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Sun, Xin

Publications and source records attributed to Sun, Xin.

At least 73 records · Page 4
All sourcesNASA NTRSDOE OSTI
DOE OSTI2018

Crystal plasticity based constitutive modeling of ZEK100 magnesium alloy combined with in-situ HEXRD experiments

In the current works, both micro- and macro-mechanical properties of a hexagonal close-packed (HCP) polycrystalline ZEK100 magnesium alloy were investigated. In the experimental perspective, in-situ high energy X-ray diffraction (HEXRD) from a synchrotron source was conducted during the uniaxial tension along the rolling direction (RD) and the transverse direction (TD) to measure the lattice strain evolutions and stress-strain behaviors. In the modeling perspective, crystal plasticity finite element (CPFE) model was developed incorporating the deformation twinning for the HCP-structured metals. The HEXRD experiments and crystal plasticity models were then coupled to characterize the constitutive behaviors of the ZEK100 alloy. The lattice strain data representing the microscopic behavior of the material and the macroscopic stress-strain behavior were then tied together as objective values to estimate the critical resolved shear stress (CRSS) and hardening parameters of available slip and twin systems of the ZEK100 alloy using the developed CPFE model. The stress-strain behavior as well as the lattice strain variation during the uniaxial tension tests are presented using the CPFE model and compared with the actual HEXRD data.

36 MATERIALS SCIENCE↗
DOE OSTI2018

Nanoscale Solute Partitioning and Carbide Precipitation in a Multiphase TRIP Steel Analyzed by Atom Probe Tomography

Nanoscale solute partitioning across multiple constituent phases in a 980-grade quenched and partitioned (Q&P) steel was analyzed using atom probe tomography (APT). The Q&P process was used to increase the C content in the retained austenite phase thereby improving its stability under plastic straining. Significant carbon enrichment of austenite was measured with decreased levels of C in martensite and almost depleted C content in ferrite, supporting the C partitioning mechanism in the literature. The APT analysis of retained austenite surrounded by martensite demonstrated a higher amount of C content compared with retained austenite surrounded by the ferrite phase. Lath and discrete carbide particle precipitation was also observed inside martensite colonies, tying up C and reducing the total amount of C available for austenite stabilization. In addition, the partitioning of Mn and other minor elements was quantitatively investigated by correlating APT and SEM-EBSD. Furthermore, these techniques provide a robust methodology for analyzing nanoscale compositional partitioning in multiphase steels, TRIP steels in particular, which can be used to better explain their microstructure-mechanical property relationships.

36 MATERIALS SCIENCE↗
DOE OSTI2018

Device-scale CFD modeling of gas-liquid multiphase flow and amine absorption for CO2 capture

In this paper we aim to develop a validated device-scale CFD model that can predict quantitatively both hydrodynamics and CO2 capture efficiency for an amine-based solvent absorber column with random Pall ring packing. A Eulerian porous-media approach and a two-fluid model were employed, in which the momentum and mass transfer equations were closed by literature-based empirical closure models. We proposed a hierarchical approach for calibrating the parameters in the closure models to make them accurate for the packed column. Specifically, a parameter for momentum transfer in the closure was first calibrated based on data from a single experiment. With this calibrated parameter, a parameter in the closure for mass transfer was next calibrated under a single operating condition. Last, the closure of the wetting area was calibrated for each gas velocity at three different liquid flow rates. For each calibration, cross validations were pursued using the experimental data under operating conditions different from those used for calibrations. This hierarchical approach can be generally applied to develop validated device-scale CFD models for different absorption columns.

Pan, Wenxiao↗
DOE OSTI2018

In Situ Local Measurement of Austenite Mechanical Stability and Transformation Behavior in Third-Generation Advanced High-Strength Steels

Austenite mechanical stability, i.e., retained austenite volume fraction (RAVF) variation with strain, and transformation behavior were investigated for two third generation advanced high strength steels (3GAHSS) under quasi-static uniaxial tension: a 1200 grade, two-phase medium Mn (10 wt%) TRIP steel, and a 980 grade, three-phase TRIP steel produced with a quenching and partitioning heat treatment. The Mn (10 wt%) TRIP steel deforms inhomogeneously via propagative instabilities (Lüders and Portevin Le Châtelier-like bands) while the 980 grade TRIP steel deforms homogenously up to necking. The dramatically different deformation behaviors of these steels required the development of a new in-situ experimental technique that couples volumetric synchrotron X-ray diffraction measurement of RAVF with surface strain measurement using stereo digital image correlation (DIC) over the beam impingement area. Measurement results with the new technique are compared with those from a more conventional approach wherein strains are measured over the entire gauge region while RAVF measurement is the same as that in the new technique. A determination is made as to the appropriateness of the different measurement techniques in measuring the transformation behaviors for steels with homogeneous and inhomogeneous deformation behaviors. Here, extension of the new in-situ technique to the measurement of austenite transformation under different deformation modes and to higher strain rates is discussed.

36 MATERIALS SCIENCE↗
DOE OSTI2018

On Process, Structure, Property Relationships in Impact Welding of Aluminum 6061 and Steel 4130

Vaporizing Foil Actuator Welding process was used to weld 1mm thick aluminum alloy 6061 sheet to 3.2 mm thick 4130 grade steel plate. Temporal evolution of the flyer sheet velocity was recorded at four locations on the flyer sheet using photonic Doppler velocimetry. The welded samples were subjected to mechanical and microstructural characterization. Although the welded interface did not show a very wavy characteristic, the welds had substantial strength. Welds made with a softer temper, T4 alloy were found to be stronger than the one created with a harder, T6 temper alloy. A coupled Lagrangian-Eulerian numerical framework was also utilized to predict the structure of the interface based on the measured velocity profile. The model also depicted absence of large waves although the jetting phenomenon was observed, thereby providing insight into necessary conditions for impact welding.

Mao, Yu↗
DOE OSTI2018

Linking process and structure in the friction stir scribe joining of dissimilar materials: A computational approach with experimental support

We present that friction stir welding (FSW) is a popular technique to join dissimilar materials in numerous applications. The solid state nature of the process enables joining materials with strikingly different physical properties. For welds in lap configuration, an enhancement to this technology is made by introducing a short, hard insert, referred to as a cutting-scribe, at the bottom of the tool pin. The cutting-scribe induces deformation in the bottom plate which leads to the formation of mechanical interlocks or hook like structures at the interface of two materials. A thermo-mechanical computational model employing a coupled Eulerian-Lagrangian approach is developed to quantitatively capture the morphology of these interlocks during the FSW process. Simulations using this model are validated by experimental observations. In conclusion, the identified interface morphology coupled with the predicted temperature field from this process–structure model can be used to estimate the post-weld microstructure and joint strength.

36 MATERIALS SCIENCE↗
DOE OSTI2018

Role of pyroptosis in normal cardiac response to calorie restriction and starvation

Highlights: • Moderate and severe caloric restriction exert different effect on cardiomyocytes. • Moderate caloric restriction alleviates the progression of pyroptosis. • Severe caloric restriction promotes the progression of pyroptosis. An unhealthy diet is a major risk factor for cardiac diseases. Most researches focus on high fat diet, little is known about the detrimental effects of starvation on heart.

60 APPLIED LIFE SCIENCES↗
DOE OSTI2018

A Numerical Study of Two-Phase Flow and Interfacial Mass Transfer in a Wetted Wall Column for Counter-Current Gas Absorption

We present a numerical study to investigate the effects of surface waves of falling films on the mass transfer from flowing gas phase into the liquid film. The model employs the volume of fluid method to explicitly track the gas-liquid phase interface and a one-fluid formulation to model the multiphase flow coupled with mass transfer between the two phases. The surface waves are generated by the time-varying injection rate of the falling film. The effects of surface wave frequencies and amplitudes on the overall mass transfer also are investigated for a counter-current gas-liquid flow of oxygen and water. Because of the solubility difference in the two phases, the model can capture the concentration discontinuity across the liquid-gas interface. Good agreement is obtained between the numerical results and experimental data reported in the literature. By systematically varying the frequencies and amplitudes of flow rate for the falling film, the surface waves generated on the film surface enhance mass transfer in general. Here, the model prediction shows a proportional increase in mass transfer for small frequencies of surface waves, but saturation at higher frequencies.

42 ENGINEERING↗
DOE OSTI2017

Effects of heat exchanger tubes on hydrodynamics and CO 2 capture of a sorbent-based fluidized bed reactor

In virtual design and scale up of pilot-scale carbon capture systems, the coupled reactive multiphase flow problem must be solved to predict the adsorber’s performance and capture efficiency under various operation conditions. This paper focuses on the detailed computational fluid dynamics (CFD) modeling of a pilot-scale fluidized bed adsorber equipped with vertical cooling tubes. Multiphase Flow with Interphase eXchanges (MFiX), an open-source multiphase flow CFD solver, is used for the simulations with custom code to simulate the chemical reactions and filtered models to capture the effect of the unresolved details in the coarser mesh for simulations with reasonable simulations and manageable computational effort. Previously developed two filtered models for horizontal cylinder drag, heat transfer, and reaction kinetics have been modified to derive the 2D filtered models representing vertical cylinders in the coarse-grid CFD simulations. The effects of the heat exchanger configurations (i.e., horizontal or vertical) on the adsorber’s hydrodynamics and CO2 capture performance are then examined. The simulation result subsequently is compared and contrasted with another predicted by a one-dimensional three-region process model.

bubbling bed↗
DOE OSTI2017

Deformation mode and strain path dependence of martensite phase transformation in a medium manganese TRIP steel

The martensite phase transformation dependence upon deformation modes and strain paths in a medium manganese (10 wt%) TRIP steel stamped into a T-shape panel was quantified through combination of 3D digital image correlation and synchrotron X-ray diffraction. The T-shape emulates a portion of a common anti-intrusion component. The stamping speed was kept intentionally slow (1 mm/s) so as to avoid excessive heat generation. The steel, which belongs to the third generation advanced high strength steel (3GAHSS) family, was chosen for two reasons: (1) it is two-phase, i.e. austenite and ferrite, with martensite resulting from deformation-induced phase transformation; (2) the 66 vol.% initial retained austenite volume fraction (RAVF) enabled a thorough examination of the martensite phase transformation at large deformation levels without exhaustion. Strain fields were coupled with measured RAVF values of small specimens extracted from specific locations on a formed T-shape panel. This enabled an exploration of the effects of linear, bilinear, and non-linear strain paths as well as deformation modes such as tension, plane strain, biaxial tension, and equibiaxial tension. Results suggest a significant martensite phase transformation dependence on deformation mode and strain path in the absence of fracture and when martensite phase transformation is unaffected by heat generated during forming. In general, the uniaxial and biaxial tension deformation modes facilitate the martensite phase transformation, while the smallest amount of martensite phase transformation occurs under plane strain. In conclusion, some discussion as to further application of the experimental methods detailed in this study to other 3GAHSS and the effects of fracture on martensite phase transformation is provided.

36 MATERIALS SCIENCE↗
DOE OSTI2017

Hierarchical calibration and validation framework of bench-scale computational fluid dynamics simulations for solvent-based carbon capture. Part 2: Chemical absorption across a wetted wall column: Original Research Article: Hierarchical calibration and validation framework of bench-scale computational fluid dynamics simulations

Part 1 of this paper presents a numerical model for non-reactive physical mass transfer across a wetted wall column (WWC). In Part 2, we improved the existing computational fluid dynamics (CFD) model to simulate chemical absorption occurring in a WWC as a bench-scale study of solvent-based carbon dioxide (CO 2 ) capture. In this study, to generate data for WWC model validation, CO 2 mass transfer across a monoethanolamine (MEA) solvent was first measured on a WWC experimental apparatus. The numerical model developed in this work can account for both chemical absorption and desorption of CO 2 in MEA. In addition, the overall mass transfer coefficient predicted using traditional/empirical correlations is conducted and compared with CFD prediction results for both steady and wavy falling films. A Bayesian statistical calibration algorithm is adopted to calibrate the reaction rate constants in chemical absorption/desorption of CO 2 across a falling film of MEA. The posterior distributions of the two transport properties, i.e., Henry's constant and gas diffusivity in the non-reacting nitrous oxide (N 2 O)/MEA system obtained from Part 1 of this study, serves as priors for the calibration of CO 2 reaction rate constants after using the N 2 O/CO 2 analogy method. Finally, the calibrated model can be used to predict the CO 2 mass transfer in a WWC for a wider range of operating conditions.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2017

A discrete element method-based approach to predict the breakage of coal

Pulverization is an essential pre-combustion technique employed for solid fuels, such as coal, to reduce particle sizes. Smaller particles ensure rapid and complete combustion, leading to low carbon emissions. Traditionally, the resulting particle size distributions from pulverizers have been informed by empirical or semi-empirical approaches that rely on extensive data gathered over several decades during operations or experiments. However, the predictive capabilities for new coals and processes are limited. This work presents a Discrete Element Method based computational framework to predict particle size distribution resulting from the breakage of coal particles characterized by the coal’s physical properties. The effect of certain operating parameters on the breakage behavior of coal particles also is examined.

Brazilian Test.↗
DOE OSTI2017

Effects of Bi Addition on the Microstructure and Mechanical Properties of Nanocrystalline Ag Coatings

Here in this study we investigated the effects of Bi addition on the microstructure and mechanical properties of an electrodeposited nanocrystalline Ag coating. Microstructural features were investigated with transmission electron microscopy (TEM). The results indicate that the addition of Bi introduced nanometer-scale Ag-Bi solid solution particles and more internal defects to the initial Ag microstructures. The anisotropic elastic-plastic properties of the Ag nanocrystalline coating with and without Bi addition were examined with nanoindentation experiments in conjunction with the recently-developed inverse method. The results indicate that the as-deposited nanocrystalline Ag coating contained high mechanical anisotropy. With the addition of 1 atomic percent (at%) Bi, the anisotropy within Ag-Bi coating was very small, and yield strength of the nanocrystalline Ag-Bi alloy in both longitudinal and transverse directions were improved by over 100% compared to that of Ag. On the other hand, the strain-hardening exponent of Ag-Bi was reduced to 0.055 from the original 0.16 of the Ag coating. Furthermore, the addition of Bi only slightly increased the electrical resistivity of the Ag-Bi coating in comparison to Ag. Lastly, results of our study indicate that Bi addition is a promising method for improving the mechanical and physical performances of Ag coating for electrical contacts.

36 MATERIALS SCIENCE↗
DOE OSTI2017

Breakup of a liquid rivulet falling over an inclined plate: Identification of a critical Weber number

Here, we have numerically investigated the breakup of a rivulet falling over a smooth inclined plate using the volume of fluid method. The breakup the rivulet is a complex phenomenon that is dictated by many factors, such as solvent properties, contact angle, inertia, plate inclination, etc. An extensive simulation campaign was conducted wherein these factors were systematically investigated. Regimes for a stable rivulet and an unstable rivulet that leads to the breakup and formation of a droplet are examined in terms of a critical value of the Weber number (We cr ) that delineates these regimes. The effect of plate inclination on the breakup of the rivulet shows that the critical Weber number decreases with increased inclination angle (θ) owing to higher liquid velocity. However, the effect is negligible beyond θ > 60°. The impact of solvent properties is characterized using the Kapitza number (Ka). Variation of We cr with Ka shows two trends depending on the Ka value of the solvent. Solvents with lower Ka values, corresponding to high viscosities and/or low surface tensions, show smaller values of the critical Weber number and the variation is linear. While solvents with higher Ka values exhibit higher values of the We cr and the variation in We cr is steep. This behavior is more pronounced with increasing contact angle. Higher contact angles promote rivulet breakup so that inertia must be higher to the breakup. As a result, a phenomenological scaling for a critical Weber number with the Kapitza number and contact angle is presented that can offer insight into rivulet breakup.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2017

Predicting the performance uncertainty of a 1-MW pilot-scale carbon capture system after hierarchical laboratory-scale calibration and validation

A challenging problem in designing pilot-scale carbon capture systems is to predict, with uncertainty, the adsorber performance and capture efficiency under various operating conditions where no direct experimental data exist. Motivated by this challenge, we previously proposed a hierarchical framework in which relevant parameters of physical models were sequentially calibrated from different laboratory-scale carbon capture unit (C2U) experiments. Specifically, three models of increasing complexity were identified based on the fundamental physical and chemical processes of the sorbent-based carbon capture technology. Results from the corresponding laboratory experiments were used to statistically calibrate the physical model parameters while quantifying some of their inherent uncertainty. The parameter distributions obtained from laboratory-scale C2U calibration runs are used in this study to facilitate prediction at a larger scale where no corresponding experimental results are available. In this paper, we first describe the multiphase reactive flow model for a sorbent-based 1-MW carbon capture system then analyze results from an ensemble of simulations with the upscaled model. The simulation results are used to quantify uncertainty regarding the design’s predicted efficiency in carbon capture. In particular, we determine the minimum gas flow rate necessary to achieve 90% capture efficiency with 95% confidence.

bubbling bed↗
DOE OSTI2017

Hierarchical calibration and validation for modeling bench-scale solvent-based carbon capture. Part 1: Non-reactive physical mass transfer across the wetted wall column

A hierarchical model calibration and validation are proposed here for quantifying the confidence level of mass transfer prediction using a computational fluid dynamics (CFD) model, where the solvent-based carbon dioxide (CO 2 ) capture is simulated and the predicted results are compared to the corresponding bench-scale experimental data. Two unit problems with an increasing level of complexity are proposed to break down the complex physical/chemical processes of solvent-based CO 2 capture into relatively simpler problems to separate the effects of physical transport and chemical reaction. This paper focuses on the calibration and validation of the first unit problem, i.e., the CO 2 mass transfer across a falling ethanolamine (MEA) film in the absence of chemical reaction. This problem is investigated both experimentally and numerically using non-reactive nitrous oxide (N 2 O) as a surrogate for CO 2 . To capture motion of the gas-liquid interface, a volume of fluid method is employed with a one-fluid formulation to compute the mass transfer between the two phases. Parallel bench-scale experiments are designed and conducted to validate and calibrate the CFD models using a general Bayesian calibration approach. Two important transport parameters, Henry's constant and gas diffusivity, are calibrated to produce the posterior distributions, which will be used as input for the second unit problem to address the chemical absorption of CO 2 across the MEA falling film, where both mass transfer and chemical reaction are involved. Finally, mass transfer coefficients predicted by CFD are also compared with those predicted by the traditional/empirical correlations under both steady and wavy falling film conditions.

54 ENVIRONMENTAL SCIENCES↗