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Results for “Finite Element Modeling”

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 1,783 records · Page 99

Enhanced boron doping for diamond growth in cylindrical CVD reactors using a Faraday cage

We report on the use of 3D-printed titanium Faraday cages in a cylindrical resonant cavity CVD reactor for the growth of heavily boron-doped single-crystalline superconducting diamond. We show that the cage enhances boron doping uniformity and provides control of the doping efficiency and growth rate by varying the distance between the plasma and the diamond surface. Using finite element modelling, we demonstrate that the Faraday cage focuses the electric field at the top of the cage whilst also suppressing the electric field inside the cage, thereby pinning the plasma at a fixed height above the sample. This eliminates plasma “hot spots” at the edges of the sample and creates a more uniform plasma electron and hydrogen radical distribution over the sample, resulting in a more uniform boron incorporation.

Boron doped diamond↗

Optimization of Type 4 composite pressure vessels using genetic algorithms and simulated annealing

We propose and demonstrate two methodologies for weight minimization of Type 4 (plastic lined, fiber wrapped) compressed hydrogen pressure vessels: genetic algorithms and simulated annealing. We consider 70 MPa vessels with a safety factor of 2.25, and analyze the vessels with classical laminate theory. We propose an objective function based on Tsai-Wu criterion, composite thickness, a safety factor, and a penalization factor. Here, the optimum results are analyzed and compared by a high resolution finite element model. Computer simulations show that the proposed methodology produces more efficient designs by reducing the weight by up to 9.8% and 11.2% when compared to previously published vessel optimization research.

08 HYDROGEN↗

Experiment and non-local crystal plasticity finite element study of nanoindentation on Al-8Ce-10Mg alloy

Cerium and magnesium strengthened aluminum alloys, or Al-Ce-Mg, is a recently developed alloy family that exhibits good mechanical properties at elevated temperatures (~300 °C). To examine the single-crystal properties of Al-Ce-Mg alloys, nanoindentation experiments are conducted in this study. A crystal plasticity finite element model (CPFEM) with the evolution of geometrically necessary dislocations (GNDs) is applied to simulate the indentation in individual grains. A parametric study is carried out to investigate the sensitivity of each crystal plasticity model parameter to the indentation behavior. The highly sensitive parameters are calibrated by matching the indentation load-depth curves, while the rest parameters are obtained from bulk polycrystal uniaxial tension tests. Overall, satisfactory matching between experiment and simulation is obtained for each individual grain. The calculated hardness, as determined from the experiment, shows the dependence on indent depth, which is captured by the GND model. Furthermore, the effect of grain orientation and neighboring grains to nanoindentation behavior have been discussed with the comparison between the simulation and experiments.

36 MATERIALS SCIENCE↗

Analysis of the accelerated crucible rotation technique applied to the gradient freeze growth of cadmium zinc telluride

Here we employ finite-element modeling to assess the effects of the accelerated crucible rotation technique (ACRT) on cadmium zinc telluride (CZT) crystals grown from a gradient freeze system. Via consideration of tellurium segregation and transport, we show, for the first time, that steady growth from a tellurium-rich melt produces persistent undercooling in front of the growth interface, likely leading to morphological instability. The application of ACRT rearranges melt flows and tellurium transport but, in contrast to conventional wisdom, does not altogether eliminate undercooling of the melt. Rather, a much more complicated picture arises, where spatio-temporal realignment of undercooled melt may act to locally suppress instability. A better understanding of these mechanisms and quantification of their overall effects will allow for future growth optimization.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Parametric study of residual stress formation in Wire and Arc Additive Manufacturing

Here, a finite element model was created to simulate the Wire Arc Additive Manufacturing (WAAM) thermal and mechanical processes of Inconel 718 on a A36 steel substrate, as well as the effects of process parameters on Residual Stress (RS). The model was verified using temperature data obtained from three thermocouples attached to the upper surface of the build substrate and micro-strain measurements obtained from Neutron Diffraction (ND) measurement. The model was then used to study the effects of changing the torch travel speed and interlayer dwell time. The study found that travel speed has little effect on RS when maintaining the same heat input rate. As well, the interlayer dwell time has a strong effect on RS. Reducing the dwell time causes the stress profiles to become relatively uniform and a high-stress region extends deeper along the build direction. This study provides important insight into mechanical stresses inside large walls made by the WAAM method.

36 MATERIALS SCIENCE↗

Type IV failure in weldment of creep resistant ferritic alloys: II. Creep fracture and lifetime prediction

The creep rupture behavior (Type IV failure) for weldments of creep strength enhanced ferritic steel is numerically analyzed, using an integrated microstructure- and micromechanics-based finite element model. To account for the large microstructure gradients across weldments, a two-dimensional digital microstructure is constructed based on the actual observed microstructure of ferritic steel weldment by using the Voronoi-tessellation method. According to the fracture mechanism studies and literature experimental observations, the Type IV failure is identified as an intergranular creep fracture in the fine-grained or intercritical heated affected zone (FGHAZ or ICHAZ). In the present study, the following micromechanics model is employed to determine the micromechanical and microstructural origins for the failure process above, accounting for the underlying physical fracture mechanisms at different length scales, including nucleation of grain boundary cavities, their growth by competition of grain boundary diffusion and grain interior creep, viscous grain boundary sliding, and the emergence of microcracks by coalescence and their evolution to the ultimate failure. The methodology demonstrates the capabilities in modeling the Type IV failure and providing quantitative creep rupture lifetime prediction which shows an excellent agreement with long-term creep experimental data for creep strength enhanced ferritic steels and their weldments. In particular, the drop-off in time to rupture at high temperatures and low stress levels in the creep rupture curves is quantitatively predicted, and the transition of failure mechanisms from creep-controlled to diffusion-controlled creep fracture mechanism is illustrated.

36 MATERIALS SCIENCE↗

Simulation of wellbore construction in offshore unconsolidated methane hydrate-bearing formation

The unconsolidated nature of offshore methane hydrate-bearing formation poses concerns for sustainable methane gas production as the weak formation is susceptible to disturbance during wellbore construction. Furthermore, this could contribute to loss of well integrity which could manifest as sand production and error in the interpretation of downhole tests such as mini-frac tests. In this study, a simulation methodology of wellbore construction process is proposed. A finite element model adopting this methodology is developed in order to assess the effect of wellbore construction process on the integrity of the unconsolidated methane hydrate-bearing formation in the Nankai Trough, Japan. The primary objectives are (i) to develop a modelling methodology of well construction process for numerical simulations, (ii) to assess the zone and magnitude of well construction-induced stress/strain disturbance in the formation and (iii) to evaluate relative impact of each well construction stage on the integrity of the formation. The results from this study show that the zone of horizontal stress disturbance from the geostatic state due to wellbore construction could extend to more than three times the radius of the wellbore. Following the wellbore construction, the deviator stress is concentrated in the hydrate reservoir sublayers with high hydrate saturation while plastic deviatoric strain has accumulated in the sublayers with low hydrate saturation. The results also show that modelling of cement shrinkage process is crucial in predicting the concentration of deviator stress in the high hydrate saturation layers.

03 NATURAL GAS↗

Insight into the interfacial microstructure and chemistry of hot isostatically pressed AA6061-AA6061 bonds for U-10Mo fuel cladding application

Here, in the present study, hot isostatic pressing (HIP) bonding was carried out using AA6061-AA6061 plates for U-10Mo monolithic fuel cladding application. HIP was performed at 560°C with an applied isostatic pressure of 103 MPa for 90 min. Interfacial microstructure characterizations were performed using scanning electron microscopy (SEM) combined with electron backscatter diffraction (EBSD) to quantify precipitate fractions and study recrystallization, grain growth, and orientation relationships across the interface. EBSD results confirmed that no interfacial grain growth occurred during the HIP process. Transmission electron microscopy (TEM) was also employed to quantify composition and identify phases of various precipitates and an oxide layer that formed at the interface during HIP bonding. Microstructural analyses revealed the formation of a large fraction of Mg 2 Si precipitate and a ~50 nm thick Mg-oxide layer at the interface. Further TEM analysis confirmed that the oxide layer was not continuous, and Mg 2 Al 2 O 5 oxide particles with an average size of 18 nm were present in the oxide layer. Finite element modeling analysis was performed to study the stress distribution at the interface during HIP processing.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

Study of hydride reorientation and ductility of SRA ZIRLO and PRXA ZIRLO using ring compression testing (RCT)

Before dry storage, spent nuclear fuel is dried at high temperatures, which induces hydride dissolution. Radial hydride particles precipitate when cooled under a stress above a threshold stress. This process can severely degrade the ductility of cladding tubes. Zirconium alloys with different microstructures, such as grain boundary density, were quantified and studied to examine their effect on hydride reorientation. The ring compression loading mode creates a range of stress states depending on the location within the ring with respect to the applied load, producing various hydride morphologies that can be used to study the effects of microstructures on hydride reorientation. Finite element modeling was performed to calculate the hoop stress, which is the dominant stress, during hydride reorientation. These results were coupled with hydride morphology to determine the threshold stress for hydride reorientation, depending on the microstructure. In conclusion, the samples were then mechanically tested using ring compression to evaluate the ductility of zirconium alloys as a function of different hydride morphologies.

Hydride embrittlement↗

Insight into the deformation features and capacity loss mechanisms of lithium-ion pouch cells under spherical indentation conditions

Mechanical deformation under extreme conditions is one of the important reasons for the failure of lithium-ion batteries in automotive application. However, the deformation features and component failure of lithium-ion cells to external loading has never been a design consideration. Here, in this study, we conduct spherical indentation tests on a dozen of lithium-ion cells with different capacities under different control mode conditions to investigate their deformation features and capacity loss mechanisms. The experimental results show that, under mechanical deformation conditions, internal faults of cells occur in stages, and energy accumulation and sudden release are two key processes of cell's mechanical failure. The cells' state of charge is the main factor affecting their thermal runaway behaviors. In addition, a finite element model is developed to simulate the deformation features and the failure mechanism of key components of lithium-ion pouch cells; the 3D x-ray computed tomography is employed to demonstrate its internal configuration. With this model, the force-strain response, the deformation features as well as the size of the failure area of lithium-ion cells under spherical indentation conditions are accurately predicted. In 3D x-ray computed tomography images, unique mud cracks in cooper current collector are observed, and the influence mechanisms of the isolated fragments on the cell capacities are revealed. These results may provide useful information for the mechanical structure design of the components of lithium-ion pouch cells.

25 ENERGY STORAGE↗

On the microstructure characterization of the AA2098-T351 alloy welded by FSW

Highlights: • The microstructural characterization of the AA2098-T351 Al-Cu-Li alloy welded by FSW was carried out. • There was strong correlation between the results of the various techniques. • DSC was an effective technique for characterization of GP zones complementing the microstructural characterization by TEM. - Abstract: The complex structure of the AA2098-T351 alloy welded by friction stir welding (FSW) was investigated by transmission electron microscopy (TEM), differential scanning calorimetry (DSC) and microhardness measurements. Thermal modelling process of the FSW process was carried out by soldering thermocouples at distances of 6, 9 and 12 mm from the weld centerline, and thermocouple measurements were used as input data into the model. Finite element software COMSOL v5.2 was used for data analysis. The prevailing phases in the base metal (BM) are T1 (Al{sub 2}CuLi) θ′ (Al{sub 2}Cu), δ′/β′(Al{sub 3}(Li,Zr)) and Ω (Al{sub 2}Cu). In the heat affected zone (HAZ), either in the retreating or advancing sides, θ′ phase was not identified. In the thermomechanical affected zone (TMAZ), T1, δ′/β′, GP zones phase were detected in the retreating side, whereas T1 and Guinier-Preston (GP) zones were not observed in the advancing side. This result supports the asymmetric behavior observed in the microhardness profile of the weld. In the stir zone (SZ), GP zones, T1, δ′/β′ (Al{sub 3}(Li,Zr)) and Ω were identified.

36 MATERIALS SCIENCE↗

Using porous random fields to predict the elastic modulus of unoxidized and oxidized superfine graphite

Nuclear graphite is a candidate material for Generation IV nuclear power plants. Porous materials such as graphite can contain complex networks of pores that influence the material's mechanical and irradiation response. A methodology known as the random finite element method (RFEM) was adapted to create synthetic microstructures and predict the influence of porosity on the elastic properties of graphite during oxidation. RFEM combines random field theory and the finite element method in a Monte Carlo framework to estimate the mechanical response of a given grade of graphite. In this research, the random fields were verified through experimental characterization to predict the elastic response of three nuclear graphite grades, ETU-10, IG-110, and 2114. Finite element models (FEM) were generated using segmentations of x-ray computed tomography (XCT) data known as image-based models (IBMs) to validate and compare with the RFEM results and better understand the effects of uniform oxidation in these graphite grades. The RFEM predictions appear to correlate well with the experimental values of the measured Young’s modulus of the three graphite grades and display the same trends as IBMs.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

Exceptional strength and wear resistance in an AA7075/TiB 2 composite fabricated via friction consolidation

The friction consolidation method successfully reinforced aluminum 7075 alloy (AA7075) with high-volume fractions (12 and 24 vol%) of titanium diboride (TiB 2 ) by high pressure and severe plastic deformation at elevated temperatures. The consolidated AMCs have a uniform dispersion of submicron- and micron-sized TiB 2 particles in the AA7075 matrix, with significant refinement of the matrix grain size and the particles. The addition of TiB 2 significantly increases hardness by up to 50 %, Young’s modulus by up to 62 %, and ultimate tensile strength by up to 28 % to 672 MPa, while reducing ductility by 80 %. Wear resistance of 7075/24 vol% TiB 2 improves seven-fold compared to baseline, making it comparable to that of carburized steels. Microstructure-based finite element modeling provided a theoretical strength limit of ~730 MPa for the composites and indicated that high triaxiality in conjunction with severe equivalent plastic strain in a narrow area between the TiB 2 particles led to early fracture initiations, limiting the ductility.

36 MATERIALS SCIENCE↗

Electrical conductivity of porous binary powder mixtures

Simultaneous data of the quasi-static compaction and electrical conductivity of porous, binary powder mixtures have been collected as a function of bulk density. The powder mixtures consist of a metal conductor, either titanium or iron, an insulator, and pores filled with ambient air. The data show a dependency of the conductivity in terms of relative bulk density and metal volume fraction on conductor type and conductor particle characteristics of size and shape. Finally, finite element models using particle domains generated by discrete element method are used to simulate the bulk conductivity near its threshold while the general effective media equation is used to model the conductivity across the compression regime.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Elevated temperature nanoscratch of Inconel 617 Superalloy

Inconel 617 superalloy is a main candidate to be used for mechanical and tribo-components in high temperature helium-cooled reactors. Recent findings show that it grows a unique surface oxide, especially under high temperature helium with distinct wear, friction, and contact properties. Here, this study reports the elevated temperature nanoscratch behavior of Inconel 617 and further utilizes it to understand the effect of temperature on contact friction constituent contributors, adhesion and plowing at small scales. Inconel 617 is aged in high temperature helium, and consequently, the total kinetic friction coefficient of the alloy surface oxide is obtained in temperatures ranging from 25 °C to 400 °C. A finite element model is developed and validated based on the experimental results. The model is then utilized along with previously established techniques to determine the adhesion and plowing components of the friction coefficient. At small scale, the experimental results show that with increasing temperature the friction coefficient increases. It was inferred that this increase is mainly due to the increased contribution of plowing friction at high levels of deformation.

36 MATERIALS SCIENCE↗

In situ indentation and high cycle tapping deformation responses in a nanolaminate crystalline/amorphous metal composite

The incorporation of nanostructured and amorphous metals into modern applications is reliant on the understanding of deformation and failure modes in constrained conditions. To study this, a 105 nm crystalline Cu/160 nm amorphous Cu 45 Zr 55 (at.%) multilayer structure was fabricated with the two crystalline layers sputter deposited between the top-middle-bottom amorphous layers and prepared to electron transparency. The multilayer was then in situ indented either under a single load to a depth of ~ 100 nm (max load of ~ 100 μN) or held at 20 μN and then repeatedly indented with an additional 5 μN up to 20,000 cycles in a transmission electron microscope to compare the deformation responses in the nanolaminate. For the single indentation test, the multilayer showed serrated load-displacement behavior upon initial indentation inductive of shear banding. Additionally, at an indentation depth of ~ 32 nm, the multilayer exhibited perfect plastic behavior and no strain hardening. Both indented and fatigue-indented films revealed diffraction contrast changes with deformation. Subsequent Automated Crystal Orientation Mapping (ACOM) measurements confirmed and quantified global texture changes in the crystalline layers with specifically identified grains revealing rotation. Using a finite element model, the in-plane displacement vectors under the indent mapped conditions where ACOM determined grain rotation was observed, indicating the stress flow induced grain rotation. Furthermore, the single indented Cu layers also exhibited evidence of deformation induced grain growth, which was not evident in the fatigue-indented Cu based multilayer. Finally, the single indented multilayer retained a significant plastic crater in the upper most amorphous layer that directly contacted the indenter; a negligible crater impression in the same region was observed in the fatigued tested multilayer. These differences are explained by the different loading methods, applied load, and deformation mechanisms experienced in the multilayers.

36 MATERIALS SCIENCE↗

Measurement of grain boundary strength of Inconel X-750 superalloy using in-situ micro-tensile testing techniques in FIB/SEM system

Grain boundaries (GBs), known as two-dimensional defects, are omnipresent in polycrystalline metallic alloys and thus influence a wide range of mechanical properties under different environmental conditions like irradiation and corrosion. Therefore, quantifying the strength of individual GBs is critical for understanding the degradation of mechanical properties of materials under different conditions. In this study we developed an efficient approach for the fabrication of micro-tensile specimens with a GB almost perpendicular to the tensile direction, which is expected to advance the development of individual GB tensile testing at micro or nanoscale in a wide scope of materials. Further, an in-situ cantilever micro-tensile testing method was developed and used to quantify the strength of a Σ3 GB in Inconel X-750 with the combination of finite element modeling. The average ultimate tensile strength (UTS) of a non-irradiated Σ3 GB is estimated at around 1.4 GPa, comparable to that of a neutron-irradiated Σ3 GB with a dose of ~1.5 dpa (1.3 GPa). Moreover, the in-situ push-to-pull micro-tensile testing technique developed in this work provides valuable insights into the high-angle GB deformation and fracture behavior. This method generates qualitatively similar ductility behavior before and after neutron irradiation as the bulk material testing. However, the ductility and UTS values obtained from this method are different from bulk measurements due to vastly different specimen dimensions.

36 MATERIALS SCIENCE↗