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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 37 records · Page 2

Preliminary Computational Study for Future Tests in the NASA Ames 9 foot' x 7 foot Wind Tunnel

The NASA Advanced Air Vehicles Program, Commercial Supersonics Technology Project seeks to advance tools and techniques to make over-land supersonic flight feasible. In this study, preliminary computational results are presented for future tests in the NASA Ames 9 foot x 7 foot supersonic wind tunnel to be conducted in early 2016. Shock-plume interactions and their effect on pressure signature are examined for six model geometries. Near- field pressure signatures are assessed using the CFD code USM3D to model the proposed test geometries in free-air. Additionally, results obtained using the commercial grid generation software Pointwise Reigistered Trademark are compared to results using VGRID, the NASA Langley Research Center in-house mesh generation program.

Pearl, Jason M.↗

Telemetry computer studies

Special purpose computers to process telemetry data and to control experiments on small telemetry satellites

COMPUTER METHOD↗

Part 2 of a Computational Study of a Drop-Laden Mixing Layer

This second of three reports on a computational study of a mixing layer laden with evaporating liquid drops presents the evaluation of Large Eddy Simulation (LES) models. The LES models were evaluated on an existing database that had been generated using Direct Numerical Simulation (DNS). The DNS method and the database are described in the first report of this series, Part 1 of a Computational Study of a Drop-Laden Mixing Layer (NPO-30719), NASA Tech Briefs, Vol. 28, No.7 (July 2004), page 59. The LES equations, which are derived by applying a spatial filter to the DNS set, govern the evolution of the larger scales of the flow and can therefore be solved on a coarser grid. Consistent with the reduction in grid points, the DNS drops would be represented by fewer drops, called computational drops in the LES context. The LES equations contain terms that cannot be directly computed on the coarser grid and that must instead be modeled. Two types of models are necessary: (1) those for the filtered source terms representing the effects of drops on the filtered flow field and (2) those for the sub-grid scale (SGS) fluxes arising from filtering the convective terms in the DNS equations. All of the filtered-sourceterm models that were developed were found to overestimate the filtered source terms. For modeling the SGS fluxes, constant-coefficient Smagorinsky, gradient, and scale-similarity models were assessed and calibrated on the DNS database. The Smagorinsky model correlated poorly with the SGS fluxes, whereas the gradient and scale-similarity models were well correlated with the SGS quantities that they represented.

Okongo, Nora↗

Experimental and computational study of the viscoplastic response of high temperature structures

The first nine months of experimental and computational studies of the thermal-structural behavior of thin panels subjected to localized heating are described. Initial experimental studies have focused on developing an experimental set-up with well-defined thermal-structure boundary conditions. Preliminary tests with a Heldenfels panel have demonstrated out of plane bending (thermal buckling) due to panel initial imperfections. Initial computational studies have focused on: (1) validation of a thermoviscoplastic code to predict thermal stresses in the unbuckled panel, and (2) investigating in-plane stresses for test panels under transient thermal loading. Plans for future research are described.

Thornton, Earl A.↗

Computational study of TATB

We have performed a computational study of TATB. The study is composed of two parts, one where we perform static T = 0 K calculations with several different DFT functionals, to investigate structural properties and obtain a cold curve. Even though the functionals used in this study give poor results at ambient pressure, they perform much better at compression, when the dominance of the van der Waals’ forces in the binding is replaced by more normal interactions. In particular AM05 gives good results, mainly because it doesn’t include any “faulty” van der Waals’. Indeed the van der Waals’ corrected functional (PBE+D2) results shows the worst performance on structural properties. For the cold curve the PBE+D2 functional gives the best results compared to experiments (room temperature) but since the structural properties were bad with this functional we cannot for sure say that this is in any way a validation. It is shown that scaling the AM05 results with a common factor reproduces the experimental data. We leave the question on why to a follow up study but speculate that maybe the experiment and our calculations do not represent the same system set-up. From the structural properties we identify a site in the TATB lattice that contains a high concentration of oxygen and hydrogen. The consequences of this finding, if any, are left to a future project. In the second part of the study we perform extensive high-quality DFT-MD (molecular dynamics with DFT forces) calculations to obtain points on the Hugoniot. This part of the study did not get finished within this project and a more extensive summary of this part will be given in a follow up report at a future date. However, we show that obtaining calculated data is essential for equations of state development since the existing experimental Hugoniot data barely deviates from room temperature isotherm data and thus give no information of the high temperature dependency of materials properties. Our conclusion so far in the project is that being able to calculate materials properties is essential for high explosives since experiments are unable to give information in the high temperature part of phase space. While blind use of DFT cannot (yet) give unambiguous answers, we can still explore qualitatively and use such information to guide us in EOS development. However, the main conclusion is that we need better functionals in DFT to easily extract needed properties from calculations.

36 MATERIALS SCIENCE↗

Computational studies of turbulent merger of corotational vortices

A computational study has been conducted to gain a better understanding of the criteria governing the merger of corotating vortices. The zero-equation and one-equation turbulent-flow models are used to model the interaction of two rolled-up, corotational vortices. A model appropriate for the swirling flow under consideration has been proposed to prescribe the algebraic variation of mixing-length in the flow field. The unsteady, two-dimensional equations in a cross-plane are solved for primitive variables using an implicit finite-difference code. The computed downstream merging distances are in good agreement with available wind tunnel data.

Raj, P.↗

EXPERIMENTAL AND COMPUTATIONAL STUDY OF DIRECT CONTACT MEMBRANE DISTILLATION

Experimental and computational studies of direct contact membrane distillation (DCMD) are conducted. The permeate flux is measured in a module containing a flat sheet membrane. Polytetrafluoroethylene (PTFE) hydrophobic membrane (Membrane Solutions, FPB045A16) with a nominal pore size of 0.45 μm, the thickness of 179~239 μm, the porosity of 80% is used in the experiments. The feed solution is a binary mixture of water and NaCl. The inlet feed temperature is fixed at 70°C, and the feed Reynolds number is varied between 500 and 2000. Two inlet feed concentrations, 0 and 35g/L, are considered. The permeate flow rate was kept constant at Re of 1300 and temperature of 20°C. Three-dimensional steady-state computational fluid dynamics (CFD) simulations are performed using the laminar model. The Navier’s Stokes, energy, and mass transport equations in each channel coupled with flux boundary conditions imposed at the membrane surface are solved. The predicted module-averaged flux is compared to measured data for all operating conditions. Measured and predicted flux agrees well; validating both experiments and model, Temperature polarization in the feed and permeate channel and concentration polarization in the feed channel are characterized by validated CFD simulations.

Oztekin, Alparslan↗

Computational Study of Separating Flow in a Planar Subsonic Diffuser

A computational study of the separated flow through a 2-D asymmetric subsonic diffuser has been performed. The Wind Computational Fluid Dynamics code is used to predict the separation and reattachment behavior for an incompressible diffuser flow. The diffuser inlet flow is a two-dimensional, turbulent, and fully-developed channel flow with a Reynolds number of 20,000 based on the centerline velocity and the channel height. Wind solutions computed with the Menter SST, Chien k-epsilon, Spalart-Allmaras and Explicit Algebraic Reynolds Stress turbulence models are compared with experimentally measured velocity profiles and skin friction along the upper and lower walls. In addition to the turbulence model study, the effects of grid resolution and use of wall functions were investigated. The grid studies varied the number of grid points across the diffuser and varied the initial wall spacing from y(sup +) = 0.2 to 60. The wall function study assessed the applicability of wall functions for analysis of separated flow. The SST and Explicit Algebraic Stress models provide the best agreement with experimental data, and it is recommended wall functions should only be used with a high level of caution.

DalBello, Teryn↗

Electronic, magnetic, and structural properties of V2CoAl: Experimental and computational study

Here, we present results of combined experimental and computations study of V2CoAl, a Heusler alloy that exhibits nearly perfect spin-polarization. Our calculations indicate that this material maintains a high degree of spin-polarization (over 90%) in the wide range of lattice parameters, except at the largest considered unit cell volume. The magnetic alignment of V2CoAl is ferrimagnetic, due to the antialignment of the magnetic moments of vanadium atoms in their two sublattices. The calculated total magnetic moment per formula unit is nearly integer at the optimal lattice parameter and at the smaller volumes of the unit cell, but it deviated from the integer values as the unit cell expands. This is consistent with the calculated variation in the degree of spin polarization with lattice constant. The expected ferrimagnetic behavior has been observed in the arc-melted V2CoAl sample, with a Curie temperature of about 80 K. However, the saturation magnetization is significantly smaller than the theoretical prediction of ∼2 μB/f.u., most likely due to the observed B2-type atomic disorder. The samples exhibit metallic electron transport across the measurement range of 2 K to 300 K.

Kharel, Parashu (ORCID:0000000171330718)↗

Computer studies of hybrid slotted working sections with minimum steady interference at subsonic speeds

Currently there is renewed interest in the evaluation and reduction of steady wind tunnel wall interference, especially for large models. Evaluation of previous predictions for perforated and slotted tunnels suggests that a hybrid slotted tunnel (i.e., a slotted tunnel with closed slats and perforated slots) should offer minimum corrections for upwash, flow curvature and solid blockage. This suggestion is confirmed by the present computer studies of a range of rectangular hybrid slotted tunnels. The computer studies are for tunnel working section height to breadth ratios of 0.835 and 0.600 over the Mach number range from 0 to 0.85. Wings swept at 28 deg and 50 deg, with ratios of model span to tunnel breadth varying from 0 to 0.7, are considered. An idealized fuselage shape is used to predict solid and wake blockage corrections for the wall configurations selected on the basis of minimum upwash and curvature interference.

Mabey, D. G.↗

Computational Study of a Cryopump Design for Fusion Exhaust Gas Purification Using Direct Simulation Monte Carlo

Cryopump-based direct internal recycling (DIR) of fusion fuel is an attractive prospect because it provides pumping of helium ash from a reactor along with separation of helium and other impurities from the fuel. Previous studies have demonstrated a continuously regenerating cryopump, referred to as the Snail pump, that separates helium ash from fusion fuel for reactor-relevant flow rates. Here, in this study, a conceptual cryopump was designed as a proof-of-principle study to target other impurities, besides helium ash, from the fusion exhaust that would complement the Snail pump. The impurity-removal cryopump consists of four sets of chevron fins, two sets operating at 80 K and the other two at 30 K. A computational study using direct simulation Monte Carlo (DSMC) was performed with a gas mixture of 96.5% D2, 2.0% He, and 0.5% each of CO2, N2, and CH4. In this configuration, 80 K chevron fin sets are capable of capturing CO2 and 30 K sets capable of capturing CO2, N2, and CH4. The computational study showed that the cryopump is capable of reducing the impurity content by more than two orders of magnitude from the flow.

Adhikari, Nirajan [Oak Ridge National Laboratory (↗

Reviewing computational studies of defect formation and behaviors in carbon fiber structural units

Solid-state carbon materials, such as graphite and graphene, are at the forefront of materials research because of their unique electronic, vibrational, and mechanical properties, leading to a broad range of potential and realized applications. One key application is their role as basic structural units of carbon fiber (CF), a lightweight alternative to steel. In CF, a delicate relationship exists between ultimate material strength and the atomic-scale density of defects contained at the inter- and intra-subunit levels. Computational studies provide insight into the stability of various types of defects that can form in these systems and connect with experimental observables such as bandgap and spectroscopic measurements. Therefore, the literature contains many computational studies that focus on changes induced by defects, including vacancies and Dienes transformations (Stone-Wales and Thrower defects). However, wide-ranging methods and cell sizes have been used, and property-specific information is often lacking. Furthermore, this review summarizes key literature findings, paying particular attention to changes in the electronic, vibrational, and mechanical properties induced by defects in graphitic materials relevant to CF.

36 MATERIALS SCIENCE↗

An experimental and computational study of turbulent boundary layers in oscillating flows

An experimental-computational study of the behavior of turbulent boundary layers for oscillating air flows over a plane surface with a small favorable mean pressure gradient is described. Experimental data were obtained for boundary layers generated on the test section wall of a new type of facility that produces a mean flow velocity with a superposed sinusoidal component over a wide frequency range. Experimental results for unsteady velocity profiles and turbulence intensity obtained from hot wire measurements at a fixed stream-wise position on the surface are presented for frequencies ranging from 5 to 21 Hz. Numerical predictions were obtained using an unsteady boundary layer computational code and the Cebeci-Smith and Glushko turbulence models. Predicted quantities related to unsteady velocity profiles exhibit fair agreement with experiment when the Cebeci-Smith model is used.

Cook, W. J.↗

An experimental and computational study of 2-D blade-vortex interaction

An experimental and computational study is carried out to investigate the dominant physical factors of 2D parallel blade-vortex interaction (BVI) and its noise generation. A shock tube was used to generate a starting vortex which interacted with a target airfoil. Double-exposed holographic interferometry and airfoil surface pressure measurements were employed to obtain quantitative data during the BVI. As a numerical approach, thin-layer Navier-Stokes code, with a multizonal grid, was also used to resolve the phenomena occuring in the BVI, especially in the head-on collision case.

Lee, Soogab↗

Computational Study of Electron-Molecule Collisions Related to Low-Temperature Plasmas

Computational study of electron-molecule collisions not only complements experimental measurements, but can also be used to investigate processes not readily accessible experimentally. A number of ab initio computational methods are available for these types of calculations. Here we describe a recently developed technique, the finite element Z-matrix method, Analogous to the R-matrix, method, it partitions the space into regions and employs real matrix elements. However, unlike the implementation of the R-matrix method commonly used in atomic and molecular physics, the Z-matrix method is fully variational. In the present implementation, a mixed basis of finite elements and Gaussians is used to represent the continuum electron, thus offering full flexibility without imposing fixed boundary conditions. Numerical examples include the electron-impact dissociation of N2 via the metastable A3Su+ state, a process which may be important in the lower thermosphere, and the dissociation of the CF radical, a process of interest to plasma etching. To understand the dissociation pathways, large scale quantum chemical calculations have been carried out for all target states which dissociate to the lowest five limits in the case of N2, and to the lowest two limits in the case of CF. For N2, the structural calculations clearly show the preference for predissociation if the initial state is the ground X1 Sg+ state, but direct dissociation appears to be preferable if the initial state is the A3Su+ state. Multi-configuration SCF target functions are used in the collisional calculation.

Huo, Winifred M.↗

Computational Study of a Generic T-tail Transport

This paper presents a computational study on the static and dynamic stability characteristics of a generic transport T-tail configuration under a NASA research program to improve stall models for civil transports. The NASA Tetrahedral Unstructured Software System (TetrUSS) was used to obtain both static and periodic dynamic solutions at low speed conditions for three Reynolds number conditions up to 60 deg angle of attack. The computational results are compared to experimental data. The dominant effects of Reynolds number for the static conditions were found to occur in the stall region. The pitch and roll damping coefficients compared well to experimental results up to up to 40 deg angle of attack whereas yaw damping coefficient agreed only up to 20 deg angle of attack.

McMillin, S. Naomi↗