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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 217 records · Page 12

Non-Fermi Liquid Behavior in the Three-Dimensional Hubbard Model

We present a numerical study on the non-Fermi liquid behavior of a three-dimensional strongly correlated system. The Hubbard model in a simple cubic lattice is simulated by the dynamical cluster approximation; in particular, the quasi-particle weight is calculated at finite dopings for a range of temperatures. By fitting the quasi-particle weight to the marginal Fermi liquid form at finite doping near the putative quantum critical point, we find evidence of a separatrix between Fermi liquid and non-Fermi liquid regions. Our results suggest that a marginal Fermi liquid and possibly a quantum critical point exist in the non-symmetry broken solution of the three-dimensional interacting electron systems. We also calculate the spectral function, close to the half-filling, and we obtain evidence of pseudogap.

Kellar, Samuel↗

An investigation of the origin of the flow turning effect in combustion stability analysis

The concept of a "flow turning" effect in the combustion based on the fact that terms appear in the equations governing the acoustic oscillations in a one dimensional model of combustion in a solid propellant rocket that do not appear in a three dimensional model. A procedure is developed to allow comparison of one and three dimensional models by averaging over the cross section of the motor cavity. Results indicate that the one dimensional equations with mass addition do not contain any physical phenomena that are missing the three dimensional equations with appropriate boundary conditions. This raises significant questions about any procedure that is based on the difference between one and three dimensional results.

Vanmoorhem, W. K.↗

Surface deformation, gravity and the geoid from a three-dimensional convection model at low Rayleigh numbers

The two-dimensional surface deformation, gravity field, and geoid are calculated from the temperature fields of a number of numerical models of constant-viscosity three-dimensional convective flows, heated from within and from below. The surface deformation and the geoid are insensitive to the short-wavelength features of the temperature variation; the gravity field is less smooth, although it still does not clearly indicate the narrowness of the upwelling and downwelling regions at large Rayleigh numbers. The results indicate that the convective upwelling beneath regions showing positive geoid and residual depth anomalies is more localized than the horizontal extent of these features would suggest. The results are relevant to attempts to understand the behavior of the earth mantle.

Craig, Claire Harvey↗

GEO3D - Three-Dimensional Computer Model of a Ground Source Heat Pump System

This file is the setup file for GEO3D, a computer program written by Jim Menart to simulate vertical wells in conjunction with a heat pump for ground source heat pump (GSHP) systems. This is a very detailed three-dimensional computer model. This program produces detailed heat transfer and temperature field information for a vertical GSHP system.

15 GEOTHERMAL ENERGY↗

Three-dimensional stochastic model of actin–myosin binding in the sarcomere lattice

The effect of molecule tethering in three-dimensional (3-D) space on bimolecular binding kinetics is rarely addressed and only occasionally incorporated into models of cell motility. The simplest system that can quantitatively determine this effect is the 3-D sarcomere lattice of the striated muscle, where tethered myosin in thick filaments can only bind to a relatively small number of available sites on the actin filament, positioned within a limited range of thermal movement of the myosin head. Here we implement spatially explicit actomyosin interactions into the multiscale Monte Carlo platform MUSICO, specifically defining how geometrical constraints on tethered myosins can modulate state transition rates in the actomyosin cycle. The simulations provide the distribution of myosin bound to sites on actin, ensure conservation of the number of interacting myosins and actin monomers, and most importantly, the departure in behavior of tethered myosin molecules from unconstrained myosin interactions with actin. In addition, MUSICO determines the number of cross-bridges in each actomyosin cycle state, the force and number of attached cross-bridges per myosin filament, the range of cross-bridge forces and accounts for energy consumption. At the macroscopic scale, MUSICO simulations show large differences in predicted force-velocity curves and in the response during early force recovery phase after a step change in length comparing to the two simplest mass action kinetic models. The origin of these differences is rooted in the different fluxes of myosin binding and corresponding instantaneous cross-bridge distributions and quantitatively reflects a major flaw of the mathematical description in all mass action kinetic models. Consequently, this new approach shows that accurate recapitulation of experimental data requires significantly different binding rates, number of actomyosin states, and cross-bridge elasticity than typically used in mass action kinetic models to correctly describe the biochemical reactions of tethered molecules and their interaction energetics.

60 APPLIED LIFE SCIENCES↗

Developing a Consistent Travel-Time Framework for Comparing Three-Dimensional Velocity Models for Seismic Location Accuracy

Abstract Location algorithms have historically relied on simple, one-dimensional (1D) velocity models for fast seismic event locations. 1D models are generally used as travel-time lookup tables, one for each seismic phase, with travel-times pre-calculated for event distance and depth. These travel-time lookup tables are extremely fast to use and this fast computational speed makes them the preferred type of velocity model for operational needs. Higher-dimensional (i.e., three-dimensional—3D) seismic velocity models are becoming readily available and provide more accurate event locations over 1D models. The computational requirements of these 3D models tend to make their operational use prohibitive. Additionally, comparing location accuracy for 3D seismic velocity models tends to be problematic, as each model is determined using different ray-tracing algorithms. Attempting to use a different algorithm than the one used to develop a model usually results in poor travel-time prediction. We demonstrate and test a framework to create first-P and first-S 3D travel-time correction surfaces using an open-source framework ( PCalc + GeoTess , https://www.sandia.gov/salsa3d/software/geotess ) that easily stores 3D travel-time and uncertainty data. This framework produces fast travel-time and uncertainty predictions and overcomes the ray-tracing algorithm hurdle because the lookup tables can be generated using the exact ray-tracing algorithm that is preferred for a model.

3D velocity models↗

Three-dimensional vector modeling and restoration of flat finite wave tank radiometric measurements

In this paper, a three-dimensional Fourier transform inversion method describing the interaction between water surface emitted radiation from a flat finite wave tank and antenna radiation characteristics is reported. The transform technique represents the scanning of the antenna mathematically as a correlation. Computation time is reduced by using the efficient and economical fast Fourier transform algorithm. To verify the inversion method, computations have been made and compared with known data and other available results. The technique has been used to restore data of the finite wave tank system and other available antenna temperature measurements made at the Cape Cod Canal. The restored brightness temperatures serve as better representations of the emitted radiation than the measured antenna temperatures.

Truman, W. M.↗

Three dimensional global modeling of atmospheric CO2

A model was developed to study the prospects of extracting information on carbon dioxide sources and sinks from observed CO2 variations. The approach uses a three dimensional global transport model, based on winds from a 3-D general circulation model (GCM), to advect CO2 noninteractively, i.e., as a tracer, with specified sources and sinks of CO2 at the surface. The 3-D model employed is identified and biosphere, ocean and fossil fuel sources and sinks are discussed. Some preliminary model results are presented.

Fung, I.↗

A three-dimensional diffusion/convection model of the large scale magnetic field in the Venus ionosphere

A three-dimensinal diffusion/convection model of the dayside Venus ionosphere magnetic field was developed on the basis of previously published one-dimensional diffusion/convection models, and assuming that the field and flow at the upper boundary (in the magnetic barrier) as well as the ionospheric plasma velocity are known. The results indicate that the low-altitude magnetosheath field draping may be distorted by the interaction with the ionosphere in such a manner that there is an apparent 'focusing' of the field toward the subsolar point, caused by the shear in the horizontal velocity between the magnetosheath and ionospheric flows. A comparison of published magnetic-field observations with the present results indicates that the simple nesting of external and internal velocity fields may be a good approximation to global plasma flows near Venus under normal conditions.

Luhmann, J. G.↗

The numerical simulation of the evolution of a Saharan dust outbreak by using a general prognostic aerosol model

A three-dimensional model is developed that explicitly predicts the evolution of the spatial distributions of aerosols utilizing a time-dependent, initial value prognostic aerosol model based on aerosol physicochemical processes, a knowledge of aerosol sinks and sources, and the predicted motions of the atmosphere. These models serve a useful purpose in determining standardized aerosol spectra for utilization in radiative transfer calculations. The first numerical prediction of a Saharan dust outbreak evolution is described. It is shown that the results are in qualitative agreement with measurements despite the fact that in this preliminary simulation the generation of the dust depended upon several empirically based assumptions. IR satellite photographs taken during GATE are being examined in an attempt to determine the sources of the dust.

Westphal, Douglas L.↗

High-energy particle transport in three-dimensional hydrodynamic models of colliding-wind binaries

Massive stars in binary systems (such as WR 140, WR 147, or η Carinae) have long been regarded as potential sources of high-energy γ-rays. The emission is thought to arise in the region where the stellar winds collide and produce relativistic particles that subsequently might be able to emit γ-rays. Detailed numerical hydrodynamic simulations have already offered insight into the complex dynamics of the wind collision region (WCR), while independent analytical studies, albeit with simplified descriptions of the WCR, have shed light on the spectra of charged particles. In this paper, we describe a combination of these two approaches. We present a three-dimensional hydrodynamical model for colliding stellar winds and compute spectral energy distributions of relativistic particles for the resulting structure of the WCR. The hydrodynamic part of our model incorporates the line-driven acceleration of the winds, gravity, orbital motion, and the radiative cooling of the shocked plasma. In our treatment of charged particles, we consider diffusive shock acceleration in the WCR and the subsequent cooling via inverse Compton losses (including Klein-Nishina effects), bremsstrahlung, collisions, and other energy loss mechanisms.

79 ASTRONOMY AND ASTROPHYSICS↗

An improved three-dimensional aerodynamics model for helicopter airloads prediction

The importance of unsteady aerodynamic effects due to rotor blade motion is demonstrated for a helicopter in high-speed forward flight. These unsteady effects are modeled as surface boundary conditions to a three-dimensional, unsteady Computational Fluid Dynamics (CFD) code called the Full-Potential Rotor Code (FPR). These boundary conditions cause significant changes in the computed lift and pitching moment at the front and rear of the rotor disk. Airloads from the modified FPR code are then iteratively coupled with the helicopter comprehensive code, CAMRAD/JA. Computed airloads show good agreement with flight-test data when lift values from the FPR code are used in the coupled calculation. However, the computed airloads from CAMRAD/JA along also show good agreement with the experimental data. Thus for this case one cannot demonstrate a significant improvement in computed airloads with the hybrid coupled scheme. The addition of the pitching moment values from the FPR code into the CAMRAD/JA calculation slows down the overall iterative convergence and does not yield any improvement in the final results.

Strawn, Roger C.↗

THREE-DIMENSIONAL MAGNETOHYDRODYNAMIC MODELING OF PROPAGATING DISTURBANCES IN FAN-LIKE CORONAL LOOPS

Quasi-periodic propagating intensity disturbances (PDs) have been observed in large coronal loops in EUV images over a decade, and are widely accepted to be slow magnetosonic waves. However, spectroscopic observations from Hinode/EIS revealed their association with persistent coronal upflows, making this interpretation debatable. Motivated by the scenario that the coronal upflows could be the cumulative result of numerous individual flow pulses generated by sporadic heating events (nanoflares) at the loop base, we construct a velocity driver with repetitive tiny pulses, whose energy frequency distribution follows the flare power-law scaling. We then perform three-dimensional MHD modeling of an idealized bipolar active region by applying this broadband velocity driver at the footpoints of large coronal loops which appear open in the computational domain. Our model successfully reproduces the PDs with similar features as the observed, and shows that any upflow pulses inevitably excite slow magnetosonic wave disturbances propagating along the loop. We find that the generated PDs are dominated by the wave signature as their propagation speeds are consistent with the wave speed in the presence of flows, and the injected flows rapidly decelerate with height. Our simulation results suggest that the observed PDs and associated persistent upflows may be produced by small-scale impulsive heating events (nanoflares) at the loop base in the corona, and that the flows and waves may both contribute to the PDs at lower heights.

79 ASTRONOMY AND ASTROPHYSICS↗

A study of circumferentially-heated and block-heated heat pipes. I - Experimental analysis and generalized analytical prediction of capillary limits. II - Three-dimensional numerical modeling as a conjugate problem

The wall and centerline vapor temperatures and heat output are determined experimentally for a low-temperature copper-water heat pipe under uniform circumferential heating and block heating. The time required to reach a vapor temperature of 60 C from an initial ambient temperature of 21 C is determined for both modes of heating. The experimental capillary limit of the heat pipe is compared to the generalized capillary limits for block-heated pipes over a range of vapor temperatures. A three-dimensional numerical model is then developed for determining the temperature, pressure, and velocity distributions in the entire domain of a circumferentially heated and a block-heated pipe. The problem is formulated as a conjugate problem, without the assumption of a uniform vapor temperature. The predictions of the model are found to be in good agreement with the experimental data.

Schmalhofer, Joseph↗

Comparison of 2-D and 3-D models of grid erosion in an ion thruster

Numerical results of particle-in-cell/Monte Carlo calculations of accelerator grid erosion in an ion thruster are presented. Specifically, it is shown that a three-dimensional model is required to account for the experimentally observed pitting of the accelerator grid between grid apertures. Some comparisons with earlier two-dimensional, axisymmetric model are made, and it is shown that, for identical operating conditions of the thruster, the wear-through time in the three-dimensional model is about two to three times higher than that obtained previously with the two-dimensional model, namely on the order of 10,000 hours for sample calculation.

Peng, Xiaohang↗

Technical Basis and Implementation of Groundwater Pathway Models Used for INL's RH LLW Disposal Facility Performance Assessment - 19440

The Idaho National Laboratory's (INL's) Remote-Handled Low-Level Waste (RH LLW) Disposal Facility has been designed and constructed to receive waste generated by INL in support of the Office of Nuclear Energy (NE) and Naval Reactors (NR) missions. RH LLW is generated on the INL site from spent nuclear fuel handling and operations at the Naval Reactors Facility (NRF), the Advanced Test Reactor (ATR), and at the Material and Fuels Complex (MFC) in addition to other miscellaneous research activities. The facility has been designed to receive RH LLW currently in storage at INL facilities and new waste generated by nuclear research programs. RH LLW received at the facility is solid waste consisting of surface contaminated materials, ion exchange resins used to purify cooling water, and activated metals generated during reactor core change outs, Naval spent fuel management, and nuclear R and D. The facility has been designed to meet the requirements of DOE Order 435.1, Radioactive Waste Management for all-pathways including groundwater and air, radon emissions limits, and inadvertent intrusion limits. The facility design includes a vault system incorporating robust concrete vaults oriented vertically in close-packed arrays, a hydraulic drainage system designed to limit water contact with the stainless steel waste canisters and concrete vaults, and a robust monitoring system. Per the environmental assessment (EA), all waste will be disposed of in stainless steel waste canisters. During facility design and construction, site-specific data was collected to provide laboratory and field scale performance characteristics for the concrete vault and hydraulic drainage systems. Field-scale infiltration tests were conducted and monitoring data was interpreted using numerical simulation. Based on interpretation of the observed laboratory and field test data, the facility performance assessment (PA) was developed. The PA groundwater pathway source release model differentially credits release from surface contaminated waste, ion exchange resins, and activated metals. It also credits steel waste canisters with failure rates based on actual corrosion data. Once released, radionuclide transport through the vadose zone and aquifer to downgradient receptor locations was simulated in the PA using a one-dimensional modeling approach based on three-dimensional modeling of historically-contaminated INL sites. This paper provides an overview of the groundwater pathway source release models and their technical implementation in the PA. It also describes the one-dimensional transport model used for the vadose zone and multi-dimensional model used for the aquifer. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

Predicting microstructurally sensitive fatigue‐crack path in WE43 magnesium using high‐fidelity numerical modeling and three‐dimensional experimental characterization

Abstract Microstructurally small fatigue‐crack growth in polycrystalline materials is highly three‐dimensional due to sensitivity to local microstructural features (e.g., grains). One requirement for modeling microstructurally sensitive crack propagation is establishing the criteria that govern crack evolution, including crack deflection. Here, a high‐fidelity finite‐element modeling framework is used to assess the performance and validity of various crack‐growth criteria, including slip‐based metrics (e.g., fatigue‐indicator parameters), as potential criteria for predicting three‐dimensional crack paths in polycrystalline materials. The modeling framework represents cracks as geometrically explicit discontinuities and involves voxel‐based remeshing, mesh‐gradation control, and a crystal‐plasticity constitutive model. The predictions are compared to experimental measurements of WE43 magnesium samples subject to fatigue loading, for which three‐dimensional grain structures and fatigue‐crack surfaces were measured post‐mortem using near‐field high‐energy x‐ray diffraction microscopy and x‐ray computed tomography. Findings from this work are expected to improve the predictive capabilities of simulations involving microstructurally small fatigue‐crack growth in polycrystalline materials.

Engineering↗