Other Materials Science and Engineering Commons^™

Data Driven Discovery Of Materials Properties., Fadoua Khmaissia

Electronic Theses and Dissertations

The high pace of nowadays industrial evolution is creating an urgent need to design new cost efficient materials that can satisfy both current and future demands. However, with the increase of structural and functional complexity of materials, the ability to rationally design new materials with a precise set of properties has become increasingly challenging. This basic observation has triggered the idea of applying machine learning techniques in the field, which was further encouraged by the launch of the Materials Genome Initiative (MGI) by the US government since 2011. In this work, we present a novel approach to apply machine learning …

Development And Degradation Analysis Of Novel Micro And Nanostructured Transition Metal Oxide (Tmo) Anodes For Aqueous Sodium Ion Batteries., Santanu Mukherjee

Electronic Theses and Dissertations

One of the primary motivations driving battery technology research is the need to develop cleaner and more efficient energy storage systems. The portable electronics industry has developed exponentially, especially over the last couple of decades and therefore the importance of efficient electrochemical energy storage systems cannot be overstated. Li-ion batteries have been the predominant rechargeable energy in use, however, they have their own particular drawbacks viz. flammability of the electrolyte, expensive mining of the Li metal etc. This is where the importance of Na-ion batteries lie. This research focuses on using existing transition metal oxides (TMOs) and tuning their crystal …

Surface Energy In Bond-Counting Models On Bravais And Non-Bravais Lattices, Tim Ryan Krumwiede

Doctoral Dissertations

Continuum models in computational material science require the choice of a surface energy function, based on properties of the material of interest. This work shows how to use atomistic bond-counting models and crystal geometry to inform this choice. We will examine some of the difficulties that arise in the comparison between these models due to differing types of truncation. New crystal geometry methods are required when considering materials with non-Bravais lattice structure, resulting in a multi-valued surface energy. These methods will then be presented in the context of the two-dimensional material graphene in a way that correctly predicts its equilibrium …

Peridynamic Models For Fatigue And Fracture In Isotropic And In Polycrystalline Materials, Guanfeng Zhang

Department of Mechanical and Materials Engineering: Dissertations, Theses, and Student Research

To improve design and reliability, extensive efforts has been devoted to understanding damage and failure of materials and structures using numerical simulation, as a complement of theory and experiment. In this thesis, peridynamics is adopted to study fatigue and dynamic failure problems.

Fatigue is a major failure mode in engineering structures. Predicting fracture/failure under cyclic loading is a challenging problem. Classical model cannot directly be applied to problems with discontinuities. A peridynamic model is adopted in this work because of important advantages of peridynamics in allowing autonomous crack initiation and propagation. A recently proposed peridynamic fatigue crack model is considered …

Technical Feasibility Of Selectively Separating Rare Earth Elements By Vapor Phase Extraction And Condensation, Katie Lyons

Graduate Theses & Non-Theses

Experiments were performed to evaluate the technical feasibility of selectively separating selected rare earth halides (bromides and chlorides) using a volatilization and condensation technique. Initially, optimum chloridizing and bromidizing roast parameters were secured in studies performed on reagent grade rare earth oxide samples and subsequently confirmed in tests performed on mineral ore and concentrate samples. The volatilization and condensation experiments were performed by placing the subject rare earth halide samples in an argon-purged multiple-zone tube furnace wherein the temperature profile was controlled to establish separate vaporization and condensation regions. Following each experiment, condensate and solid residue samples were analyzed to …

Nano-Confined Metal Oxide In Carbon Nanotube Composite Electrodes For Lithium Ion Batteries, Alexandra J. Henriques

FIU Electronic Theses and Dissertations

Lithium ion batteries (LIB) are one of the most commercially significant secondary batteries, but in order to continue improving the devices that rely on this form of energy storage, it is necessary to optimize their components. One common problem with anode materials that hinders their performance is volumetric expansion during cycling. One of the methods studied to resolve this issue is the confinement of metal oxides with the interest of improving the longevity of their performance with cycling. Confinement of metal oxide nanoparticles within carbon nanotubes has shown to improve the performance of these anode materials versus unconfined metal oxides. …

Analysis Of Additively Manufactured Lattice Structures Using Finite Element Methods, Christopher A. Box

Theses and Dissertations

Additive Manufacturing (AM) processes are well known for their ability to fabricate parts with complex geometries. Lattice structures leverage this ability to create parts with high strength-to-weight ratio and other desirable structural qualities. This research presents a parameterized modeling tool using common Finite Element Analysis (FEA) and scripting software with which aggregated lattice structures can be analyzed, given different geometric properties and loading conditions. A full factorial Design of Experiments is run to explore the effects of various parameters on the strength of lattice structures. Experimental compressive strength results from three FDM-produced PLA lattices are discussed and compared to predictions …

Deposition Of Copper Nanoparticles On 2d Graphene Nanoplatelets Via Cementation Process, Luiza Da Fontoura

FIU Electronic Theses and Dissertations

The main goal of this thesis is to deposit metal particles on the surface of 2D nanoplatelets using a controlled cementation process. As a proof of concept, copper (Cu) and Graphene Nanoplatelets (GNP) were chosen as the representative metal and 2D nanoplatelets, respectively. Specific goals of this study include depositing nanometer scale Cu particles on the surface of GNP at a low concentration (approximately 5 vol.%) while maintaining clustering and impurities at a minimum. Parametric studies were done to attain these goals by investigating various metallic reducer types and morphologies, GNP surface activation process, acid volume % and copper (II) …

Redesign Of Computer Keyboards For Hospital And Consumer Use, Kent Williams, Brian Jensen, Anton Bowden

Biomedical Engineering Western Regional Conference

Application of carbon nanotube coatings to computer keyboards in order to reduce the spread of bacteria in hospitals and homes.

Keywords: carbon nanotube, bacteria, antimicrobial, keyboard, design, MRSA, biofilm

The Effect Of Biocomposite Material In A Composite Structure Under Compression Loading, Benjamin Andrew Sweeney

Master's Theses

While composite structures exhibit exceptional strength and weight saving possibilities for engineering applications, sometimes their overall cost and/or material performance can limit their usage when compared to conventional structural materials. Meanwhile ‘biocomposites’, composite structures consisting of natural fibers (i.e. bamboo fibers), display higher cost efficiency and unique structural benefits such as ‘sustainability’. This analysis will determine if the integration of these two different types of composites are beneficial to the overall structure. Specifically, the structure will consist of a one internal bamboo veneer biocomposite ply; and two external carbon fiber weave composite plies surrounding the bamboo biocomposite. To acquire results …

Effect Of Liquid Contamination On Hermeticity And Seal Strength Of Flexible Pouches With Lldpe, Francesca Delle Cese, Koushik Saha, S. Roy, Jay Singh

Journal of Applied Packaging Research

Flexible packaging is a growing successful market and the majority of flexible package applications are for the food industry. The demand for process optimization and reduced production costs, has led to an increase in flexible packaging. However, fast production lines can result in contamination in the seal area. For flexible food packaging, contamination is considered any food particle or substance trapped in the seal area. Current quality control processes can detect contamination in the seal area, but it is not determined if seal contamination affects seal quality. Oil-based and sodium based snack foods are two common categories that can be …

Verifying The Implementation Of An Anisotropic Grain Boundary Energy Model In Idaho National Lab’S Marmot, John-Michael H. Bradley, Evan D. Hansen, Jarin C. French, Yongfeng Zhang (Mentor)

Idaho Conference on Undergraduate Research

This work aims to verify the correct implementation of an anisotropic grain boundary (GB) energy model for face-centered cubic (FCC) and fluorite materials in Idaho National Laboratory’s phase field fuel performance code MARMOT. The model was recently implemented in MARMOT with the purpose of enabling higher fidelity simulations of UO₂ nuclear fuels. As part of verification, tests were performed to measure the energy dependence on misorientation of high symmetry GBs in an FCC metal (Cu). The energies of the [100], [110], and [111] twist boundaries result as predicted, as do the energies of the [111] symmetric tilt boundaries. However, …

Composite Cold Expansion Tooling, Andrew Amos

All Undergraduate Projects

In the world of aircraft manufacturing, cold expansion products literally hold these aircraft together. The problem faced today is that the Little Brute Hydraulic Puller designed and built by Fatigue Technology Inc. is a handheld steel hydraulic cylinder that is heavy and expensive to produce. In a market that demands continuous improvement, there is a constant push to make the product cheaper, better and lighter. In order to accomplish this demand a composite tube will be substituted in the design as the primary pressure cylinder instead of the traditional steel pressure cylinder in order to create a lighter and cheaper …

A Simple Embedded Atom Potential For Palladium-Hydride, Yang Zhang

Theses, Dissertations and Capstones

Metal Hydride systems are an important research topic in material science because of their many practical, industrial, and scientific applications. Therefore, the development of reliable and efficient interatomic potentials for metal hydrides systems, to be utilized in atomistic modeling, can be of great value in accelerating the research in this field. The embedded-atom method (EAM), based on the density functional theory (DFT), has the advantage of being both computationally efficient and being well suited for modeling metal hydride systems. In this work, the author has developed an efficient EAM potential for the palladium hydride (Pd-H) alloy system. Contrary to previously …

Computational Modeling Of Percolation Conduction And Diffusion Of Heterogeneous Materials, Jian Qiu

Electronic Theses and Dissertations

Heterogeneous materials provide a unique combination of desirable mechanical, thermal or electrical properties. This dissertation presents several micro-structure modeling approaches to predict the effective properties of heterogeneous materials and demonstrates its certain application toward two highly heterogeneous, unconventional structural composite materials (carbon fiber reinforced composite materials and graphene nanoplatelets composite). By using the efficient computational algorithm based on the FEA, a randomly oriented disk-shaped particles system are generated. A new element partition scheme based on the vector operations and geometry of inclusion has been implemented to mesh the intersected disks. The computed equivalent conductivity is expressed as a power-law function …

The Effects Of Carboxylic Acids In Aluminum Anodizing, Abby E. Koczera

Honors Theses and Capstones

Hard-anodized alumina coatings were formed in sulfuric acid at low temperature and high current density in the presence of carboxylic acid additives. Citric acid, trimesic acid, mellitic acid and ethylenediaminetetraacetic acid (EDTA) were utilized in varying concentrations. The additives were chosen for their capacity to form complexes with tri-valent aluminum and hence impart chemical stability to the coatings. The coatings were sealed in boiling water, and corrosion resistance was observed in a high pH solution of potassium hydroxide. The coatings were examined using scanning electron microscopy (SEM) to assess coating thickness and pore dimensions. Thicker coatings were produced when the …

Nonlinear Dielectric Behavior Of Field-Induced Antiferroelectric/Paraelectric-To-Ferroelectric Phase Transition For High Energy Density Capacitor Application, Mingyang Li

Dissertations, Master's Theses and Master's Reports

Electric field-induced antiferroelectric(AFE)/paraelectric(PE)-to-ferroelectric(FE) phase transitions are investigated for the associated nonlinear dielectric behavior, which could offer high dielectric capacity. The phenomenon in monolithic materials has been computed for Kittel antiferroelectric and BaTiO₃ model systems using the Landau-Ginzburg-Devonshire theory. The general switching curves give values of the polarization as a function of external electric field. A similar computation is performed for particle-filled polymer-matrix composites where an internal depolarization field is considered. The polarization-electric field response changes with different depolarization factors, which demonstrate the shape and alignment of the dielectric particles embedded in polymer-matrix are key factors for the composite to …

Study Of Multiferroic Properties Of Ferroelectric- Ferromagnetic Heterostructures Bzt-Bct/Lsmo, Md Abdullah-Al Mamun

MSU Graduate Theses

Currently, there has been a flurry of research focused on multiferroic materials due to their potential applications. Lead (Pb)-based ferroelectric and multiferroic materials (PZT, PMN-PT, PZN-PT etc.) have been widely used for sensors, actuators, and electro-mechanical applications due to their excellent dielectric and piezoelectric properties. However, these materials are facing global restriction due to the toxicity of Pb. In this thesis, multiferroic properties of ferroelectric-ferromagnetic heterostructures consist of Pb-free perovskite oxides 0.5Ba(Zr_0.2Ti_0.8)O₃-0.5 (Ba_0.7 Ca_0.3)TiO₃ (BZT-BCT) and La_0.7Sr_0.3MnO₃ (LSMO) have been studied. The heterostructures BZT-BCT/LSMO were …

Tightening The Loop On The Circular Economy: Distributed Plastic Recycling With An Open Source Recyclebot, Shan Zhong

Dissertations, Master's Theses and Master's Reports

Following the goals of a circular economy, the growth of both plastic consumption and prosumer 3-D printing are driving an interest in producing 3-D printer filament from waste plastic. However, traditional recycling can have a significant environmental impact as it demands the collection and transportation of relatively low-density waste plastics to collection centers and reclamation facilities for separation and reconstruction. Compared to the traditional recycling, distributed recycling (where consumers directly recycle their own waste) has the potential to reduce energy consumption because it can save the energy for transportation needed in conventional recycling. A promising method of such distributed plastic …

Polyvinyl Alcohol (Pva) Fiber-Reinforced Rubber Concrete And Rubberized Self-Compacting Concrete, Jiaqing Wang

Dissertations, Master's Theses and Master's Reports

This study experimentally investigates the mechanical performance and durability of Polyvinyl Alcohol (PVA) fiber-reinforced rubber concrete and the rubberized self-compacting concrete. The waste rubber particles were introduced as a partial replacement of fine aggregate in the plain concrete. In addition, the waste tire rubbers were pre-treated with alkali surface treatment method to enhance the performance. The PVA fibers were added to the concrete mixes to enhance the post-failure resistance and thus fracture energy. Rubberized fiber concrete samples were prepared with different fine aggregate replacement ratios and the optimum fiber content. At the same time, the rubber particles had been used …