contact area and thereby open the door to applications in the real world. The plasma physical processes prevailing at the surface where the self-organization takes place remain largely unexplored. There is very little published research on the conditions that prevail at the surface and virtually no scholarship on measured plasma parameters of the self-organized attachments themselves or the surface electric field. This effort breaks new ground by elucidating these largely unexplored physical processes.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

NASA NTRS1993

CFD Analysis of Spray Combustion and Radiation in OMV Thrust Chamber

The Variable Thrust Engine (VTE), developed by TRW, for the Orbit Maneuvering Vehicle (OMV) uses a hypergolic propellant combination of Monomethyl Hydrazine (MMH) and Nitrogen Tetroxide (NTO) as fuel and oxidizer, respectively. The propellants are pressure fed into the combustion chamber through a single pintle injection element. The performance of this engine is dependent on the pintle geometry and a number of complex physical phenomena and their mutual interactions. The most important among these are (1) atomization of the liquid jets into fine droplets; (2) the motion of these droplets in the gas field; (3) vaporization of the droplets (4) turbulent mixing of the fuel and oxidizer; and (5) hypergolic reaction between MMH and NTO. Each of the above phenomena by itself poses a considerable challenge to the technical community. In a reactive flow field of the kind occurring inside the VTE, the mutual interactions between these physical processes tend to further complicate the analysis. The objective of this work is to develop a comprehensive mathematical modeling methodology to analyze the flow field within the VTE. Using this model, the effect of flow parameters on various physical processes such as atomization, spray dynamics, combustion, and radiation is studied. This information can then be used to optimize design parameters and thus improve the performance of the engine. The REFLEQS CFD Code is used for solving the fluid dynamic equations. The spray dynamics is modeled using the Eulerian-Lagrangian approach. The discrete ordinate method with 12 ordinate directions is used to predict the radiative heat transfer in the OMV combustion chamber, nozzle, and the heat shield. The hypergolic reaction between MMH and NTO is predicted using an equilibrium chemistry model with 13 species. The results indicate that mixing and combustion is very sensitive to the droplet size. Smaller droplets evaporate faster than bigger droplets, leading to a well mixed zone in the combustion chamber. The radiative heat flux at combustion chamber and nozzle walls are an order of negligible less than the conductive heat flux. Simulations performed with the heat shield show that a negligible amount of fluid is entrained into the heat shield region. However, the heat shield is shown to be effective in protecting the OMV structure surrounding the engine from the radiated heat.

Giridharan, M. G.↗

NASA NTRS1993

A modeling study of marine boundary layer clouds

Marine boundary layer (MBL) clouds are important components of the earth's climate system. These clouds drastically reduce the amount of solar radiation absorbed by the earth, but have little effect on the emitted infrared radiation on top of the atmosphere. In addition, these clouds are intimately involved in regulating boundary layer turbulent fluxes. For these reasons, it is important that general circulation models used for climate studies must realistically simulate the global distribution of the MBL. While the importance of these cloud systems is well recognized, many physical processes involved in these clouds are poorly understood and their representation in large-scale models remains an unresolved problem. The present research aims at the development and improvement of the parameterization of these cloud systems and an understanding of physical processes involved. This goal is addressed in two ways. One is to use regional modeling approach to validate and evaluate two-layer marine boundary layer models using satellite and ground-truth observations; the other is to combine this simple model with a high-order turbulence closure model to study the transition processes from stratocumulus to shallow cumulus clouds. Progress made in this effort is presented.

Wang, Shouping↗

NASA NTRS1994

Low-frequency oscillations in radiative-convective systems

Although eastward propagation has long been considered one of the essential features of the Madden-Julian waves, recent observations have revealed a stationary or quasi-stationary component in the oscillations, particularly in measures of the diabatic heating rate. Wave-CISK theories of the low-frequency oscillations have struggled to explain the observed period and vertical structure of the waves. On the other hand, theoretical and numerical studies have shown that low-frequency waves strongly resembling the observed oscillations can be excited by specified low-frequency oscillations of the convective heating. A problem with the latter set of theories is that the cause of the oscillatory heating has not been satisfactorily explained. It is proposed here that the observed low-frequency wave motions are the response to forcing by an essentially stationary, self-excited oscillating heat source that is produced by nonlinear interactions among radiation, cumulus convection, and the surface fluxes of sensible heat and moisture. Feedback of the large-scale motions on the latent heating is not required. Results from two very different one-dimensional models are presented to support this hypothesis. The physical processes included in the models are essentially the same, that is, radiation, cumulus convection, and the surface fluxes of sensible heat and moisture; the first model is highly simplified, however, while the second includes relatively sophisticated parameterizations of all the relevant physical processes. Results from both models show low-frequency oscillations of the latent heating, temperature, and moisture. Experiments show that the oscillations are favored by a warm sea surface and weak surface wind speeds, consistent with the observed conditions over the Indian Ocean and the tropical western Pacific Ocean.

Hu, QI↗

DOE OSTI2023

Department of Energy’s Atmospheric System Research (ASR) Program’s Workshop on the Future of Atmospheric Large Eddy Simulation (LES) (Workshop Report)

Large-eddy simulation (LES) is used as a tool to understand physical processes such as turbulence, aerosols, clouds, precipitation, radiation, the interactions among all these, and their interactions with the underlying surface. Over the next 10 years, LES will drive fundamental progress in open scientific questions in these areas as LES is increasingly used to gain understanding of complex interacting physical processes involving atmospheric turbulence. This growth will be driven both by scientific demand and the expansion of computational resources needed to conduct LES, and the form that the growth takes will largely be determined by how computational resources are leveraged for scientific gain. In particular, we suggest that computational resources are likely to be leveraged in two separate but not necessarily distinct ways. On one hand, growth in computational resources will allow LES to be made more routine, that is, performed more frequently, while on the other hand, the computational expense (measured in total floating point operations) afforded to individual LES will expand dramatically, allowing simulations to increase in both domain size and resolution as well as physical detail. Current U.S. Department of Energy (DOE) projects such as LES ARM Symbiotic Simulation and Observation Activity (LASSO) are leading the way in conducting routine LES, building large, public databases that are accessible for data science, sensitivity studies, and training for machine learning. LES will also become more routine as it becomes more accessible for individual researchers to address their scientific questions of interest. Scientific questions addressed by LES over the next 10 years are likely to include cloud organization and aggregation; aerosol cloud interactions and atmospheric chemistry (including geo-engineering); urban-scale LES; atmospheric extreme events, ranging from small-scale severe weather to wildfires; and ocean-wave-atmosphere interactions. Further LES-related research will likely grow significantly in areas related to societal impact studies of air quality and extreme weather events, applications to renewable energy forecasting and resource assessment, and aid in decision-making processes.

54 ENVIRONMENTAL SCIENCES↗

DOE OSTI2022

A gradient-based deep neural network model for simulating multiphase flow in porous media

We report simulation of multiphase flow in porous media is crucial for the effective management of subsurface energy and environment-related activities. The numerical simulators used for modeling such processes rely on spatial and temporal discretization of the governing mass and energy balance partial-differential equations (PDEs) into algebraic systems via finite-difference/volume/element methods. These simulators usually require dedicated software development and maintenance, and suffer low efficiency from a runtime and memory standpoint for problems with multi-scale heterogeneity, coupled-physics processes or fluids with complex phase behavior. Therefore, developing cost-effective, data-driven models can become a practical choice, and in this work, we choose deep learning approaches as they can handle high dimensional data and accurately predict state variables with strong nonlinearity. In this paper, we describe a gradient-based deep neural network (GDNN) constrained by the physics related to multiphase flow in porous media. We tackle the nonlinearity of flow in porous media induced by rock heterogeneity, fluid properties, and fluid-rock interactions by decomposing the nonlinear PDEs into a dictionary of elementary differential operators. We use a combination of operators to handle rock spatial heterogeneity and fluid flow by advection. Since the augmented differential operators are inherently related to the physics of fluid flow, we treat them as first principles prior knowledge to regularize the GDNN training. We use the example of pressure management at geologic CO 2 storage sites, where CO 2 is injected in saline aquifers and brine is produced, and apply GDNN to construct a predictive model that is trained with physics-based simulation data and emulates the physics process. We demonstrate that GDNN can effectively predict the nonlinear patterns of subsurface responses, including the temporal and spatial evolution of the pressure and saturation plumes. We also successfully extend the GDNN to convolutional neural network (CNN), namely gradient-based CNN (GCNN), and validate its capability to improve the prediction accuracy. GDNN has great potential to tackle challenging problems that are governed by highly nonlinear physics and enable the development of data-driven models with higher fidelity.

42 ENGINEERING↗

NASA NTRS1992

Pioneer 10 and 11 interstellar studies

The Pioneer 10 spacecraft may soon be the first man-made object to leave our solar system and penetrate the heliospheric boundary into interstellar space. Scientific investigators on this mission eagerly anticipate the opportunity to measure the physical processes occurring in the terminal boundary region and in the unexplored space known as the interstellar medium by astronomers who have studied it remotely with telescopes for many years. This paper is a descriptive overview of the Pioneer 10 mission and the dominant physical processes that have been discovered since its 1972 launch into our heliosphere and those processes that we expect to see at the boundary and in the interstellar medium.

Dyal, P.↗

DOE OSTI2023

Department of Energy’s Atmospheric System Research (ASR) Program’s Workshop on the Future of Atmospheric Large Eddy Simulation (LES) (Workshop Report)

54 ENVIRONMENTAL SCIENCES↗

NASA NTRS2002

The Reanalysis for Stratospheric Trace-gas Studies

In order to re-examine trace gas transport in the middle atmosphere for the period May 1991 until April 1995, a "reanalysis" is being performed using an up-to-date version of the DAO's "GEOS" assimilation system. The Reanalysis for Stratospheric Trace-gas Studies (ReSTS) is intended to provide state-of-the-art estimates of the atmosphere during a period when the Upper Atmospheric Research Satellite provided a high density of trace-gas observations, and when the aerosol loading from the eruption of Mount Pinatubo contaminated the lower stratosphere, at the same time performing a natural tracer transport experiment. This study will present the first results from ReSTS, focussing on the improvements over the meteorological analyses produced by the then-operational GEOS-1 data assimilation system; emphasis will be placed on the improved representations of physical processes between GEOS-1 and the current GEOS-4 systems, highlighting the transport properties of the datasets. Alongside the production of a comprehensive atmospheric dataset, important components of ReSTS include performing sensitivity studies to the formulation of the assimilation system (including the representation of physical processes in the GCM, such as feedbacks between ozone/aerosols and meteorology) and to the inclusion of additional data types (including limb-sounding temperature data alongside the TOVS observations). Impacts of some of these factors on the analyzed meteorology and transport will be discussed. Of particular interest are attempts to determine the relative importance of various steps in the assimilation process to the quality of the final analyses.

Pawson, Steven↗