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At least 235 records · Page 13

CFD Simulation of Biomass Pyrolysis Vapor Upgrading over a Pt/TiO 2 Catalyst in Fixed and Moving Beds

This report presents a comprehensive computational fluid dynamics (CFD) study of the biomass pyrolysis vapor phase upgrading and the catalyst regeneration in different reactors under various operational conditions. This study used the open-source software Multiphase Flow with Interphase eXchanges (MFiX), developed at National Energy Technology Laboratory (NETL) for simulating hydrodynamics, heat transfer, and chemical reactions in multiphase systems. This simulation solved the conservation of mass, momentum, energy, species for gas and solid phases with chemical reactions.

09 BIOMASS FUELS↗

Prediction of propellant behavior in spinning flow of a space motor

A model for 2-phase flow dynamics in a spinning spherical rocket motor, developed for the Ofeq satellite program, is based on the sectional approach to solution of the flow equations. An experimental model was built, to enable the motion of the aluminum/aluminum-oxide particles resulting from combustion within a solid-fuel motor to be simulated by injected paraffin droplets. The injected droplets included under-5 micrometer droplets which move with the gas stream and larger droplets, averaging 20 micrometer diameter, which simulate the motion of aluminum particles. The test chamber comprised a pair of cylindrical pyrex tubes with a sharp contraction in diameter, rotated at various speeds by a frequency-controllable motor. An optical system, based on a 5 W argon ion laser with a beam splitter and frequency shifter, mounted on a movable table, facilitated sectional measurements of the three velocity components and determination of size-velocity relationships. Preliminary results indicate that the effect of rotation on axial velocity is negligible, while its effect on tangential velocity approximates to solid-body rotation.

Gany, A.↗

Atmospheric Trace Gas Abundances and Stable Isotope Ratios via IR-LIF

We propose to develop new technologies with support provided by PIDDP that will enable the in situ measurements of abundances and stable isotope ratios in important radiatively and biogenically active gases such as carbon dioxide, carbon monoxide, water, methane, nitrous oxide, and hydrogen sulfide to very high precision (0.1 per mil or better for the isotopic ratios, for example). Such measurements, impossible at present, could provide pivotal new constraints on the global (bio)geochemical budgets of these critical species, and could also be used to examine the dynamics of atmospheric transport on Mars, Titan, and other solar system bodies. We believe the combination of solid state light sources with imaging of the IR laser induced fluorescence (IR-LIF) via newly available detector arrays will make such in situ measurements possible for the first time. Even under ambient terrestrial conditions, the LIF yield from vibrational excitation of species such as water and carbon dioxide should produce emission measures well in excess of ten billion photons/sec from samples volumes of order 1 c.c. These count rates can, in principle, yield detection limits into the sub-ppt range that are required for the in situ isotopic study of atmospheric trace gases. While promising, such technologies are relatively immature, but developing rapidly, and there are a great many uncertainties regarding their applicability to in situ IR-LIF planetary studies. We therefore feel PIDDP support will be critical to developing these new tools, and propose a three-year program to combine microchip near-IR lasers with low background detection axes and state-of-the-art HgCdTe detectors developed for astronomical spectroscopy to investigate the sensitivity of IR-LIF under realistic planetary conditions, to optimize the optical pumping and filtering schemes for important species, and to apply the spectrometer to the non-destructive measurement of stable isotopes in a variety of test samples. These studies form the necessary precursors to the development of compact, lightweight stable isotope/trace gas sensors for future planetary missions.

Blake, Geoffrey A.↗

The Role of Early Giant-planet Instability in Terrestrial Planet Formation

The terrestrial planets are believed to have formed by violent collisions of tens of lunar- to Mars-size protoplanets at time t < 200 Myr after the protoplanetary gas disk dispersal (t {sub 0}). The solar system giant planets rapidly formed during the protoplanetary disk stage and, after t {sub 0}, radially migrated by interacting with outer disk planetesimals. An early (t < 100 Myr) dynamical instability is thought to have occurred with Jupiter having gravitational encounters with a planetary-size body, jumping inward by ∼0.2–0.5 au, and landing on its current, mildly eccentric orbit. Here we investigate how the giant-planet instability affected the formation of the terrestrial planets. We study several instability cases that were previously shown to match many solar system constraints. We find that resonances with giant planets help to remove solids available for accretion near ∼1.5 au, thus stalling the growth of Mars. It does not matter, however, whether the giant planets are placed on their current orbits at t {sub 0} or whether they realistically evolve in one of our instability models; the results are practically the same. The tight orbital spacing of Venus and Earth is difficult to reproduce in our simulations, including cases where bodies grow from a narrow annulus at 0.7–1 au, because protoplanets tend to spread radially during accretion. The best results are obtained in the narrow-annulus model when protoplanets emerging from the dispersing gas nebula are assumed to have (at least) the mass of Mars. This suggests efficient accretion of the terrestrial protoplanets during the first ∼10 Myr of the solar system.

79 ASTRONOMY AND ASTROPHYSICS↗

Potassium carbonate decomposition modeling within rotating detonation engines for direct power extraction applications

We report that recently, there has been a significant interest in detonation-based combustion systems, such as rotating detonation engines (RDE), due to potential performance advantages in propulsion and energy applications. This includes improvements in thermodynamic efficiency, inherently high gas velocities, and the possibility of achieving an increase in total pressure (i.e. pressure gain) through the combustion process. Due to approximating a constant volume combustion process, these devices also tend to exhibit extremely high local gas temperatures relative to a comparable constant pressure combustor. These advantages overlap well with desirable performance characteristics of direct power extraction (DPE) technologies, such as a magnetohydrodynamic (MHD) generator. Typically, in DPE systems hot combustion products are seeded with an easily ionizable material such as potassium carbonate (K 2 CO 3 ) in order to boost the electrical conductivity. However, due to the short gas residence times within an RDE, it was unclear whether forming an electrically conductive combustion plasma would be feasible for integration with a downstream MHD generator. A model is presented which describes the heating, decomposition, and ionization of solid K 2 CO 3 particles and aqueous solutions of K 2 CO 3 in water, for a given initial particle diameter. This model was combined with available computational fluid dynamics (CFD) data for an oxygen-methane RDE in a one-way coupled Eulerian-Lagrangian framework to predict particle trajectories and the corresponding heating, decomposition, and ionization histories. Electrical conductivities were computed using a previously developed model, and a method was proposed to determine an equivalent average electrical conductivity. Results show that particle sizes below ~30 µm are able to fully decompose before reaching the exit of the RDE. While the one-way coupled nature of the simulations precluded rigorous evaluation of the effects of seed material on detonability, a substantial temperature reduction is expected at the detonation wave front due to heating and decomposition. A preliminary comparison is presented between the RDE and an equivalent constant pressure adiabatic combustor, showing a potential performance advantage for the RDE.

42 ENGINEERING↗

Microscopic ejecta measurements from hypervelocity impacts on aluminum and powdered regolith targets

Meteoroids and space debris pose a two-fold threat to spacecraft due to the risk of both mechanical damage from the impact and electrical damage from the impact-generated plasma, which produces electromagnetic emissions. Analysis of impact products, however, has the potential to provide useful information about planetary rings and small solar system bodies, such as asteroids and comets. Understanding the plasma dynamics and radiation mechanism is essential to addressing the impact threat and extracting science data from impacts. Charge attachment to condensed-phase debris may lead to a dusty plasma under certain conditions, so interpreting hypervelocity impacts requires knowledge of both the nature of the plasma and of the ejecta. We address the latter with measurements of the microscopic ejecta distribution produced by light gas gun impacts on solid aluminum and powdered regolith simulant targets. We examine both the size and shape of the ejecta using thin-film witness plates and find that the size distributions of microscopic ejecta follow power laws. Observations from the powdered regolith simulant match well with disruption experiments of solid basalt, while measurements from the aluminum impacts diverge from extrapolations based on studies of macroscopic debris. Analysis of the ejecta shape shows a transition from smooth to irregularly shaped ejecta at the material grain size, and the shape of debris may provide insight on the phase of the ejected material. Finally, based on our results, we predict a significant number of secondary impacts on plasma sensors due to ejecta, even at considerable distance from the target, supporting the hypothesis that charged dust affects plasma measurements in the ejecta curtain.

42 ENGINEERING↗

HOSS: an implementation of the combined finite-discrete element method

Nearly thirty years since its inception, the combined finite-discrete element method (FDEM) has made remarkable strides in becoming a mainstream analysis tool within the field of Computational Mechanics. FDEM was developed to effectively “bridge the gap” between two disparate Computational Mechanics approaches known as the finite and discrete element meth-ods. At Los Alamos National Laboratory (LANL) researchers developed the Hybrid Optimization Software Suite (HOSS) as a hybrid multi-physics platform, based on FDEM, for the simulation of solid material behavior complemented with the latest technological enhancements for full fluid–solid interaction. Furthermore, in HOSS, several newly developed FDEM algorithms have been implemented that yield more accurate material deformation formulations, inter-particle interaction solvers, and fracture and fragmentation solutions. Additionally, an explicit computational fluid dynamics solver and a novel fluid–solid interaction algorithms have been fully integrated (as opposed to coupled) into the HOSS’ solid mechanical solver, allowing for the study of an even wider range of problems. Advancements such as this are leading HOSS to become a tool of choice for multi-physics problems. Finally, HOSS has been successfully applied by a myriad of researchers for analysis in rock mechanics, oil and gas industries, engineering application (structural, mechanical and biomedical engineering), mining, blast loading, high velocity impact, as well as seismic and acoustic analysis. This paper intends to summarize the latest development and application efforts for HOSS.

58 GEOSCIENCES↗

Spike-Nosed Bodies and Forward Injected Jets in Supersonic Flow

The paper contains new numerical simulation and experimental test results of blunt body drag reduction using thin spikes mounted in front of a body and one- or two-phase jets injected against a supersonic flow. Numerical simulations utilizing the NASA CFL3D code were conducted at the Hampton University Fluid Mechanics and Acoustics Laboratory (FM&AL) and experimental tests were conducted using the facilities of the IM/MSU Aeromechanics and Gas Dynamics Laboratory. Previous results were presented at the 37th AIAA/ASME/SAE/ASEE Joint Propulsion Conference. Those results were based on some experimental and numerical simulation tests for supersonic flow around spike-nosed or shell-nosed bodies, and numerical simulations were conducted only for a single spike-nosed or shell-nosed body at zero attack angle, alpha=0. In this paper, experimental test results of gas, liquid and solid particle jet injection against a supersonic flow are presented. In addition, numerical simulation results for supersonic flow around a multiple spike-nosed body with non-zero attack angles and with a gas and solid particle forward jet injection are included. Aerodynamic coefficients: drag, C(sub D), lift, C(sub L), and longitudinal momentum, M(sub z), obtained by numerical simulation and experimental tests are compared and show good agreement.

Gilinsky, M.↗

Normal mode description of phases of matter: Application to heat capacity

Understanding thermodynamics in liquids at the atomic level is challenging because of strong atomic interactions and lack of spatial symmetry. Recent prior theoretical works have focused on describing heat capacity of liquids in terms of phonon-like excitations but often rely on fitting factors and assumptions. In this work, we propose characterizing various phases in terms of instantaneous normal modes (INMs) of structural snapshots from molecular dynamics simulations of single-element systems over wide ranges of temperature and pressure. We use the INMs to build a mode-level microscopic description of heat capacity and demonstrate that heat capacity of liquids can be described by a combination of both solidlike and gaslike degrees of freedom, leading to a more unified framework to fundamentally describe heat capacity of all three phases of matter: solid, liquid, and gas. Published by the American Physical Society 2024

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Ignition Transient Calculations in the Space Shuttle Solid Rocket Motor

The work presented is part of an effort to develop a multidimensional ignition transient model for large solid propellant rocket motors. On the Space Shuttle, the ignition transient in the slot is induced when the igniter, itself a small rocket motor, is fired into the head-end portion of the main rocket motor. The computational results presented in this paper consider two different igniter configurations. The first configuration is a simulated Space Shuttle RSRM igniter which has one central nozzle that is parallel to the centerline of the motor. The second igniter configuration has a nozzle which is canted at an angle of 45 deg from the centerline of the motor. This paper presents a computational fluid dynamic (CFD) analyses of certain flow field characteristics inside the solid propellant star grain slot of the Space Shuttle during the ignition transient period of operation for each igniter configuration. The majority of studies made to date regarding ignition transient performance in solid rocket motors have concluded that the key parameter to be determined is the heat transfer rate to the propellant surface and hence the heat transfer coefficient between the gas and the propellant. In this paper the heat transfer coefficients, pressure and velocity distributions are calculated in the star slot. In order to validate the computational method and to attempt to establish a correlation between the flow field characteristics and the heat transfer rates a series of cold flow experimental investigations were conducted. The results of these experiments show excellent qualitative and quantitative agreement with the pressure and velocity distributions obtained from the CFD analysis. The CFD analysis utilized a classical pipe flow type correlation for the heat transfer rates. The experimental results provide an excellent qualitative comparison with regard to spatial distribution of the heat transfer rates as a function of nozzle configuration and igniter pressure. The results indicate that from a quantitative point of view that the pipe flow correlation gives reasonably good results. Furthermore, there appears to be a direct correlation between igniter pressure and an average Reynolds number in the star grain slot. This may lead to a simple method for modifying the convection heat transfer correlation. Calculated results of pressure-vs-time for the first 200 msec of motor firing of the Space Shuttle RSRM support the trends shown for the heat transfer rate comparisons between the cold flow CFD and experimental data.

Jenkins, Rhonald M.↗

Spike-Nosed Bodies and Forward Injected Jets in Supersonic Flow

The paper contains new numerical simulation and experimental test results of blunt body drag reduction using thin spikes mounted in front of a body and one- or two-phase jets injected against a supersonic flow. Numerical simulations utilizing the NASA CFL3D code were conducted at the Hampton University Fluid Mechanics and Acoustics Laboratory (FM&AL) and experimental tests were conducted using the facilities of the IM/MSU Aeromechanics and Gas Dynamics Laboratory. Previous results were presented at the 37th AIAA/ASME/SAE/ASEE Joint Propulsion Conference. Those results were based on some experimental and numerical simulation tests for supersonic flow around spike-nosed or shell-nosed bodies, and numerical simulations were conducted only for a single spike-nosed or shell-nosed body at zero attack angle, alpha = 0 degrees. In this paper, experimental test results of gas, liquid and solid particle jet injection against a supersonic flow are presented. In addition, numerical simulation results for supersonic flow around a multiple spike-nosed body with non-zero attack angles and with a gas and solid particle forward jet injection are included. Aerodynamic coefficients: drag, C (sub D), lift, C(sub L), and longitudinal momentum, M(sub z), obtained by numerical simulation and experimental tests are compared and show good agreement.

Gilinsky, M.↗

Shock physics in warm dense matter: A quantum hydrodynamics perspective

Abstract Warm dense matter (WDM), an exotic, highly compressed state of matter between solid and plasma phases, is of high current interest, in particular for astrophysics and inertial confinement fusion. For the latter, in particular the propagation of compression shocks is crucial. The main unknown in the shock propagation in WDM is the behaviour of the electrons since they are governed by correlations, quantum and spin effects that need to be accounted for simultaneously. Here we describe the shock dynamics of the warm dense electron gas using a quantum hydrodynamic model. From the numerical hydrodynamic simulations, we observe that the quantum Bohm pressure induces shear force that weakens the formation and strength of the shock. In addition, the Bohm pressure induces an electron density response that takes the form of oscillations. This is confirmed by the theoretical analysis of the early stage of the shock formation. Our theoretical and numerical analyses allow us to identify characteristic dimensionless shock propagation parameters at which the effect of the Bohm force is important.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Analysis of Planar-Cavity Receiver Reactor for Solar Thermochemical Dry-Reforming

Concentrating solar thermal (CST) systems can be leveraged to provide not only heat for power generation, but also for energy storage and thermochemical fuel production. Such solar thermochemical processes have been studied conceptually, from solar thermochemical hydrogen production (STCH) and thermochemical energy storage (TCES), to gasification, reforming, and fuel upgrading by various means. The solar receiver and reactor are critical components in the conversion of solar energy into chemical energy in the form of 'solar fuels'. For effective conversion of solar energy within a coupled solar receiver-reactor, extremely high temperatures are required, thereby demanding a high solar concentration ratio (CR) for efficient operation. This creates a design challenge for the receiver-reactor, as many thermochemical processes involve gas or gas-solid systems that are limited by low heat transfer coefficients. A unique receiver design is proposed that has the potential to incorporate various high-temperature thermochemical processes such as TCES-assisted power generation, methane reforming, or STCH processes. Modeling this receiver and its potential applications requires a full three-dimensional model that accurately captures the interconnected effects of receiver geometry, spatial solar irradiance, complex radiation, reaction kinetics, fluid dynamics, and heat transfer. In this paper we analyze a CST system integrated with this unique planar-cavity receiver-reactor design using the developed model. The model presented in this paper showed where improved thermal management was needed to achieve suitable receiver performance when a dry-methane reforming process is implemented.

14 SOLAR ENERGY↗

Computational fluid dynamics analysis of char conversion in Sandia’s pressurized entrained flow reactor

Design and analysis of practical reactors utilizing solid feedstocks rely on reaction rate parameters that are typically generated in lab-scale reactors. Evaluation of the reaction rate information often relies on assumptions of uniform temperature, velocity, and species distributions in the reactor, in lieu of detailed measurements that provide local information. This assumption might be a source of substantial error, since reactor designs can impose significant inhomogeneities, leading to data misinterpretation. Spatially resolved reactor simulations help understand the key processes within the reactor and support the identification of severe variations of temperature, velocity, and species distributions. In this work, Sandia’s pressurized entrained flow reactor is modeled to identify inhomogeneities in the reaction zone. Tracer particles are tracked through the reactor to estimate the residence times and burnout ratio of introduced coal char particles in gasifying environments. The results reveal a complex mixing environment for the cool gas and particles entering the reactor along the centerline and the main high-speed hot gas reactor flow. Furthermore, the computational fluid dynamics (CFD) results show that flow asymmetries are introduced through the use of a horizontal gas pre-heating section that connects to the vertical reactor tube. Computed particle temperatures and residence times in the reactor differ substantially from the idealized plug flow conditions typically evoked in interpreting experimental measurements. Furthermore, experimental measurements and CFD analysis of heat flow through porous refractory insulation suggest that for the investigated conditions (1350 °C, <20 atm), the thermal conductivity of the insulation does not increase substantially with increasing pressure.

47 OTHER INSTRUMENTATION↗

Formation of Planetary Systems

Stars are observed to be forming within cold regions of the galaxy called molecular clouds. A clump of gas and dust within a molecular cloud can collapse into a rotationally- supported disk orbiting the pre s sure -supported star. Such a disk has the same initial elemental composition as the growing star. At sufficient distances from the central star, it is cool enough for approx. 1 - 2% of this material to be in solid form, either remnant interstellar grains or condensates formed within the disk. During the infall stage, the disk is very active and probably highly turbulent. When the infall slows substantially or stops, the disk becomes more quiescent. The dust grows from micron-sized dust to kilometer-sized planetesimals by physical collisions, possibly aided by collective gravity. The dynamics of larger solid bodies within protoplanetary disks are better characterized. The primary perturbations on the orbits of kilometer-sized and larger planetesimals in protoplanetary disks are mutual gravitational interactions and physical collisions. These interactions lead to accretion (and in some cases erosion and fragmentation) of planetesimals. The most massive planets have the largest gravitationally-enhanced collision cross-sections, and accrete almost everything with which they collide. The size distribution of solid bodies becomes quite skewed, with a few large bodies growing much faster than the rest of the swarm, until they have accumulated most of the small bodies within their gravitational reach. Slower growth continues (at least for solid, earth-like planets) as the eccentricities of planetary embryos are pumped up by long-range mutual gravitational perturbations. As planetary masses increase, they become more efficient at stirring random velocities of neighboring bodies. If sufficiently massive and dense planets exist far enough from the star, they can eject material into interstellar space. In most models, giant planets begin their growth like terrestrial planets, but if they become massive enough before the protoplanetary disk dissipates, then they are able to accumulate substantial amounts of gas. Giant planet growth times predicted by current models are similar to estimates of the lifetime of the gaseous protoplanetary disk, so we don't know whether or not giant planets form in most protoplanetary disks. However, planets that become massive while a substantial amount of gas remains in the disk may migrate into the star as a consequence of their gravitational interactions with the disk.

Lissauer, Jack J.↗

Direct Study of Changes in Catalyst Structure-Kinetic Properties During Redox Transitions

The Temporal Analysis of Products (TAP) pulse response methodology is a transient technique that provides the time resolution needed to deconvolve reaction steps from the complex networks typical in industrial catalytic processes. Traditionally, TAP measurements observe gas phase dynamics at the reactor exit but lack direct measurements of changes in the catalyst itself. Recently, a new operando technique was developed that couples gas phase transients to dynamic changes in metal centers with the precise TAP methodology for nanomole titration. Using an industrial CrOx/Al2O3 catalyst used for propane dehydrogenation, we demonstrate the capabilities of this unique device to reveal key catalytic processes: 1) total propane oxidation not associated with chromia centers, 2) reduction of Cr6+ to Cr3+ correlated with selective product formation, and 3) subsequent carbon accumulation. By utilizing incremental pulsing in a diffusion-only transport regime, the spectrokinetic device allows us to resolve detailed changes in catalyst structure, composition, and kinetic function that are otherwise indistinguishable in conventional operando devices. The unification of the TAP methodology with time-resolved spectroscopic measurements offers new and unique insights into the complex kinetic phenomena regulated by solid catalyst surfaces.

03 - NATURAL GAS↗

Environmental effects of large impacts on the earth; relation to extinction mechanisms

Since Alvarez et al., discovered a worldwide approx. cm-thick layer of fine sediments laden with platinum group elements in approximately chondritic proportions exactly at the Cretaceous-Tertiary (C-T) boundary, and proposed bolide-impact as triggering mass extinctions, many have studied this hypothesis and the layer itself with its associated spherules and shocked quartz. At issue is whether the mass extinctions, and this horizon has an impact versus volcanic origin. A critical feature of the Alvarez hypothesis is the suggestion that the bolide or possibly a shower of objects delivered to the earth approx. 0.6 x 10 to the 18th power g of material which resulted in aerosol-sized ejecta such that global insolation was drastically reduced for significant periods. Such an event would lower temperatures on continents and halt photosynthesis in the upper 200 m of th eocean. The latter would strangle the marine food chain and thus produce the major marine faunal extinctions which mark the C-T boundary. Crucial issues examined include: What are the dynamics of atmospheric flow occurring upon impact of a large bolide with the earth; What is the size distributions of the very fine impact ejecta and how do these compare to the models of ejecta which are used to model the earth's radiative thermal balance. The flow field due to passage of a 10 km diameter bolide through an exponential atmosphere and the interaction of the gas flow and bolide with the solid ear was calculated. The CO2 released upon impact onto shallow marine carbonate sections was modeled and found that the mass of CO2 released exceeds the present 10 to the 18th power g CO2 budget of the earth's atmosphere by several times. Using the calculations of Kasting and Toon it was found that to compute the temperature rise of the earth's surface as a function of CO2 content, it was found that sudden and prolonged global increases are induced from impact of 20 to 50 km radius projectiles and propose that sudden terrestrial greenhouse-induced heating, not cooling, produced the highly variable extinctions seen at the C-T boundary.

Okeefe, John D.↗

Glass/Jamming Transition in Colloidal Aggregation

We have studied colloidal aggregation in a model colloid plus polymer system with short-range attractive interactions. By varying the colloid concentration and the strength of the attraction, we explored regions where the equilibrium phase is expected to consist of colloidal crystallites in coexistance with colloidal gas (i.e. monomers). This occurs for moderate values of the potential depth, U approximately equal to 2-5 kT. Crystallization was not always observed. Rather, over an extended sub-region two new metastable phases appear, one fluid-like and one solid-like. These were examined in detail with light scattering and microscopy techniques. Both phases consist of a near uniform distribution of small irregular shaped clusters of colloidal particles. The dynamical and structural characteristics of the ergodic-nonergodic transition between the two phases share much in common with the colloidal hard sphere glass transition.

Segre, Philip N.↗