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At least 325 records · Page 18

Quantifying uncertainty in the process-structure relationship for Al–Cu solidification

Phase field method (PFM) is a simulation tool to predict microstructural evolution during solidification and is helpful to establish the process-structure relationship for alloys. The robustness of the relationship however is affected by model-form and parameter uncertainties in PFM. In this paper, the uncertainty associated with the thermodynamic and process parameters of PFM is studied and quantified. Surrogate modeling is used to interpolate four quantities of interests (QoIs), including dendritic perimeter, area, primary arm length, and solute segregation, as functions of thermodynamic and process parameters. A sparse grid approach is applied to mitigate the curse-of-dimensionality computational burden in uncertainty quantification. Polynomial chaos expansion is employed to obtain the probability density functions of the QoIs. The effect of parameter uncertainty on the Al–Cu dendritic growth during solidification simulation are investigated. Here, the results show that the dendritic morphology varies significantly with respect to the interface mobility and the initial temperature.

36 MATERIALS SCIENCE↗

Microstructural Pattern Formation during Far-from-Equilibrium Alloy Solidification

We introduce a new phase-field formulation of rapid alloy solidification that quantitatively in- corporates non-equilibrium effects at the solid-liquid interface over a very wide range of interface velocities. Simulations identify a new dynamical instability of dendrite tip growth driven by solute trapping at velocities approaching the absolute stability limit. They also reproduce the formation of the widely observed banded microstructures, revealing how this instability triggers transitions between dendritic and microsegregation-free solidification. Predicted band spacings agree quantita- tively with observations in rapidly solidified Al-Cu thin films.

36 MATERIALS SCIENCE↗

Numerical Simulation of Solidification of Colloids Inside a Differentially Heated Cavity

Development of the solid–liquid interface, distribution of the particle concentration field, as well as the development of thermosolutal convection during solidification of colloidal suspensions in a differentially heated cavity are investigated. The numerical model is based on the one-fluid mixture approach combined with the single-domain enthalpy porosity model for phase change, and it is implemented in FLUENT software package. The linear dependence of the liquidus and solidus temperatures with the concentration of the nanoparticles was assumed. A colloidal suspension consisting of water and copper or alumina nanoparticles were considered. In the current investigation, the nanoparticle size selected was 5 and 2 nm. The suspension was solidified unidirectionally inside a square differentially heated cavity that was cooled from the left side. It was found that the solid–liquid interface changed its morphology from a planar shape to a dendritic one as the solidification process proceeds in time, due to the constitutional supercooling that resulted from the increased concentration of particles at the solid–liquid interface rejected from the crystalline phase. Initially, the flow consisted of two vortices rotating in opposite directions. However, at later times, only one counter clockwise rotating cell survived. Changing the material of the particle to alumina resulted in crystallized phase with a higher concentration of particles. If it is compared to that of the solid phase resulted from freezing the copper–water colloidal suspension. Furthermore, decreasing the segregation coefficient destabilizes the solid–liquid interface and increases the intensity of the convection cell with respect to that of the case of no particle rejection. At slow freezing rates, the resulting crystal phase consisted of lower particle content compared to the case of higher freezing rate.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Numerical Study and Validation of Melting and Solidification in PCM Embedded Heat Exchangers with Straight Tube

Latent heat thermal energy storage (LHTES) systems have shown great potential to enable reliable use of renewable energy and load shifting. LHTES offer high storage density and release energy at near constant temperature because of its use of phase change materials (PCMs). The cylindrical PCM heat exchangers (PCMHX) are one of the most used technologies due to their simplicity. Numerical models for such PCMHX enable engineers to estimate their performance for different design parameters and operating conditions without having to test them all. However, modeling the phase change phenomena can be challenging. To better understand the difficulties involving accurate modeling of PCMHX, a cylindrical latent storage unit filled with PCM and water as in-tube heat transfer fluid (HTF) is numerically investigated. This paper presents a study based on a 2D-axisymmetric model of a straight tube embedded in PCM in a cylindrical container. CFD is used to study the charging (melting) and discharging (solidification) phenomena. The models are validated against experimental and numerical data from the literature. The predicted local PCM temperature profile over time agrees within 2K compared to the experimental values. The paper also presents a simple method to estimate the melting and solidification phase change temperature range from limited data provided by PCM manufacturers.

PCM, melting, solidification, CFD, heat exchanger↗

Experience of Non-Technological Waste Solidification with Polymers at Radium Institute - 13530

In the run of scientific and production activities in Radium Institute there are generated the liquid radioactive wastes (LRW) of the most various compositions, which are partially processed (with the use of cementation technology) as accumulated and removed to the special-purpose enterprise ('Radon') for a long-term storage. The process of cementation has wide practical application including the use for a long time at Radium Institute for solidification of aqueous solutions. One of the problems appearing at laboratory waste processing consists in a presence of organic substances in aqueous solutions and high acid concentration. Solidification of such waste (water-organic) also runs into a number of serious difficulties due to organic liquid and cement incompatibility. In this connection, development of advanced technologies with using high-tech polymers seems to be quite justified. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

Geo-polymer solidification technology approved by Czech / Slovak nuclear authority to immobilise NPP resins and sludge waste - 15555

This paper presents the features and performance record of the geo-polymer solidification technology, SIAL{sup R}, licensed for use by both the Slovakian (UJD SR) and Czech Nuclear (SUJB) regulators. An overview of its performance at Bohunice in Slovakia, where it has been used to successfully treat resins and sludge wasteforms will be provided along with references to other plants where it has been used. More recently, geo-polymers have been noted as an immobilization technology which shows potential for resins produced by treatment of radioactive contaminated water resulting from the clean-up of the Fukushima Daiichi Plant. The Nuclear Power Plant A-1 located in Jaslovske Bohunice was completed in 1972 and operated for 5 years until two accidents in 1976 and 1977. After the second accident in February 1977 (INES level 4) the Nuclear Power Plant was permanently shut down for decommissioning. Fuel assemblies and fuel cladding damaged in the accidents led to significant Sr-90, Cs-137 and transuranic contamination. As a consequence of the long-term corrosion of the barrier's material, highly contaminated sludge accumulated which could not be effectively immobilized using conventional methods such as cementation or bitumen treatment due to adverse physical-chemical properties and high specific activity of the waste (Cs-137). This challenge led to AMEC developing and licensing the geo-polymer, SIAL{sup R}. Today, this geo-polymer is one of the most proven and widely used for on-site solidification of radioactive materials such as sludge, resins, sorbents and organic liquids. There are numerous benefits to using this geo-polymer for waste immobilisation. It can be used at room temperature and can incorporate up to approximately four times as much waste (sludge, resin) as a Portland cement matrix equivalent depending on the waste being treated. In addition, it is characterized by excellent mechanical and physical properties, compared with the earlier generation techniques. This includes higher mechanical strength, lower leachability, low volatility, posing a low fire risk and excellent physical stability in the presence of frost and water (no distortion or cracking). Dedicated facilities to receive and encapsulate waste from different locations can be created but this geo-polymer can also provide efficient and practical on-site treatment of radioactive waste streams. This is achievable because the equipment used to encapsulate waste using SIAL{sup R} is also modular, flexible and versatile. At Bohunice, the facility for encapsulation was designed to occupy existing areas of the plant in close proximity to the tanks where the waste was being stored. This allowed for the removal of the waste using Remote Operated Vehicles (ROVs) and for the waste to be immediately treated on site without the need for transportation saving both time and resource. To achieve this, some of the rooms and areas of the building were assessed and modified to ensure that the waste package flow was suitable whilst ensuring that appropriate safety measures were in place such as adequate shielding to reduce or entirely eliminate dose uptake of workers. To date, SIAL{sup R} has been used to successfully immobilize approximately 500 tons of waste which includes sludge and resin from Bohunice, Slovakia and approximately 250 m{sup 3} of spent ion exchange resins from tanks on site at the Dukovany nuclear plant, Czech Republic. It now has a track record of over 15 years which includes on-going research and development. The International missions WANO and OSART evaluated the SIAL{sup R} matrix technology at NPP Dukovany as an example of good practice. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

Development of Cement Solidification Technique for Sodium Borate Waste Produced in PWR Plants - 16061

A cement solidification process for treating sodium borate waste produced in pressurized water reactor (PWR) plants was studied. It is known that the setting and hardening reaction of cement is retarded by the presence of boron compounds. This technique was developed to obtain high uniaxial compressive strength more than 10 MPa which can satisfy various countries disposal regulations. As examples of disposal regulations, France requires 8 MPa for homogeneous solidified products. The sodium/ boron (Na/B) ratio was controlled to about 1 by adding NaOH to simulated liquid waste for the purpose of improving the workablility and mechanical strength. To obtain high volume reduction, simulated liquid waste was dehydrated and powdered by using a wiped film evaporator. Ordinary portland cement (OPC) was used for the solidification. The viscosity of cement mixture was controlled by the water/cement ratio. The resulting viscosity became less than 25 dPa.s, and it was possible to continuously mix the mixture. Solidified cement with containing 73 kg/m{sup 3} of boron had a uniaxial compressive strength of more than 10 MPa. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

Studies on Workability of Geopolymer Solidification - 18171

In Japan, intermediate-level radioactive waste, such as spent resin, is solidified and set in sealed containers without venting. To reduce the amount of hydrogen generated due to water radiolysis in stored intermediate-level waste, geopolymer solidification has been studied. Geopolymer solidification is an excellent method for conditioning intermediate-level waste from the viewpoint of its high thermal stability and low processing cost. However, it has a problem that the apparent viscosity increases drastically a few minutes after the onset of setting. This may cause some trouble in the process of pouring the geopolymer into drums and mixing it with waste. In this study, in order to control the workability of a geopolymer mixture, we investigated the effects of the compounding ratio and the kinds of chemical agents used. We confirmed that the geopolymer reaction was slowed down by reducing the amount of calcium and adding boron. The uniaxial compressive strength of the geopolymer was 3-80 MPa. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

Solidification of Low and Intermediate Level Waste - A Comparison between Different Methods - 19584

The treatment of radioactive materials results in products that have to be suitable for a period of interim storage as well as for disposal in a repository. Considering available options for treatment of radioactive waste, future disposal also has to be taken into account. Up to now, only cementation and encapsulation in geopolymer (only to limited extent) are relevant treatment methods for the solidification of German waste for disposal in the repository Grube Konrad. However, a synopsis of other solidification technologies is considered to be helpful in order to be prepared for future developments in the fields of radioactive waste treatment. Treatment methods addressed in this paper are: - Cementation; - Encapsulation into geopolymer matrix; - Vitrification; - SYNROC; - Geomelting. The criteria for evaluation of the treatment methods are as follows: - Requirements concerning waste properties; - Safety of treatment facilities; - Fulfillment of waste acceptance criteria for repository Grube Konrad; - Fulfillment of requirements for near surface disposal; - Suitability for long-term interim storage. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

Influence of Solidification Velocity on Partitioning and Precipitate Evolution in a Multicomponent, Soft Magnetic Alloy Processed by Laser Melting

Multicomponent alloys have recently been shown to overcome the structural-functional barrier associated with soft magnetic materials. Here, single laser tracks have been used to investigate the effects of solidification velocity on the Al 7 Fe 32.6 Co 27.7 Ni 27.7 Ta 5 (at pct) alloy. Ta-rich cell wall partitioning was shown to affect the final distribution and size of the precipitating L1 2 phase, after aging. These findings demonstrate that solidification rate control offers the potential to tailor localized performance in alloys with size-dependent precipitation properties.

Brookins, Jeffrey M. [Oak Ridge National Laborator↗

In-Situ Synchrotron X-Ray Diffraction of Ultrasonic Microstructural Refinement During Solidification in a Commercial Al–Si–Mg Alloy

This study reports the first use of in-situ synchrotron X-ray diffraction (SXRD) to study the effects of ultrasonic melt processing (USMP) on phase and grain size evolution during solidification in a commercial Al–Si–Mg casting alloy. USMP is a technique that, when applied to aluminum as it solidifies, can be used to refine the local microstructure of large-scale castings. Analysis of the in-situ SXRD data to estimate the average grain size of primary α-Al grains during USMP demonstrates that USMP slows the growth rate of α-Al grains and reduces grain size by 36 pct. Furthermore, there is also evidence that USMP causes the primary α-Al grains to move relative to the X-ray beam; such motion increases the probability of primary α-Al grains colliding and fragmenting. This movement becomes constrained at the onset of the Al–Si binary eutectic, suggesting that USMP ceases to effectively refine the microstructure once the Al–Si binary eutectic begins to form. Complementary laboratory-scale X-ray diffraction (XRD) data were used to correlate the lattice parameters of the α-Al and Si (D-A4) phases with temperature to estimate cooling rate during solidification. Thus, this study can guide the design of novel castings with spatially distributed fine-grained regions produced using local ultrasonic processing.

Aluminum Alloys↗

Orientation Dependence of Columnar Dendritic Growth with Sidebranching Behaviors in Directional Solidification: Insights from Phase-Field Simulations

In this study, a thin-interface phase-field model was employed to study the orientation dependence of the columnar dendritic growth with sidebranching behaviors in directional solidification. It was found that the dimensionless tip undercooling increases with the increase of misorientation angle for three pulling velocities. The primary spacing is found to be a function of misorientation angle, and the dimensionless primary spacing with respect to the misorientation angle follows the orientation correction given by Gandin and Rappaz (Acta. Metall. 42:2233–2246, 1994). For the analysis of the dendritic tip, the two-dimensional (2-D) form of the nonaxisymmetric needle crystal was used to determine the radius of the tilted columnar dendrite. Based on the definitions of open side and constrained side of the dendrite, the analysis of the width active sidebranches and the dendritic area in 2-D with respect to the distance from the dendritic tip was carried out to investigate the asymmetrical dendrite envelop and sidebranching behaviors on the two sides in directional solidification. The obtained prefactor and exponent with respect to misorientation angle are discussed, showing that the sidebranching behaviors of a tilted columnar dendritic array obey a similar power-law relationship with that of a free dendritic growth.

36 MATERIALS SCIENCE↗

Rapid Solidification and Phase Transformations in Additive Manufactured Materials

Within the past few years, additive manufacturing (AM) has emerged as a promising manufacturing technique to enable the production of complex engineering structures with high efficiency and accuracy. Among the important factors establishing AM as a sustainable manufacturing process is the ability to control the microstructures and properties of AM products. In most AM processes, such as laser sintering (LS), laser melting (LM), and laser metal deposition (LMD), rapid solidification and high-temperature phase transformations play primary roles in determining nano- and microstructures, and consequently the mechanical and other properties of AM products. This topic of JOM is dedicated to summarizing the current research efforts in the area of rapid solidification and phase transformations in additively manufactured materials. Finally, a brief summary follows below of 10 journal articles in this topic.

36 MATERIALS SCIENCE↗

Convection Effects During Bulk Transparent Alloy Solidification in DECLIC-DSI and Phase-Field Simulations in Diffusive Conditions

In order to study the dynamical formation and evolution of cellular and dendritic arrays under diffusive growth conditions, three-dimensional (3D) directional solidification experiments were conducted in microgravity on a model transparent alloy onboard the International Space Station using the Directional Solidification Insert in the DEvice for the study of Critical LIquids and Crystallization. Selected experiments were repeated on Earth under gravity-driven fluid flow to evidence convection effects. Both radial and axial macrosegregation resulting from convection are observed in ground experiments, and primary spacings measured on Earth and microgravity experiments are noticeably different. The microgravity experiments provide unique benchmark data for numerical simulations of spatially extended pattern formation under diffusive growth conditions. The results of 3D phase-field simulations highlight the importance of accurately modeling thermal conditions that strongly influence the front recoil of the interface and the selection of the primary spacing. The modeling predictions are in good quantitative agreements with the microgravity experiments.

36 MATERIALS SCIENCE↗

Effects of Solidification Cooling Rates on Microstructures and Physical Properties of Fe-6.5%Si Alloys

Compared to the widely used Fe-3.2wt%Si steel, Fe-6.5wt%Si has superior electric and magnetic properties, including higher electrical resistivity, lower iron loss, higher permeability, and near zero magnetostriction. However, Fe-6.5wt%Si sheet is difficult to produce using traditional manufacturing processes as the high silicon content favors the formation of ordered phases that embrittle the material. Fortunately, these ordered phases can be suppressed if the alloy is cooled fast enough from a high temperature kinetically trapping the disordered solid solution or amorphous state. Planar flow casting is known for its rapid solidification rate. In order to consider it as a viable method to manufacture ductile Fe-6.5wt%Si sheets, the effect of cooling rate on physical properties of Fe-6.5wt%Si alloy are systematically investigated. In this work, various cooling rates are achieved by changing melt-spin wheel speeds, which significantly affect the solidification temperature profile and have profound effects on ordering, microstructures, textures, hardness, and magnetic properties. High cooling rates result in refined grains, reduced ordering, enhanced <100> out of the plane texture, decreased hardness, and increased coercivity. This study demonstrates a critical cooling rate at ~1.7 × 10 5 K/s, corresponding to a tangential wheel speed of 5-7 m/s, below which the hardness significantly increases in agreement with the sudden increase of the ordered phases that causes the material embrittlement.

36 MATERIALS SCIENCE↗

Verification and validation of a rapid heat transfer calculation methodology for transient melt pool solidification conditions in powder bed metal additive manufacturing

A fundamental understanding of spatial and temporal thermal distributions is crucial for predicting solidification and solid-state microstructural development in parts made by additive manufacturing. While sophisticated numerical techniques that are based on finite element or finite volume methods are useful for gaining insight into these phenomena at the length scale of the melt pool (100 - 500 µm), they are ill-suited for predicting engineering trends over full part cross-sections (> 10 x 10 cm) or many layers over long process times (> many days) due to the necessity of fully resolving the heat source characteristics. On the other hand, it is extremely difficult to resolve the highly dynamic nature of the process using purely in-situ characterization techniques. This article proposes a pragmatic alternative based on a semi-analytical approach to predicting the transient heat conduction during powder bed metal additive manufacturing process. The model calculations were theoretically verified for selective laser melting of AlSi10Mg and electron beam melting of IN718 powders for simple cross-sectional geometries and the transient results are compared to steady state predictions from the Rosenthal equation. It is shown that the transient effects of the scan strategy create significant variations in the melt pool geometry and solid-liquid interface velocity, especially as the thermal diffusivity of the material decreases and the pre-heat of the process increases. With positive verification of the strategy, the model was then experimentally validated to simulate two point-melt scan strategies during electron beam melting of IN718, one intended to produce a columnar and one an equiaxed grain structure. Lastly, through comparison of the solidification conditions (i.e. transient and spatial variations of thermal gradient and liquid-solid interface velocity) predicted by the model to phenomenological CET theory, the model accurately predicted the experimental grain structures.

36 MATERIALS SCIENCE↗

Onset of magma ocean solidification on Mars inferred from Mn-Cr chronometry

The mantle of Mars probably differentiated through the crystallization of a magma ocean during the first tens of million years (Ma) of Solar System evolution. However, the exact timescale of large-scale silicate differentiation of the martian mantle is debated, and in particular, it remains unclear when differentiation commenced. In this paper, we applied the short-lived 53 Mn- 53 Cr system to martian meteorites in order to date the onset of large-scale mantle differentiation on Mars. The new Cr isotope data demonstrate that martian meteorites exhibit no resolvable radiogenic 53 Cr variations, and instead have a uniform +20.2±1.2 (95% conf.) parts-per-million excess in 53 Cr/ 52 Cr relative to the terrestrial mantle. The investigated groups of martian meteorites are lithologically varied and derive from diverse mantle sources that probably had variable Mn/Cr. Hence, the lack of 53 Cr variability among martian meteorites demonstrates that silicate differentiation on Mars occurred after the extinction of 53 Mn. Provided that the sources of the martian meteorites have Mn/Cr variations that are typical of the terrestrial planets, this result implies that the onset of large-scale silicate differentiation must have occurred later than 20±5 Ma after Solar System formation. The onset of silicate differentiation on Mars inferred here is significantly later than time estimates for segregation of the martian core which conservatively occurred within <10 Ma after Solar System formation. Thus, the new Mn-Cr data imply that there was a small, but resolvable, time gap of at least 5 Ma between core formation and magma ocean solidification on Mars. If the age of core segregation is taken at face value, our results imply that the martian magma ocean remained mostly molten over several Ma. This inferred longevity of the magma ocean is inconsistent with thermal models predicting rapid (<1 Ma) solidification of the martian magma ocean. Although there is currently no unique solution to this conundrum, our results can potentially be explained by a protracted history of impact bombardment that delayed differentiation in a shallow magma ocean on Mars, or perhaps more readily, by the presence of an early and dense atmosphere that acted as an insulator and prevented the magma ocean from cooling quickly.

58 GEOSCIENCES↗

Primary solidification of ternary compounds in Al-rich Al–Ce–Mn alloys

Primary solidification of ternary compounds Al 20 Mn 2 Ce and Al 10 Mn 2 Ce were analyzed through the coupling of the thermodynamic modeling and classic nucleation theory. Thermodynamic models of Al 20 Mn 2 Ce and Al 10 Mn 2 Ce were developed using the CALPHAD approach based on first-principles calculated enthalpy of formation and experimental data obtained from this work and the literature. The analysis suggested that despite the larger thermodynamic driving force for nucleation of Al 10 Mn 2 Ce, nucleation is preferred for the Al 20 Mn 2 Ce phase in the highly undercooled liquid due to its smaller interfacial energy. Therefore, manufacturing methods with rapid cooling rates will favor primary solidification of Al 20 Mn 2 Ce for Al-rich Al–Ce–Mn alloys.

36 MATERIALS SCIENCE↗