Materials Science and Engineering Commons^™

“Zero” Porosity High Loading Nmc622 Positive Electrodes For Li-Ion Batteries, Haidar Y. Alolaywi, Kubra Uzun, Yang-Tse Cheng

Chemical and Materials Engineering Faculty Publications

LiNi0.6 Mn0.2Co0.2 O 2 (NMC622) is a widely used positive electrode material for lithium-ion batteries, including electric vehicles. In this work, we investigated the effects of porosity, ranging from “zero” to the typical 35%, on the electrochemical behavior of high- loading NMC622 electrodes. Although it is well known that the energy density of the electrode increases with increasing areal capacity and decreasing porosity, NMC-positive electrodes with exceedingly low porosity (e.g., near zero) and high loading (e.g., 4 mAh cm−2 ) have not been investigated. Here, we report an intriguing observation that the “zero porosity” NMC electrode can have higher capacity …

Spark Plasma Sintering Of Magnesium Titanate Ceramics, Suzana Filipović, Nina Obradović, William G. Fahrenholtz, Steven Smith, Miljana Mirković, Adriana Peleš Tadić, Jovana Petrović, Antonije Đorđević

Materials Science and Engineering Faculty Research & Creative Works

Magnesium titanate ceramics were prepared by reactive spark plasma sintering (SPS) at 1200 °C for 5 min. Prior to sintering, MgO and TiO₂ powders were mixed by high energy ball milling (HEBM) for 15, 30, or 60 min. The effect of milling time on phase composition was analyzed by X-ray diffraction (XRD) for milled powders and sintered specimens. The morphology of the sintered ceramics was investigated by scanning electron microscopy (SEM), while elemental distribution was determined by energy dispersive spectroscopy (EDS). The presence of the MgTi2O5 phase was detected in XRD and was confirmed by EDS analysis. Microcracking was …

Degree Of Dispersion/Exfoliation And Surface Functionalization Of 1d And 2d Carbon Nanostructured Materials: Interface Interactions And Effects On Mechanical Properties, Michail Margas

Material Science and Engineering Dissertations - Archive

The development of advanced cementitious nanocomposites relies heavily on understanding the interfacial interactions between carbon-based nanomaterials and the cement matrix, which significantly influence the material’s performance. The goal of this dissertation is to investigate the effect of dispersion/exfoliation and surface functionalization of 1D multiwall carbon nanotubes (MWCNTs), carbon nanofibers (CNFs), and 2D graphene nanoplatelets (GNPs) in aqueous suspensions on the interface interactions of nanoengineered cementitious composites. The first objective of this dissertation is to quantitatively evaluate the degree of nanomaterial dispersion for MWCNT and CNF suspensions, in a converging manner for cement-based materials applications using spectroscopic techniques, such as UV-vis …

Development Of Synthetically Accessible Glycolated Polythiophenes For High-Performance Organic Electrochemical Transistors, Bowen Ding, Vianna N. Le, Hang Yu, Guanchen Wu, Adam V. Marsh, Edgar Gutiérrez-Fernández, Nicolás Ramos, Martina Rimmele, Jaime Martín, Jenny Nelson, Alexandra F. Paterson, Martin Heeney

Chemical and Materials Engineering Faculty Publications

Four glycolated polythiophene-based organic mixed ionic-electronic conductors (OMIECs), PE2gTT, PE2gT, PT2gTT, and PT2gT are prepared by atom-efficient direct arylation polymerization, avoiding the need for toxic organometallic pre- cursors. PE2gT, PT2gTT, and PT2gT are operable in p-type accumulation mode organic electrochemical transistors (OECTs), with PT2gT displaying the best device performance with a μC* product figure-of-merit of 290 F cm−1 V−1 s−1 . A record volumetric capacitance among p-type glycolated polythiophene OMIECs of 313 F cm−3 is observed for PE2gT, ascribed to the high proportion- ality of polar components in its materials design. The good OECT performance of PE2gT with μC* = …

The Integrated Behavioral Model Of Mental Health Help Seeking (Ibm-Hs): A Health Services Utilization Theory Of Planned Behavior For Accessing Care, Joseph H. Hammer, David L. Vogel, Patrick R. Grzanka, Nayeon Kim, Brian T. Keum, Claire Adams, Sarah A. Wilson

Chemical and Materials Engineering Faculty Publications

This article introduces the integrated behavioral model of mental health help seeking (IBM-HS), a theoretical model for understanding the constructs (e.g., systemic, predisposing, and enabling factors; mental health literacy; illness perceptions; perceived need; stigma; shame; perceived benefits, motivation) that influence people’s decision making around seeking professional mental health care and their ultimate access to formal treatment. The IBM-HS is a help-seeking-specific adaptation of the empirically supported integrated behavioral model and integrative model, which are themselves evolutions of the theory of planned behavior and theory of reasoned action. The IBM-HS posits that help-seeking determinants (e.g., structural forces; cultural influences; past help-seeking …

Investigation Of The Effect Of Preparation Parameters On The Structural And Mechanical Properties Of Gelatin/Elastin/Sodium Hyaluronate Scaffolds Fabricated By The Combined Foaming And Freeze-Drying Techniques, Mansour Qamash, S. Misagh Imani, Meisam Omidi, Ciara Glancy, Lobat Tayebi

Electrical & Computer Engineering Faculty Publications

This paper aimed to evaluate the effects of different preparation parameters, including agitation speed, agitation time, and chilling temperature, on the structural and mechanical properties of a novel gelatin/elastin/sodium hyaluronate tissue engineering scaffold, recently developed by our research group. Fabricated using a combination of foaming and freeze-drying techniques, the scaffolds were assessed to understand how these parameters influence their morphology, internal microstructure, porosity, mechanical properties, and degradation behavior. The fabrication process used in this study involved preparing a homogeneous aqueous solution containing 8% gelatin, 2% elastin, and 0.5% sodium hyaluronate (w/v), which was then subjected to mechanical agitation at speeds …

Control Of Flow Instabilities With Acoustic Metamaterials, Jensen E. Mctighe

Open Access Master's Theses

Acoustic metamaterials (AMs) have been proposed for uses in flow control, as they offer a passive control method and can be engineered independently, without needing complex fluid structure interactions simulations. For example, AMs embedded into flat plate surfaces have been demonstrated to delay (or speed up) the onset of laminar-to-turbulent boundary layer transition by attenuating (or strengthening) Tollmein-Schlicting waves through numerical simulation. However, as of present, no experimental research has been conducted to study or demonstrate the behaviors of AMs designed to interact with flow structures. An experiment was performed in which an AM was embedded into a flat plate …

Theoretical Investigations Of The Structural, Dynamical, Electronic, Magnetic, And Thermoelectric Properties Of CoMRhsi (M = Cr, Mn) Quaternary Heusler Alloys, Abdullah Hzzazi, Hind Alqurashi, Eesha Andharia, Bothina Hamad, M. O. Manasreh

Physics Faculty Publications and Presentations

The structural, dynamical, electrical, magnetic, and thermoelectric properties of CoMRhSi (M = Cr, Mn) quaternary Heusler alloys (QHAs) were investigated using density functional theory (DFT). The Y-type-II crystal structure was found to be the most stable configuration for these QHAs. Both CoCrRhSi and CoMnRhSi alloys possess a half-metallic behavior with a 100% spin-polarization as the majority spin channel is metallic. On the other hand, the minority spin channel is semiconducting with narrow indirect band gaps of 0.54 eV and 0.57 eV, respectively, along the Γ−𝑋 high symmetry line. In addition, both CoCrRhSi and CoMnRhSi alloys possess a ferromagnetic structure …

Effect Of Strain Profiling On Anisotropic Opto-Electronic Properties Of As2X3 (X =S, Te) Monolayers From First Principles, Eesha Andharia, Hind Alqurashi, Ihsan Erikat, Bothina Hamad, M. O. Manasreh

Physics Faculty Publications and Presentations

Strain Engineering is a widely adopted approach to modulate the opto-electronic performance of 2-Dimensional (2D) materials. Recently, anisotropic Van der Waals (vdW) based 2D As₂S₃ monolayer has gained significant attention within the scientific community due to its stability in ambient conditions. Similar compounds like As₂Te₃ have also been theoretically explored. However, its indirect bandgap nature limits its application in optical devices. In this study, a systematic study of compressive and tensile strain on three profiles–Uniaxial along a-axis, Uniaxial along b-axis and biaxial strain from −10% to +10%, is performed for As₂S_{3 …}

Electrostatic Sorting Of Lunar Regolith Simulants For Sustainable Resource Utilization: Modeling And Characterization Of Particle Size Distribution, Abdullah Al Moinee, Peter Bachle, Kyle Newport, William Schonberg, David Bayless, Jeffrey Smith, Daoru Han, Fateme Rezaei

Civil, Architectural and Environmental Engineering Faculty Research & Creative Works

In pursuit of sustainable resource utilization on the Moon, this paper delves into modeling and characterization of particle size distribution (PSD) of lunar regolith simulants in an electrostatic system. A prototype electrostatic sieve was built and tested with four sample simulants mirroring properties of lunar mare and highland regolith. An alternating four-phase (90 degrees, 180 degrees, 270 degrees, 360 degrees) traveling square-wave was utilized for particle-directed transport to model the diverse trajectories of the particles. Numerically, we scrutinized how the distribution functions of the particles are manifested as the electrostatic field propagates, with a focus on three distinct particle ranges …

Ltspice Modeling For Gan-Git Hemt Including Cryogenic Temperature, Md Maksudul Hossain, Yuqi Wei, H. Alan Mantooth

Electrical Engineering Faculty Publications and Presentations

Highly efficient electrically driven avionics have led to a renewed interest in cryogenic propulsion systems with the goal of reducing carbon emission footprint. Although cryogenic converters promise better efficiency and improved power density, the successful design is incumbent upon the appropriate switching device selection and simulation-based analyses prior to initial prototyping. In this work, a datasheet-driven compact model for a gallium nitride (GaN) Gate Injection Transistor (GIT) has been proposed and implemented in LTspice, a versatile, high performance, and free circuit simulator in order to investigate the merit of the chosen device in a power electronic system.

F-Temper Vs O-Temper Brazing Of 3003 Aluminum Return Bends, Mieka R. Clark

Dissertations, Master's Theses and Master's Reports

As-extruded (F-temper) 3003 return bends can provide cost savings over annealed (O-temper) return bends in aluminum heat exchangers. To assess if F-temper return bends are an alternative to the baseline O-temper bends, the grain structure, bending performance, and melting behavior were assessed through:

• Quantifying the effect of dispersoids on recrystallization
• Tracking bending behavior through grain morphology and surface texture
• Measuring the number and volume fraction of the α-Al(Mn,Fe)Si intermetallic
• Inducing incipient melting through high temperature thermal exposure.

When homogenized at 620°C and 630°C, the F-temper bends had no orange peel texture, the grain size was equivalent to the annealed product, …

Machine Learning For Electronic Structure Prediction, Shashank Pathrudkar

Dissertations, Master's Theses and Master's Reports

Kohn-Sham density functional theory is the work horse of computational material science research. The core of Kohn-Sham density functional theory, the Kohn-Sham equations, output charge density, energy levels and wavefunctions. In principle, the electron density can be used to obtain several other properties of interest including total potential energy of the system, atomic forces, binding energies and electric constants. In this work we present machine learning models designed to bypass the Kohn-Sham equations by directly predicting electron density. Two distinct models were developed: one tailored to predict electron density for quasi one-dimensional materials under strain, while the other is applicable …

Investigation Of Space Charge Effects On Co2 Electrocatalytic Reduction On Gd-Doped Ceria Via Scanning Kelvin Probe And Model-Based Bayesian Analysis, Alejandro Mejia

Graduate Theses, Dissertations, and Problem Reports (ETD)

In studying novel energy conversion and storage systems, such as high-temperature electrolysis, numerous underlying fundamental physical processes remain unclear or inadequately understood. Among these, the modeling and comprehension of surface reaction mechanisms, coupled with the intricate effects of space‑charge interfaces, remains an unclear and challenging area of research.

The work of this dissertation involves the development of a 2D finite element analysis model, leveraging the robust MOOSE framework from INL. This model, featuring inhomogeneous defect thermodynamics for near-surface chemistry, formulated through Poisson‑Cahn variational theory, has been exploited for studying the electrocatalytic reduction of CO₂ on gadolinia doped ceria. The …

Data-Driven Modeling Of Oxygen Kinetics In La0.6sr0.4co0.2fe0.8o3−Δ (Lscf) For High-Temperature Reduction Of Co2 In An Electrolysis Cell, Ferron Campbell

Graduate Theses, Dissertations, and Problem Reports (ETD)

Electrolysis systems are critical to several societal applications, particularly energy storage and conversion. Developing these systems requires a detailed knowledge of the chemistry and thermodynamics of the materials used in the electrolysis cell. This work focuses on using embedded scientific machine learning as an efficient way to build an interpretable model for the reaction and transport kinetics in the LSCF electrode, whose performance directly influences the electrolysis system’s performance. The models developed in this study are trained using the publicly available machine learning package, FoKL-GP. This package incorporates a robust Gibbs sampler that employs a forward variable selection process to …

Laser Deposition Additive Manufacturing Of Multi-Material And Metal-Ceramic Composite Structures, Manikanta Grandhi

Graduate Theses, Dissertations, and Problem Reports (ETD)

The increasing performance requirements of modern industrial systems, coupled with the imperative for decarbonization, necessitate a fundamental rethinking of metallic component design and manufacturing. Traditional materials, with their inherent limitations in property optimization, susceptibility to degradation, and weight constraints, are proving insufficient. Multi-material joining offers a potential solution, enabling designers to strategically integrate diverse materials with specific, tailored properties into single component. Functionally graded materials (FGMs) and oxide dispersion strengthened (ODS) materials are prime examples of this approach, delivering substantial improvements in wear resistance, thermal regulation, high-temperature resilience, and overall weight efficiency. However, conventional manufacturing approaches further exacerbate the limitations …

Novel Membrane Materials For Nutrient Recovery From Nutrient-Rich Resources, Km Prottoy Shariar Piash

Graduate Theses, Dissertations, and Problem Reports (ETD)

Global demand for fertilizer production is expanding substantially to meet the food demand of an increasing world population. Anaerobic digestate (AD) of various centralized wastewater facilities contains substantial amounts of ammonium (NH₄⁺) (300-800 mg/L), potassium (K⁺) (13-120 mg/L), and phosphorus (P) (30-100 mg/L)- based nutrients. In addition to reducing energy costs and CO₂ emissions compared to conventional fertilizing raw material manufacturing, recovering nutrients from these waste streams could help mitigate problems such as eutrophication, which otherwise incurs billions of dollars losses to US economy annually. Apart from nutrients, wastewater streams also contain organic pollutants …

Processing, Stability, And High-Temperature Properties Of Doped Lacro3-Based Refractory Ceramics And Composites For Harsh Environments Sensing Applications, Javier A. Mena

Graduate Theses, Dissertations, and Problem Reports (ETD)

In order to test and monitor the operational stability and conditions of various energy, transportation, and manufacturing systems and their components, accurate sensors capable of operating at temperatures over 1000 °C in various environments for long durations are required. In addition, many of these harsh environmental systems do not permit sensors to be directly inserted into the environment, so the sensors need to be embedded into the surrounding support or thermal protective materials. Some technological and industrial applications that require the use of harsh environment conditions sensing include nuclear and chemical reactors, jet engines, heavyduty gas turbines, rotating bearings in …

Passive Wireless Corrosion And Temperature Detection In High-Temperature Environments, Noah Lane Strader

Graduate Theses, Dissertations, and Problem Reports (ETD)

This work focuses on the theory and development of LC sensors for high temperature and corrosion measurement for stainless steel and copper surfaces with power industry and general corrosion detection applications. The LC resonators were fabricated via screen printing an Ag inductor on an alumina substrate. The LC design was modeled using the ANSYS HFSS modeling package. The LC passive wireless sensors operate with resonant frequencies centered at 85-110 MHz. The wireless response of the LC sensor was interrogated and received by a radio frequency signal generator and spectrum analyzer at temperatures from 50-800 °C for copper ground planes and …

Far-Field Passive Wireless Sensors Composed Of Electroceramic Materials For Harsh Environment Applications, Kevin M. Tennant

Graduate Theses, Dissertations, and Problem Reports (ETD)

The demand for high temperature sensing technologies in industrial applications has been steadily increasing, driven by the need for precise monitoring and control in extreme environments. This thesis presents an investigation into the development and optimization of passive wireless sensors for high temperature sensing applications. The research focuses on overcoming the challenges associated with traditional sensing methods by leveraging passive wireless sensor technology, offering advantages such as reduced complexity, improved reliability, and enhanced flexibility.

A passive wireless high temperature sensor for far-field applications was developed for stable temperature sensing up to 1000 °C. The goal is to leverage the properties …

Materials Testing For Large Format 3d Printing, William Jenkins

Williams Honors College, Honors Research Projects

An ABS Carbon Fiber blend was printed into single walled hexagons at a variety of settings on a Cincinnati BAAM large format 3D printer. These hexagons were then cut down into sheets and had tensile and flexural test samples cut out of them, in order for materials testing to be performed. Tensile strength, tensile strain, young’s modulus, flexural strength, deflection and elastic modulus were all determined. A desktop CNC machine and a planer were purchased for the manufacturing of these samples, and an efficient cutting procedure was designed and optimized. After all data collection concluded, this data was thoroughly analyzed, …

Robot-Based 3d Printing, Aaron Hoffman

Williams Honors College, Honors Research Projects

Details of a large-format 3D printer created to print experimental materials, test multi-axis print techniques, and quickly print large objects. The printer consists of a 7-axis robotic arm and pellet extruder, which are controlled by a PC. Experimental materials such as recycled polymers or carbon-fiber reinforced materials can be easily tested with the pellet format of the extruder. The printer can perform different printing techniques and can be used to experiment with material properties when using these techniques with different polymers. The print surface is around 5 times larger than the average commercial 3D printer, and the robotic arm provides …

Effects Of Ac Interference On Pipelines Under Cathodic Protection And Cathodic Disbondment Of Pipeline Coatings, Tanner Laughorn

Williams Honors College, Honors Research Projects

This project is split into two parts. The first revolves around AC interference on pipeline steel under cathodic protection. The corrosion rate of steel samples will be measured after they are exposed to varying levels of AC interference and cathodic protection. The results will be used to help develop new guidelines for appropriate cathodic protection of steel pipelines. The second part of this project revolves around the cathodic disbondment of pipeline coatings while under cathodic protection. The disbondment distance, electrolyte pH, and electrochemical impedance spectroscopy will be tested for multiple industry standard coatings under various conditions. The results will be …

Short Strand Carbon Fiber Reinforced Polylactic Acid Filament For Additive Manufacturing, Dale Chenoweth, Lukas Seggi, Luke Phillips

Williams Honors College, Honors Research Projects

In this design project, the additive manufacturing filament of short strand carbon fiber (SSCF) reinforced polylactic acid (PLA) composite was developed. The micro-size, precision cut SSCFs were mixed with the PLA pellets through a melting homogenization process. Through this process the composite material block is cut and divided into pieces for ease of pelletizing. The material block pieces are then pelletized to be fed through the single screw extruder to develop the SSCF-PLA composite filament. The SSCF-PLA filaments were manufactured with a varying amount of SSCF ranging from 0.5% to 10% of the material block's weight. Development of a 1% …

Ambient Temperature Strength Degradation Of A Ceramic Matrix Composite Due To Solid Particle Erosion, Jonathan Clawson

Williams Honors College, Honors Research Projects

Solid particle erosion (SPE) is an issue for aircraft exposed to hard, fine particles, such as sand or dust, that can be ingested into the engine at a high velocity without reaching their melting point, resulting in material removal. SPE can be attributed to the intake of particulate debris from the runway or from airborne particulates. The cumulative mass loss from SPE damage affects the structural integrity and performance of the engine; however, its effects on ceramic matrix composites (CMCs), that are being employed in the aerospace industry, are not well understood in literature. The limited SPE research studies that …

Schaeffler Icvd Coating Machine, Louis Mcgrath

Williams Honors College, Honors Research Projects

Chemical Vapor Deposition (CVD) is mutual technology used to deposit thin film through a gaseous phase by vaporizing the solid materials. This conventional process usually requires high thermal stability of the materials, which is not applicable for most of the polymeric materials. Therefore, a novel process, initiated Chemical Vapor Deposition (iCVD) is developed by introducing the gaseous monument and initiator to form the thin film in-situ. By adjusting the free-radical polymerization in the vapor phase, a variety of thin and uniform polymer films can be achieved. Depending on the chemistry, iCVD has many categories. This report explains the design …

Causational Analysis And Rectification Of Issues Concerning Scale Formation On Hot-Rolled Straight Bar Product And Its Effects On Ultrasonic Testing, Riley Mattix

Williams Honors College, Honors Research Projects

At Charter Steel's NDT Processing Plant located in Cleveland, Ohio, a concern has arisen regarding the recently implemented bar straightening and UT (Ultrasonic Testing) equipment. A substantial amount of mill scale, which is typically removed during the straightening process, is persisting on the bar’s surface throughout most of the NDT procedure. This lingering scale has been observed to flake off once inside the UT equipment, introducing unwanted noise and phantom peaks into the UT readings. Additionally, thick mill scale has been identified as a source of background interference in the received data. In contrast, bars that have been subjected to …

Corrosion Inhibitors: Mitigating The Degradation Of Rebar, Jake R. Hughes

Williams Honors College, Honors Research Projects

Our conjecture was twofold: first, that two compounds historically used as food preservatives could act as environmentally friendly inhibitors against rebar corrosion, and second, that molecular properties have a quantifiable influence on inhibition efficiency (%IE). To evaluate the two compounds, cyclic potentiodynamic polarization was used to determine corrosion current density (i_corr) and %IE. The “green” inhibitor candidates included sodium metabisulfite and ascorbic acid, which yielded maximum %IE values of -123900% and 91%, respectively. Results indicated that sodium metabisulfite is not a suitable inhibitor, while ascorbic acid showed potential to extend reinforced concrete’s design life without posing health or …

Application Of Conductivity Techniques For Interlayer Discontinuity Detection In Additively Manufactured Metal Materials, Joshua D. Newell, Riley R. Myers

Williams Honors College, Honors Research Projects

Additive manufacturing is becoming increasingly more popular and efficient. One drawback is the possibility of interlayer discontinuities forming in the material. A non-destructive technique utilizing the changing resistivity of the material as discontinuities appear was used to detect those discontinuities and was verified through additional testing of manually added through-thickness discontinuities. This technique has been proven to be useful in understanding fatigue crack growth of conventional metal and composite structures. Experimental investigation of fatigue in steel with an edge notch has been performed using these techniques to understand source and location of crack formation and growth in conventional material. Application …

Novel Re-Crosslinkable Preformed Particle Gels (Rppg) For Parent- And Infill-Well-Fracture Interactions Mitigation, Xiaojing Ge, Adel Alotibi, Ahmed Al-Hlaichi, Yanbo Liu, Tao Song, Junchen Liu, Baojun Bai, Thomas P. Schuman

Geosciences and Geological and Petroleum Engineering Faculty Research & Creative Works

Hydraulic fracturing treatments in unconventional infill (or "child") wells can be significantly affected by depletion from existing parent-well, resulting in asymmetrical fracture growth. These issues may lead to excessive load-water production, proppant deposition, casing deformation in the parent well, and unbalanced stimulation of infill wells. To mitigate these effects, various strategies have been proposed, including the use of far-field diverters in child wells and repressurization of parent wells. Additionally, an increasingly popular strategy involves injecting near-wellbore diverters to temporarily plug entry points into the parent wellbores during frac operations on infill wells. To achieve better application, a novel low-cost, self-degradable, …