Materials Science and Engineering Commons^™

Formation Of Chromium-Iron Carbide By Carbon Diffusion In Alₓcocrfenicu High-Entropy Alloys, Mohsen Beyramali Kivy, Caitlin S. Kriewall, Mohsen Asle Zaeem

Materials Science and Engineering Faculty Research & Creative Works

Effect of the addition of carbon on phase formations in Al_xCoCrFeNiCu (x = 0.3, 1.5, 2.8) high-entropy alloys (HEAs) was studied. Free diffusion of carbon from graphite crucible resulted in the partitioning of the entire Cr from the matrix and the formation of the (Cr,Fe)₂₃C₆ phase in all HEAs. No other metal-carbide phase was detected. The formation of (Cr,Fe)₂₃C₆ enhanced the overall hardness of the HEAs. By increasing the amount of Al, the Cr amount decreased resulting in the reduction of carbon diffusion and volume fraction of the (Cr,Fe)₂₃C_{6 …}

Elucidating The Effect Of Water-To-Cement Ratio On The Hydration Mechanisms Of Cement, Aida Margarita Ley-Hernandez, Jonathan Lapeyre, Rachel Cook, Aditya Kumar, Dimitri Feys

Materials Science and Engineering Faculty Research & Creative Works

The hydration of cement is often modeled as a phase boundary nucleation and growth (pBNG) process. Classical pBNG models, based on the use of isotropic and constant growth rate of the main hydrate, that is, calcium-silicate-hydrate (C-S-H), are unable to explain the lack of any significant effect of the water-to-cement (w/c) ratio on the hydration kinetics of cement. This paper presents a modified form of the pBNG model, in which the anisotropic growth of C-S-H is allowed to vary in relation to the nonlinear evolution of its supersaturation in solution. Results show that once the supercritical C-S-H nuclei form, their …

Corrosion Resistance Of Pipeline Steel With Damaged Enamel Coating And Cathodic Protection, Liang Fan, Signo Tadeu Dos Reis, Genda Chen, Michael L. Koenigstein

Materials Science and Engineering Faculty Research & Creative Works

This paper presents the first report on the corrosion resistance of pipeline steel with damaged enamel coating and cathodic protection in 3.5 wt % NaCl solution. In particular, dual cells are set up to separate the solution in contact with the damaged and intact enamel coating areas, to produce a local corrosion resistance measurement for the first time. Enamel-coated steel samples, with two levels of cathodic protection, are tested to investigate their impedance by electrochemical impedance spectroscopy (EIS) and their cathodic current demand by a potentiostatic test. Due to its glass transition temperature, the enamel-coated pipeline can be operated on …

Efficiency Of Solid Inclusion Removal From The Steel Melt By Ceramic Foam Filter: Design And Experimental Validation, Soumava Chakraborty, Ronald J. O'Malley, Laura Bartlett, Mingzhi Xu

Materials Science and Engineering Faculty Research & Creative Works

An investigation was performed to measure the efficiency of solid alumina inclusion removal by filtration during casting. A mold design was developed using modeling software to produce two castings that fill simultaneously, one with a filter and the other without a filter. The design avoided vortex formation and thus air entrainment, which helped to avoid reoxidation inside the mold cavity. Samples from these castings were analyzed utilizing an SEM/EDS system with automated feature analysis (AFA) to measure the efficiency of inclusion removal using a 20 ppi zirconia foam filter. This study also documents the occurrence of inclusion flotation and agglomeration …

Effects Of The Tempering And High-Pressure Torsion Temperatures Onmicrostructure Of Ferritic/Martensitic Steel Grade 91, Artur Ganeev, Marina Nikitina, Vil Sitdikov, Rinat Islamgaliev, Andrew Hoffman, Haiming Wen

Materials Science and Engineering Faculty Research & Creative Works

Grade 91 (9Cr-1Mo) steel was subjected to various heat treatments and then to high-pressure torsion (HPT) at different temperatures. Its microstructure was studied using transmission electron microscopy (TEM) and X-ray diffraction (XRD). Effects of the tempering temperature and the HPT temperature on the microstructural features and microhardness in the ultrafine-grained (UFG) Grade 91 steel were researched. The study of the UFG structure formation takes into account two different microstructures observed: before HPT in both samples containing martensite and in fully ferritic samples.

Understanding Homogeneous Nucleation In Solidification Of Aluminum By Molecular Dynamics Simulations, A. Mahata, Mohsen Asle Zaeem, M. I. Baskes

Materials Science and Engineering Faculty Research & Creative Works

Homogeneous nucleation from aluminum (Al) melt was investigated by million-atom molecular dynamics simulations utilizing the second nearest neighbor modified embedded atom method potentials. The natural spontaneous homogenous nucleation from the Al melt was produced without any influence of pressure, free surface effects and impurities. Initially isothermal crystal nucleation from undercooled melt was studied at different constant temperatures, and later superheated Al melt was quenched with different cooling rates. The crystal structure of nuclei, critical nucleus size, critical temperature for homogenous nucleation, induction time, and nucleation rate were determined. The quenching simulations clearly revealed three temperature regimes: sub-critical nucleation, super-critical nucleation, …

Recent Advances In Study Of Solid-Liquid Interfaces And Solidification Of Metals, Mohsen Asle Zaeem

Materials Science and Engineering Faculty Research & Creative Works

Solidification occurs in several material processing methods, such as in casting, welding, and laser additive manufacturing of metals, and it controls the nano- and microstructures, as well as the overall properties of the products. Recent advancements in experimental and computational modeling techniques have made it possible to more effectively study atomistic and microscale mechanisms that control the solidification nano- and microstructures, and formation and evolution of solidification defects.

Multifunctional Cerium-Based Nanomaterials And Methods For Producing The Same, Matthew O'Keefe, William Fahrenholtz, Carlos E. Castano Londono

Materials Science and Engineering Faculty Research & Creative Works

Embodiments relate to a cerium-containing nano-coating composition, the composition including an amorphous matrix including one or more of cerium oxide, cerium hydroxide, and cerium phosphate; and crystalline regions including one or more of crystalline cerium oxide, crystalline cerium hydroxide, and crystalline cerium phosphate. The diameter of each crystalline region is less than about 50 nanometers.

Micro-Slotting Technique For Measurement Of Local Residual Stress In Metallic Materials, Elizabeth Anne Burns

Doctoral Dissertations

"Micro-slotting, a micro-scale relaxation residual stress measurement technique, has been shown in recent years to be a reliable method for measuring local residual stresses in metallic materials. This technique employs an SEM-focused ion beam system for milling and imaging, digital image correlation software to track displacements due to residual stress relaxation, and finite element analysis for interpolation of the original local stress state. In this research, a micro-slotting procedure was established using finite element models and was used to obtain sub-surface residual stress measurements on machined and shot peened planar Ti-6Al-4V samples. These measurements were compared to macro-scale XRD residual …

Quantitative Phase-Field Modeling Of Crack Propagation In Multi-Phase Materials, Arezoo Emdadi

Doctoral Dissertations

”Research presented in this dissertation is focused on developing and validating a computational framework for study of crack propagation in polycrystalline composite ceramics capable of designing micro-architectures of phases to improve fracture toughness and damage tolerance of ZrB₂-based ultra-high temperature ceramics (UHTCs). A quantitative phase-field model based on the regularized formulation of Griffith’s theory is presented for crack propagation in homogenous and heterogeneous brittle materials. This model utilizes correction parameters in the total free energy functional and mechanical equilibrium equation within the crack diffusive area to ensure that the maximum stress in front of the crack tip is …

Electrodeposited Epitaxial Cobalt Oxides And Copper Metal, Caleb M. Hull

Doctoral Dissertations

"Electrochemical deposition methods are presented for the deposition of Co(OH)₂ and Cu metal. Paper I shows the deposition of β-Co(OH)₂ on Ti through electrochemical reduction of [Co(en)₃]³⁺ to [Co(en)₃]²⁺ in 2M NaOH. The catalytic properties of the deposited Co(OH)₂ towards water oxidation is found comparable to Co₃O₄, with the surface of the Co(OH)₂ converting to CoOOH during the reaction. Paper II gives the conditions suitable for epitaxial growth of Co(OH)₂ on Au(100), Au(110), and Au(111) following the same reduction mechanism as described in Paper I. …

Soy-Based Polyurethane Foam For Insulation And Structural Applications, Gurjot S. Dhaliwal

Doctoral Dissertations

"Polyurethane (PU) foams are widely used as insulation materials due to their high insulation properties and low cost compared to conventional materials such as styrene and mineral wool. PU foams are traditionally fabricated with petroleum-based precursors. However, high crude price and higher carbon footprint has lead interest of researchers to synthesis PU foams using plant-based raw materials, that are inexpensive and renewable. In this dissertation, PU foams were fabricated using soy-based polyol and its thermal and mechanical properties were investigated. In the first part, of PU foam samples with different formulations were fabricated using soy-based polyol HB230, and varying amounts …

Functionalized Nanoporous Carbon Scaffolds For Hydrogen Storage Applications, Christopher L. Carr

Doctoral Dissertations

"Recent efforts have demonstrated confinement in porous scaffolds at the nanoscale can alter the hydrogen sorption properties of metal hydrides, though not to an extent feasible for use in onboard hydrogen storage applications, proposing the need for a method allowing further modifications. The work presented here explores how the functionalization of nanoporous carbon scaffold surfaces with heteroatoms can modify the hydrogen sorption properties of confined metal hydrides in relation to non-functionalized scaffolds (FS). Investigations of nanoconfined LiBH₄ and NaAlH₄ indicate functionalizing the carbon scaffold surface with nitrogen can shift the activation energy of hydrogen desorption in excess of …

Chemistry, Design, And Processing Of Two-Stage Trip Steel, Daniel M. Field

Doctoral Dissertations

"A regular solution model was developed to calculate the chemical driving force for α-martensite formation, ΔG^{λ→ α}_Chem. A model for the strain energy, ΔG^λ→α_str, was formulated utilizing the Young’s modulus (E), lattice misfit squared (δ²), and molar volume (Ω) which opposed the chemical driving force for α-martensite formation. The M^α_S was determined at a temperature at which ΔG^λ→α_Chem + ΔG^λ→α_str = 0. In conjunction with a previously developed ε-martensite model, a means of predicting the volume fraction of λ-austenite was determined; and it was shown that for values …

Multi-Scale Investigation Of Microstructure, Fiber-Matrix Bond, And Mechanical Properties Of Ultra-High Performance Concrete, Zemei Wu

Doctoral Dissertations

"The main objective of this study is to provide new insights into enhancing fiber-matrix bond and mechanical properties of ultra-high performance concrete (UHPC). Three main strategies were investigated: 1) use of supplementary cementitious materials; 2) use of nano-particles; and 3) use of deformed fibers. A multi-scale investigation involving the evaluation of non-fibrous UHPC mortar phase (matrix), fiber-matrix interface phase, and then UHPC composite material was undertaken to determine microstructural characteristics, fiber bond to matrix, and key mechanical properties of the UHPC matrix and UHPC. Test results indicate that the incorporation of 10%-20% silica fume effectively improved the fiber-matrix bond and …

Corrosion Performance Of Zirconium-Based Passivations On Electroplated Zinc Nickel, Madison Morgan Reed

Masters Theses

“Performance requirements for Department of Defense (DoD) electrical components include corrosion and electrical contact resistance. Historically, electroplated cadmium with a chromate conversion coating (CrCC) has been used to meet corrosion and contact resistance standards. However, replacements are needed for these materials because they are toxic and carcinogenic. Electroplated γ-ZnNi has been identified as an acceptable alternative to Cd. This study evaluated commercially available Zr-based thin films and sealers as passivations for potential replacement of CrCCs. Ten different passivations were tested and compared with bare γ-ZnNi. X-Bond and Zircobond passivations were found to provide some improvement to the bare ZnNi corrosion …

Grain Refinement Of High Alloy Stainless Steels In Sand And Directionally Solidified Castings, Dustin Alan Arvola

Masters Theses

"The goal of this research project is to develop an industrially viable melting process that will control the crystallization macrostructure of austenitic grades of cast steels. Titanium nitride (TiN) has proven to be an effective grain refiner of austenite. Theoretical simulation and experimental application has led to the development of a repeatable grain refining melt process for austenitic stainless steel alloys.

Grain refinement of the as-cast structure of Cr-Ni stainless steel alloys solidified with primary FCC, BCC and dual FCC/BCC phases was studied experimentally. Refinement was achieved in both cast ferritic and austenitic grades. Dual solidification of …

Research And Development Of Optically Transparent Join With Low Processing Temperatures, Eric Kevin Muskovin

Masters Theses

The purpose of this study was to investigate durable solar cell cover glass joins produced by diffusion bonding with deep eutectic solvents (DES) and to develop a novel process of joining optically transparent materials at low temperatures. A joined PV cell-glass specimen was characterized using Raman, μ-FTIR, SEM-EDS, and thin-film XRD. DESs were created with malonic acid (MAL) and choline chloride (ChCl) of varying composition factors (CF; CF=MAL/ChCl). Joining borosilicate glass coupons was attempted using DESs with CF = 0.65 and 1 at temperatures between 100-150 °C for 20 hours. Joining the glass coupons failed at all temperatures and oxygen …

Designed Extrudate For Ceramic Additive Manufacturing, Devin Mcmillen

Masters Theses

"The objective of this thesis work was to design ceramic paste systems that assist in achieving a high theoretical density ( > 95%) after deposition by a novel additive manufacturing process, i.e. Ceramic On-Demand Extrusion (CODE). The work is encompassed in five main sections: Sections 1 and 2 provide an introduction and literature review of relevant topics for the following sections of experimentation. Section 3 provides an analysis of a reaction chemistry to identify three discrete materials that could be combined via CODE and result in zirconium diboride (ZrB₂) post-sintering. Section 4 describes the development of a high solids …

Effect Of Microstructural Features On Steel Machinability, Mark C. Emmendorfer

Masters Theses

Non-metallic inclusions can have a tremendous impact on the machinability of steel. Some oxide inclusions such as alumina, spinel, and other refractory abrasive oxide inclusions can have a detrimental effect on machinability. Modification of oxide inclusions by calcium treatment can promote the formation of low melting point oxides such as anorthite and gehlenite inclusions that can assist in chip formation and form a lubricating layer on the rake surface of the machine tool. MnS is known to be beneficial to improving the machinability of steel. They assist in chip formation by being heavily deformed in the primary shear zone. Sulfide …

Modulated Photothermal Radiometry: Detector Sensitivity Study And Experimental Setup, Jessica Nicole Seals

Masters Theses

"This thesis outlines the development of a system used for determining the surface thermal diffusivity of both non-irradiated and irradiated materials. The motivation for this work is to establish a modulated photothermal radiometry (PTR) system on the campus of Missouri University of Science and Technology. One of the main efforts described in this thesis is the design and construction of the physical apparatus. Along the way, it was necessary to perform a detailed sensitivity analysis of the system to determine whether the expected signal emitted from the sample falls within the bounds of detectivity for the HgCdTe (MCT) detector used …

High Temperature Polymer Composites Using Out-Of-Autoclave Processing, Sudharshan Anandan

Doctoral Dissertations

"High performance polymer composites possess high strength-to-weight ratio, corrosion resistance, and have design flexibility. Carbon/epoxy composites are commonly used aerospace materials. Bismaleimide based composites are used as a replacement for epoxy systems at higher service temperatures. Aerospace composites are usually manufactured, under high pressure, in an autoclave which requires high capital investments and operating costs. In contrast, out-of-autoclave manufacturing, specifically vacuum-bag-only prepreg process, is capable of producing low cost and high performance composites. In the current study, out-of-autoclave processing of high temperature carbon/bismaleimide composites was evaluated. The cure and process parameters were optimized. The properties of out-of-autoclave cured laminates compared …

Direct Printing Of Single-Crystal Silicon By Microscale Nanoparticle Printing And Confined Laser Melting And Crystallization, Wan Shou

Doctoral Dissertations

"The transport and interfacial phenomena in laser melting and crystallization of silicon in micro-/nano-scale confinement lacks sufficient understanding. Uncovering the underlying mechanisms, and hence harness the melting and crystallization processes can help the formation of controllable single-crystal structures or patterns. In this dissertation, a molecular dynamics (MD) simulation was conducted to calculate the interfacial free energy of the silicon system in contact with flat and structured walls. Then the calculated interfacial energies were employed to predict the nucleation mechanisms in a slab of liquid silicon confined by two walls and compared with MD simulation results. Further, in combination with a …

Electrodeposited Semiconductor Nanostructures & Epitaxial Thin Films For Flexible Electronics, Naveen Kumar Mahenderkar

Doctoral Dissertations

"Single-crystal Si is the bedrock of semiconductor devices due to the high crystalline perfection which minimizes electron-hole recombination, and the dense native silicon oxide which minimizes surface states. To expand the palette of electronic materials beyond planar Si, an inexpensive source of highly ordered material is needed that can serve as an inert substrate for the epitaxial growth of grain boundary-free semiconductors, photonic materials, and superconductors. There is also a need for a simple, inexpensive, and scalable fabrication technique for the growth of semiconductor nanostructures and thin films. This dissertation focuses on the fabrication of semiconducting nanowires (polycrystalline Ge & …

Facile Synthesis Of Nanostructured Metal Borides And Composites For Applications In Sustainable Energy, Maalavan Arivu

Masters Theses

"Electrocatalytic water splitting is a promising solution for sustainable energy generation since one of the half reactions lead to the formation of H₂ which is a clean fuel. The other half of the reaction leading to O₂ evolution is an energy intensive process necessitating the need for an electrocatalyst to break the activation barrier for the commencement of the reaction. In this work we will focus on expanding the family of non-oxidic OER electro-catalysts, especially borides, whereby, apart from facilitating delocalization of electron cloud on the catalytically active transition metal site, low anion electronegativity and increased covalency in …

Microstructural Development And Its Effect On Aqueous Corrosion Of A Borosilicate Glass Ceramic For Waste Vitrification, Nicholas Stephen Roberts

Masters Theses

"Waste loadings of reprocessed spent nuclear fuel vitrified into borosilicate glass can be increased by precipitating environmentally stable phases concentrated with waste components in a chemically stable glass matrix. The principal objective of this thesis was to characterize the development of crystalline powellite (CaMoO₄ and related phases) and oxyapatite (Ca₂LN₈Si₆O₂₆) in borosilicate glass-ceramics and to determine how the formation of those phases affected its chemical durability.

Borosilicate glasses provided by PNNL were re-melted and quenched at rates from over 300⁰C/s to ~0.05⁰C/s. Isothermal heat treatment experiments were conducted by quenching melts …

Effect Of Thickness On The Structure And Corrosion Performance Of Sputtered Ce-Al-O Coatings On Al 2024-T3 Alloy Substrates, Yuanyuan Liu, Jiamu Huang, Lilu Qin, James B. Claypool, Matthew J. O'Keefe, Yiming Jiang

Materials Science and Engineering Faculty Research & Creative Works

Ce-Al-O coatings with thicknesses between ca. 136 nm and 1094 nm were deposited on Al 2024-T3 alloy substrates using magnetron co-sputtering of independent Al and CeO2 targets. The Ce-Al-O coatings with thicknesses from ca. 136 nm to 490 nm were compact, dense, and did not have distinct X-ray diffraction peaks. The ca. 1094 nm thick Ce-Al-O coating exhibited a columnar-textured outer layer ∼700 nm thick and a dense, ∼390 nm thick inner layer. X-ray photoelectron spectroscopy analysis revealed that the Ce-Al-O coatings contained Ce (III) species, and that the Al/Ce atomic ratio decreased with increasing coating thickness. Electrochemical corrosion data …

A Simple Model For Elastic-Plastic Contact Of Granular Geomaterials, Jian Wang, Qimin Li, Changwei Yang, Yidan Huang, Caizhi Zhou

Materials Science and Engineering Faculty Research & Creative Works

We propose a simple elastic-plastic contact model by considering the interaction of two spheres in the normal direction, for use in discrete element method (DEM) simulations of geomaterials. This model has been developed by using the finite element method (FEM) and nonlinear fitting methods, in the form of power-law relation of the dimensionless normal force and displacement. Only four parameters are needed for each loading-unloading contact process between two spheres, which are relevant to material properties evaluated by FEM simulations. Within the given range of material properties, those four parameters can be quickly accessed by interpolating the data appended or …

Femtosecond Laser-Matter Interactions In Ternary Zinc Phosphate Glasses, J. Hernandez-Rueda, N. W. Troy, P. Freudenberger, Richard K. Brow, D. M. Krol

Materials Science and Engineering Faculty Research & Creative Works

We investigate the interaction of ultrashort laser pulses with ternary zinc phosphate glasses. We explore the viability of ten different glass compositions with different levels of alumina to inscribe optical waveguides via the fs-laser direct writing technique, finding that only samples with [O]/[P] ratios of 3.25 are suitable candidates. We also test a zinc magnesium phosphate glass to fabricate waveguide Bragg gratings in order to generate filters and mirrors with specific spectral properties. Confocal Raman spectroscopy inspection shows that laser-damaged material exhibits a relative intensity decrease and a subtle blue-shift on the 1209 cm-1 Raman peak, which implies a relative …

Characterization And Tailoring Of Powder Used In Additive Manufacturing And Plasma Spheroidization, Caitlin S. Kriewall

Masters Theses

"There are many processes that use metal powder as the starting material for the production of parts. With the growth of these manufacturing techniques, more critical part applications are being considered. In order to fully understand the process and create consistent parts, powder properties need to be well understood. Selective laser melting (SLM) is a powder bed-based additive manufacturing process. During processing, heat-affected powders are generated and can deposit within the build area. The current work investigated the characterization of heat-affected 304L stainless steel powder using techniques such as scanning electron microscopy, x-ray diffraction and x-ray photoelectron spectroscopy to detect …