Engineering Papers⌕ Search

SEARCH · Engineering Papers

Results for “computational homogenization”

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.

Quote a phrase for an exact phrase match. Source license links do not imply unrestricted reuse.

At least 91 records · Page 5

The ERTS-1 investigation (ER-600). Volume 5: ERTS-1 urban land use analysis

The Urban Land Use Team conducted a year's investigation of ERTS-1 MSS data to determine the number of Land Use categories in the Houston, Texas, area. They discovered unusually low classification accuracies occurred when a spectrally complex urban scene was classified with extensive rural areas containing spectrally homogeneous features. Separate computer processing of only data in the urbanized area increased classification accuracies of certain urban land use categories. Even so, accuracies of urban landscape were in the 40-70 percent range compared to 70-90 percent for the land use categories containing more homogeneous features (agriculture, forest, water, etc.) in the nonurban areas.

Erb, R. B.↗

MO-F-CAMPUS-I-02: Accuracy in Converting the Average Breast Dose Into the Mean Glandular Dose (MGD) Using the F-Factor in Cone Beam Breast CT- a Monte Carlo Study Using Homogeneous and Quasi-Homogeneous Phantoms

Purpose: To investigate the accuracy in estimating the mean glandular dose (MGD) for homogeneous breast phantoms by converting from the average breast dose using the F-factor in cone beam breast CT. Methods: EGSnrc-based Monte Carlo codes were used to estimate the MGDs. 13-cm in diameter, 10-cm high hemi-ellipsoids were used to simulate pendant-geometry breasts. Two different types of hemi-ellipsoidal models were employed: voxels in quasi-homogeneous phantoms were designed as either adipose or glandular tissue while voxels in homogeneous phantoms were designed as the mixture of adipose and glandular tissues. Breast compositions of 25% and 50% volume glandular fractions (VGFs), defined as the ratio of glandular tissue voxels to entire breast voxels in the quasi-homogeneous phantoms, were studied. These VGFs were converted into glandular fractions by weight and used to construct the corresponding homogeneous phantoms. 80 kVp x-rays with a mean energy of 47 keV was used in the simulation. A total of 109 photons were used to image the phantoms and the energies deposited in the phantom voxels were tallied. Breast doses in homogeneous phantoms were averaged over all voxels and then used to calculate the MGDs using the F-factors evaluated at the mean energy of the x-rays. The MGDs for quasi-homogeneous phantoms were computed directly by averaging the doses over all glandular tissue voxels. The MGDs estimated for the two types of phantoms were normalized to the free-in-air dose at the iso-center and compared. Results: The normalized MGDs were 0.756 and 0.732 mGy/mGy for the 25% and 50% VGF homogeneous breasts and 0.761 and 0.733 mGy/mGy for the corresponding quasi-homogeneous breasts, respectively. The MGDs estimated for the two types of phantoms were similar within 1% in this study. Conclusion: MGDs for homogeneous breast models may be adequately estimated by converting from the average breast dose using the F-factor.

60 APPLIED LIFE SCIENCES↗

Fiber/Matrix Interfacial Thermal Conductance Effect on the Thermal Conductivity of SiC/SiC Composites

SiC/SiC composites used in fusion reactor applications are subjected to high heat fluxes and require knowledge and tailoring of their in-service thermal conductivity. Accurately predicting the thermal conductivity of SiC/SiC composites as a function of temperature will guide the design of these materials for their intended use, which will eventually include the effects of 14-MeV neutron irradiations. This paper applies an Eshelby-Mori-Tanaka approach (EMTA) to compute the thermal conductivity of unirradiated SiC/SiC composites. The homogenization procedure includes three steps. In the first step EMTA computes the homogenized thermal conductivity of the unidirectional (UD) SiC fiber embraced by its coating layer. The second step computes the thermal conductivity of the UD composite formed by the equivalent SiC fibers embedded in a SiC matrix, and finally the thermal conductivity of the as-formed SiC/SiC composite is obtained by averaging the solution for the UD composite over all possible fiber orientations using the second-order fiber orientation tensor. The EMTA predictions for the transverse thermal conductivity of several types of SiC/SiC composites with different fiber types and interfaces are compared to the predicted and experimental results by Youngblood et al.

SiC/SiC composite, thermal conductance, thermal co↗

A Theoretical Study of the Qualitative Reaction Mechanism for the Homogeneous Disproportionation of Pentavalent Uranyl Ions

There is significant interest in understanding the oxidation and reduction of aqueous uranium ions. In the literature, there is considerable variation in the results of attempts to reduce uranium depending on very small differences in reducing species, pH, spectator ions, mineral substrates, and other factors. Of particular curiosity is the fact that U(V) can be stabilized in the lab but is almost never found in the environment. In order to better understand these two phenomena, a direct computational study of homogenous, aqueous U(V) disproportionation was undertaken. Using a combination of Marcus Theory with Hartree– Fock and MP2 calculations, the rate constant of the electron-transfer reaction was calculated. Under the conditions studied, the electron-transfer reaction is slow (k observed ~10 -1 M-1 s-1). This reduced rate is a result of a variety of factors: the +1 charge of the reactants, the large encounter complex distance, and the electronic reorganization energies associated with the proton transfers. Excluding the energy from the coupled proton transfers, all of the remaining factors could be eliminated by small alterations of the uranium’s environment.

Environmental Molecular Sciences Laboratory↗

Studying fuel failure behaviour with a micromechanical approach

Under Loss Of Coolant Accident (LOCA) conditions in light water reactors, the temperature evolution within the fuel pellets combined with a reduction of the cladding confinement can lead to fuel fragmentation. This work focuses on the pellet rim, where bubbles density increases owing to a higher irradiation level. This area, called 'High Burn-up Structure' (HBS), has a specific behaviour due to a microstructure reorganization composed of small grains about 100 nm compared to 10 μm for initial UO{sub 2} fuel. The aim of this study is to define a macroscopic fragmentation model based on a micro mechanical approach to have a better understanding of the fuel mechanical behaviour at lower scale: size and volume fraction of fragments. This paper introduces a stepwise micromechanical method: firstly, we detail how to model the HBS microstructure including pressurized porosities, based on experimental or numerical data and define a Representative Volume Element (RVE). Then we use 3D full field computations in order to determine crack snapshot. Elastic computations are performed to find the bubbles pressure level which is required to reach the cracks initiation threshold. Then nonlinear computations, using a failure local behavior law, are conducted to identify the failure snapshot. The results of these nonlinear computations will be used as an input data of the homogenization ('macroscopic') model. First computations with Full-Fields FEM method give promising results at local scale. Nevertheless, material parameters need to be refined as their experimental values are not perfectly defined yet, leaving an uncertainty in the model.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

An ILLIAC program for the numerical simulation of homogeneous incompressible turbulence

An algorithm and ILLIAC computer program, developed for the simulation of homogeneous incompressible turbulence in the presence of an applied mean strain, are described. The turbulence field is represented spatially by a truncated triple Fourier series (spectral method) and followed in time using a fourth-order Runge-Kutta algorithm. These include: (1) transformation of variables suggested by Taylor's sudden-distortion theory; (2) implicit viscous diffusion by use of an integrating factor; (3) implicit pressure calculation suggested by Taylor's sudden-distortion theory, and (4) inexpensive control of aliasing by random and phased coordinate shifts.

Rogallo, R. S.↗

Progress on Generic Phase-Field Method Development

In this report, we summarize our current collaborative efforts, involving three national laboratories: Idaho National Laboratory (INL), Pacific Northwest National Laboratory (PNNL) and Los Alamos National Laboratory (LANL), to develop a computational framework for homogenous and heterogenous nucleation mechanisms into the generic phase-field model. During the studies, the Fe-Cr system was chosen as a model system due to its simplicity and availability of reliable thermodynamic and kinetic data, as well as the range of applications of low-chromium ferritic steels in nuclear reactors. For homogenous nucleation, the relevant parameters determined from atomistic studies were used directly to determine the energy functional and parameters in the phase-field model. Interfacial energy, critical nucleus size, nucleation rate, and coarsening kinetics were systematically examined in two- and three- dimensional models. For the heterogeneous nucleation mechanism, we studied the nucleation and growth behavior of chromium precipitates due to the presence of dislocations. The results demonstrate that both nucleation schemes can be introduced to a phase-field modeling algorithm with the desired accuracy and computational efficiency.

36 MATERIALS SCIENCE↗

Hydrodynamic Coupling to a Homogenized Radiation Transport Method based on Young Measures

Resolving radiation transport fields subject to opacity profiles with strong, oscillatory line structure while potentially falling under intermediate optical depth conditions presents a numerical challenge in radiation transport modeling. The Young measure-based homogenization technique formulated by Haut et al. (2017) was investigated as a candidate method for resolving radiation fields under such conditions more accurately. The method was compared against frequently-utilized mean opacity methods as the Rosseland and Planck formulations. In this work, all methods were tested through radiation slab calculations separately comprised of aluminum, copper, and krypton, each for different thermodynamic conditions. Following these offline radiation slab calculations, demonstrations shifted towards the SCEPTRE radiation transport code and, subsequently, the multiphysics ALEGRA code for approximately-coupled radiation-material simulations. Throughout all the simulations shown in this study, for a fixed computational cost, the homogenized method was observed to be more accurate than any of the solutions determined through traditional mean opacity approaches.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

SU-E-T-121: Analyzing the Broadening Effect On the Bragg Peak Due to Heterogeneous Geometries and Implementing User-Routines in the Monte-Carlo Code FLUKA in Order to Reduce Computation Time

Purpose: Aim of this study was to analyze the modulating, broadening effect on the Bragg Peak due to heterogeneous geometries like multi-wire chambers in the beam path of a particle therapy beam line. The effect was described by a mathematical model which was implemented in the Monte-Carlo code FLUKA via user-routines, in order to reduce the computation time for the simulations. Methods: The depth dose curve of 80 MeV/u C12-ions in a water phantom was calculated using the Monte-Carlo code FLUKA (reference curve). The modulating effect on this dose distribution behind eleven mesh-like foils (periodicity ∼80 microns) occurring in a typical set of multi-wire and dose chambers was mathematically described by optimizing a normal distribution so that the reverence curve convoluted with this distribution equals the modulated dose curve. This distribution describes a displacement in water and was transferred in a probability distribution of the thickness of the eleven foils using the water equivalent thickness of the foil’s material. From this distribution the distribution of the thickness of one foil was determined inversely. In FLUKA the heterogeneous foils were replaced by homogeneous foils and a user-routine was programmed that varies the thickness of the homogeneous foils for each simulated particle using this distribution. Results: Using the mathematical model and user-routine in FLUKA the broadening effect could be reproduced exactly when replacing the heterogeneous foils by homogeneous ones. The computation time was reduced by 90 percent. Conclusion: In this study the broadening effect on the Bragg Peak due to heterogeneous structures was analyzed, described by a mathematical model and implemented in FLUKA via user-routines. Applying these routines the computing time was reduced by 90 percent. The developed tool can be used for any heterogeneous structure in the dimensions of microns to millimeters, in principle even for organic materials like lung tissue.

60 APPLIED LIFE SCIENCES↗

Implementation of Material and Geometry Criticality Search in RMC Code

RMC is a continuous-energy Reactor Monte Carlo neutron and photon transport code being developed by Department of Engineering Physics at Tsinghua University, Beijing. For the use of simulation of reactor control or design of reactor with unknown material and geometry parameters, an accurate and efficient method of eigenvalue search is implemented in RMC code. The eigenvalue search focuses on two types of parameters. One is nuclide atom density, called material search, which includes the fuel density, enrichment or boron concentration. Perturbation theory of Monte Carlo Code, like differential operator method and adjoint-weighted perturbation method has been widely researched in sensitivity and uncertainty study. For material search, the perturbation algorithm needs to coupled with flexible material control block and optimized strategy. The other type of parameter is surface position, called geometry search, which includes fuel rod diameter, pitch and control rod position. MC21 iterated on surface position based on bisection method or regula-falsi method, and directly recalculated k-eff until it converged to target error interval. In this paper, the differential operator method, improved Newton-Raphson method is introduced. Based on these methods, the global material search is implemented. Then based on material search and finite method, global geometry search is implement. Finally, fuel enrichment, boron concentration and control rod position in normal PWR assembly are searched. The results show that RMC can search material and geometry parameters accurately and efficiently. In this paper, global eigenvalue search of material and geometry parameters have been implemented in RMC code. They are based on the differential operator method in Monte Carlo perturbation theory. The differential operator method samples δk/δρ{sub r}, δ{sup 2}k/δρ{sub r}{sup 2} along with k-eff estimator. Therefore it won't take up too much additional computational resource. For homogeneous material search, fission source effect has little effect of accuracy and can be ignored. The results of fuel enrichment and boron concentration searches in assembly show that improved Newton-Raphson method can iterate efficiently until k-eff is in the error interval. Based on material search and finite difference formula, the geometry parameter, like control rod axial position, can iterate until k-eff is in the error interval. However, the tiny perturbed region may not contain enough tracks to simulate. Besides, the large number density's relative change up to -1 may cause underestimation of Δk-eff, and then slope of k-x curve. This will cause non-convergence for Newton- Raphson method. (authors)

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Negative magnetic eddy diffusivities from the test-field method and multiscale stability theory

The generation of a large-scale magnetic field in the kinematic regime in the absence of an α-effect is investigated by following two different approaches: the test-field method and the multiscale stability theory relying on the homogenization technique. Our computations of the magnetic eddy diffusivity tensor of the parity-invariant flow IV of G. O. Roberts and the modified Taylor–Green flow confirm the findings of previous studies and also explain some of their apparent contradictions. The two flows have large symmetry groups; this is used to considerably simplify the eddy diffusivity tensor. Finally, a new analytic result is presented: upon expressing the eddy diffusivity tensor in terms of solutions to auxiliary problems for the adjoint operator, we derive relations between the magnetic eddy diffusivity tensors that arise for mutually reverse small-scale flows v(x) and −v(x).

79 ASTRONOMY AND ASTROPHYSICS↗

SU-E-T-151: Enhanced Radiation Attenuation with Multi-Layer Foils

Purpose: To evaluate the effect of increasing the number of thin high Z foils on the dose enhancement and the overall radiation attenuation with a 24MV photon beam. Methods: DOSXYZnrc was used to perform Monte Carlo simulations of multi-layer lead foil configurations. The foil size was 7cm x 7cm. and the foil thickness was adjusted to give a combined thickness of 1mm. The number of foils used was 4, 6, 8, and 10. The separation between foils was also varied from 3 to 9 mm. The Mohan 24MV energy spectrum was used as a photon source. The field size was 5cm x 5cm and SSD was 100 cm. The phantom size was 16cm × 16cm × 28cm. The number of histories ranged from 1 to 2 billion. The percentage difference of the dose between the medium with foils and the homogeneous water was computed along the beam axis. The minimum dose enhancement and the change of integrated dose between the foils were determined. Results: Increasing the number of foils resulted in a decrease in the minimum dose enhancement. The highest dose region occurred in the last section for the 4 and 6 foil cases, whereas the 8 and 10 foil configurations showed the maximum dose region towards the center of the foil group. Increasing the number of foils increased the total integrated dose between foils. For example, the total integrated dose increase between the first and the last foils with a 3mm foil separation were 34.2, 43.4, 57.4, and 64.7% for 4, 6, 8 and 10 foils, respectively. Conclusion: This work showed the degree of dose enhancement around multiple thin lead foils. The results suggest that the total attenuation of photon beam can be increased by increasing the number of foils with a fixed total foil thickness.

07 ISOTOPE AND RADIATION SOURCES↗

The O{sub 2} A-Band in the Fluxes and Polarization of Starlight Reflected by Earth-Like Exoplanets

Earth-like, potentially habitable exoplanets are prime targets in the search for extraterrestrial life. Information about their atmospheres and surfaces can be derived by analyzing the light of the parent star reflected by the planet. We investigate the influence of the surface albedo A {sub s}, the optical thickness b {sub cloud}, the altitude of water clouds, and the mixing ratio of biosignature O{sub 2} on the strength of the O{sub 2} A-band (around 760 nm) in the flux and polarization spectra of starlight reflected by Earth-like exoplanets. Our computations for horizontally homogeneous planets show that small mixing ratios ( η < 0.4) will yield moderately deep bands in flux and moderate-to-small band strengths in polarization, and that clouds will usually decrease the band depth in flux and the band strength in polarization. However, cloud influence will be strongly dependent on properties such as optical thickness, top altitude, particle phase, coverage fraction, and horizontal distribution. Depending on the surface albedo and cloud properties, different O{sub 2} mixing ratios η can give similar absorption-band depths in flux and band strengths in polarization, especially if the clouds have moderate-to-high optical thicknesses. Measuring both the flux and the polarization is essential to reduce the degeneracies, although it will not solve them, especially not for horizontally inhomogeneous planets. Observations at a wide range of phase angles and with a high temporal resolution could help to derive cloud properties and, once those are known, the mixing ratio of O{sub 2} or any other absorbing gas.

79 ASTRONOMY AND ASTROPHYSICS↗

Limb-darkening scans of Jupiter

Representative center-limb photometric measurements of several areas on Jupiter are presented in the form of limb-darkening scans taken through narrow-band interference filters which isolate continuum regions near the 3-0 and 4-0 hydrogen quadrupole bands (8200 and 6300 A, respectively). Results of scans measured through filters which isolate two regions dominated by methane absorption (6190 and 7250 A) are also discussed. Limb-darkening curves at all four wavelengths are computed for semiinfinite homogeneous isotropically scattering atmospheres with different values of the single-scattering albedo of the cloud particles. It is found that albedo values between 0.985 and 0.989 match the data over most of the northern component of the South Equatorial Belt. The single-scattering albedo values are used to show that the equatorial regions of Jupiter which emit at 5 microns may be relatively clear while the tropical regions may be relatively cloudy.

Pilcher, C. B.↗

Big whorls carry little whorls

The aim of the research was to explore the space-time structure of homogeneous turbulence by computing and then interpreting the two-point spectra and correlations of the velocity and pressure fields. Many of these statistics are of considerable practical importance. In particular, it is of interest to compare the different time and length integral scales and microscales for Eulerian and Lagrangian qualities, and to compare the space and time spectra.

Hunt, J. C. R.↗

Pitch-angle scattering of cometary ions - Computer simulations

The relationships between the rate of pitch-angle scattering induced by wave-particle interactions and two parameters, alpha, and the cometary ion interjection rate, Lambda-j, are studied with the aid of one-dimensional electromagnetic hybrid computer simulations of homogeneous plasmas. The simulations are done with relatively weak ion injection rates commensurate with those in the distant environment of the Comet Halley. In response to the linear temporal growth of the fluctuating magnetic field energy, the injected ions pitch-angle scatter toward isotropy in both the quasi-parallel and quasi-perpendicular regimes. For the injection of cometary oxygen ions, the simulations show pitch-angle scattering rates that increase as the square root of the injection rate. The oxygen ion pitch-angle scattering rates are roughly twice as large at perpendicular injection, again in qualitative agreement with observations.

Gary, S. P.↗

A software architecture for multidisciplinary applications: Integrating task and data parallelism

Data parallel languages such as Vienna Fortran and HPF can be successfully applied to a wide range of numerical applications. However, many advanced scientific and engineering applications are of a multidisciplinary and heterogeneous nature and thus do not fit well into the data parallel paradigm. In this paper we present new Fortran 90 language extensions to fill this gap. Tasks can be spawned as asynchronous activities in a homogeneous or heterogeneous computing environment; they interact by sharing access to Shared Data Abstractions (SDA's). SDA's are an extension of Fortran 90 modules, representing a pool of common data, together with a set of Methods for controlled access to these data and a mechanism for providing persistent storage. Our language supports the integration of data and task parallelism as well as nested task parallelism and thus can be used to express multidisciplinary applications in a natural and efficient way.

Chapman, Barbara↗