Engineering Commons^™

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 …

Permeability, Structural Changes, Flow Regime Transitions In Fuel Cell Catalyst Layers And A Model For Predicting Trapped Saturation For Two-Phase Flow In Porous Media, Karrar Takleef Alofari

Dissertations, Master's Theses and Master's Reports

Proper water management in Proton Exchange Membrane (PEM) fuel cell is important to achieve high performance. Understanding the percolation of the produced water at the cathode catalyst layer (CL) is critical for any robust water management technique. In this study, an ex-situ experimental setup is used to study percolation in the CL at different injection rates and relative humidity (RH) conditions. The results show that increasing the flow rate force the liquid to flow through the bulk of the pores due to the dominant viscous effect. On the other hand, at low injection rates, the capillary becomes dominant and liquid …

Microscale Transverse Compression Modeling: A Comparative Study Of The Analytical Mac/Gmc Methods To Experimental Results, Emily Zeitunian

Dissertations, Master's Theses and Master's Reports

Composite materials require a multi-scale approach to fully understand its behavior. At the micro level, material behavior analysis is conducted most often using numerical or analytical approaches. These models, however, require validation from experimental data to ensure material predictions are accurate. This study compares a semi-analytical micromechanical analysis tool, MAC/GMC, to experimental results of in-situ microscale transverse compression testing conducted at AFRL facilities. Effective properties, stress-strain curves, stress and strain fields, and damage predictions are compared with experimental outputs. Both generalized method of cells (GMC) and high-fidelity generalized method of cells (HFGMC) theories implemented within MAC/GMC show results that agree …

Design And Analysis Of Marangoni-Driven Robotic Surfers, Mitchel L. Timm

Dissertations, Master's Theses and Master's Reports

We designed and experimentally studied the dynamics of two robotic systems that surf along the water-air interface. The robots were self-propelled by means of creating and maintaining a surface tension gradient resulting from an asymmetric release of isopropyl alcohol (IPA). The imbalance in the distribution of surface tension surrounding the robots generates a propulsive force commonly referred to as Marangoni propulsion. First, we considered a single surfer, which was custom-made with novel control mechanisms that allow for both forward motion and steering to be remotely adjusted solely through the manipulation of local surface stresses. We analyzed the performance of this …

Advancement Of Full-Vector Variable-Temperature Magnetometry For Rock-Magnetic And Paleointensity Applications, Leonid Surovitskii

Dissertations, Master's Theses and Master's Reports

Data on the variation of the direction and strength of Earth’s ancient magnetic field (absolute paleointensity) provide crucial information into the mechanisms of the geodynamo and the Earth’s thermal history. However, the use of conventional methods and instrumentation for absolute paleointensity determination has been hampered by physicochemical alteration of the samples caused by multiple high-temperature cycles and long experiment durations. The reliability and efficiency of the measurement process can be improved by the measurement of the full remanent magnetization vector simultaneously with the temperature cycling of a sample. Such as approach can also substantially expand the scope of materials available …

Multiscale Modeling Of Carbon Fibers/Graphene Nanoplatelets/Epoxy Hybrid Composites For Aerospace Applications, Hashim Al Mahmud

Dissertations, Master's Theses and Master's Reports

Significant research effort has been dedicated for decades to improve the mechanical properties of aerospace polymer-based composite materials. Lightweight epoxy-based composite materials have increasingly replaced the comparatively heavy and expensive metal alloys used in aeronautical and aerospace structural components. In particular, carbon fibers (CF)/graphene nanoplatelets (GNP)/epoxy hybrid composites can be used for this purpose owing to their high specific stiffness and strength. Therefore, this work has been completed to design, predict, and optimize the effective mechanical properties of CF/GNP/epoxy composite materials at different length scales using a multiscale modeling approach. The work-flow of modeling involves a first step of using …

Buckling Load Study On Pop Nut (Rivet) Using Finite Element Analysis, Saurabh Shankar Shegokar

Dissertations, Master's Theses and Master's Reports

This study highlights the material behavior in riveting operation that includes buckling load analysis using ABAQUS. Finite Element Analysis is used to find the buckling load vs. Displacement results and validated with the results obtained in physical testing of rivet (POP Nut). A mesh sensitivity study is performed using ABAQUS to understand the optimum mesh size for this analysis. An axisymmetric model with contact properties is created and simulated to reduce the simulation time using ABAQUS. The results obtained through Finite Element Analysis show a good resemblance with the testing results. Design changes were suggested to achieve better results that …

Increasing Access To Pv Technology Through Sustainable Racking: A Review Of Existing Literature And Ground Mounted Fixed Tilt Designs, And What Can Be Done Next, Parijata Prabhakara

Dissertations, Master's Theses and Master's Reports

There is a lack of literature on the structural balance of systems (BOS), also called racking, for ground mount, fixed-tilt solar PV systems. Literature that exists discusses mostly rooftop racking and installations, additional wind loading, and weight considerations imposed on roofs, and little guidance is provided in building codes. The lack of peer-reviewed guidance on design requirements for domestic and large-scale application solar PV racking systems leaves most consumers relying on expensive, patented, off-the-shelf hardware. As PV cell technology and module costs have improved, we can start to focus on PV BOS improvements (particularly racking) and move towards sustainable designs …

Easily Verifiable Controller Design With Application To Automotive Powertrains, Mohammad Reza Amini

Dissertations, Master's Theses and Master's Reports

Bridging the gap between designed and implemented model-based controllers is a major challenge in the design cycle of industrial controllers. This gap is mainly created due to (i) digital implementation of controller software that introduces sampling and quantization imprecisions via analog-to-digital conversion (ADC), and (ii) uncertainties in the modeled plant’s dynamics, which directly propagate through the controller structure. The failure to identify and handle these implementation and model uncertainties results in undesirable controller performance and costly iterative loops for completing the controller verification and validation (V&V) process.

This PhD dissertation develops a novel theoretical framework to design controllers that are …

Frontal Crash Analysis Of A Conformable Cng Tank Using Finite Element Analysis, Datta Sandesh Manjunath

Dissertations, Master's Theses and Master's Reports

The purpose of this study is to computationally model and analyze a Conformable Compressed Natural Gas (CNG) fuel tank for frontal crashes using Finite Element Analysis. Researchers have developed a CNG fuel tank, which is conformable, non-conventional and non-cylindrical. This tank increases cost efficiency, volumetric efficiency and cargo efficiency in CNG vehicle applications. A lightweight pickup truck (2015 Chevrolet Silverado) has been used to integrate the CNG tanks and field-testing has been conducted to demonstrate the application.

The report mainly focuses on the effective finite element modeling of the chassis, brackets and tanks using HYPERMESH and RADIOSS. The frontal crash …

Integration And Testing Of An Advanced Conformable Cng Tank In A Full-Sized Light-Duty Pickup, Abayomi Famuyiwa

Dissertations, Master's Theses and Master's Reports

Michigan Technological University is collaborating with Southwestern Energy and REL Inc. to develop and integrate a compressed natural gas (CNG) matrix tank that enables efficient packaging, increases range, and reduced cost for CNG vehicle applications. The vehicle being used in this project is a light-duty pickup truck to take advantage of the open space underneath the body and bed of the vehicle. With today’s cylindrical CNG tanks consuming cargo space, a solution is to develop a tank capable of being shaping to the underbody of the truck to free cargo space. University faculty and graduate students utilizes Finite Element Analysis …

Methodology For Analyzing Epoxy-Cnt Phononic Crystals For Wave Attenuation And Guiding, Madhu Kolati

Dissertations, Master's Theses and Master's Reports

Phononic crystals (PhnCs) control, direct and manipulate sound waves to achieve wave guiding and attenuation. This dissertation presents methodology for analyzing nanotube materials based phononic crystals to achieve control over sound, vibration and stress mitigation. Much of the analytical work presented is in identifying frequency band gaps in which sound or vibration cannot propagate through these PhnCs. Wave attenuation and mitigation analysis is demonstrated using finite element simulation. Engineering principles from current research areas of solid mechanics, solid-state physics, elasto-dynamics, mechanical vibrations and acoustics are employed for the methodology. A considerable effort is put to show that these PhnCs can …

Computational Study Of Microstructure-Propertymechanism Relations In Ferroic Composites, Fengde D. Ma

Dissertations, Master's Theses and Master's Reports - Open

Ferroic materials, as notable members of smart materials, have been widely used in applications that perform sensing, actuation and control. The macroscopic property change of ferroic materials may become remarkably large during ferroic phase transition, leading to the fact that the macroscopic properties can be tuned by carefully applying a suitable external field (electric, magnetic, stress). To obtain an enhancement in physical and/or mechanical properties, different kinds of ferroic composites have been fabricated. The properties of a ferroic composite are determined not only by the properties and relative amounts of the constituent phases, but also by the microstructure of individual …

Transient Thermoelectric Supercooling: Isosceles Current Pulses From A Response Surface Perspective And The Performance Effects Of Pulse Cooling A Heat Generating Mass, Alfred Piggott

Dissertations, Master's Theses and Master's Reports

With increased public interest in protecting the environment, scientists and engineers aim to improve energy conversion efficiency. Thermoelectrics offer many advantages as thermal management technology. When compared to vapor compression refrigeration, above approximately 200 to 600 watts, cost in dollars per watt as well as COP are not advantageous for thermoelectrics. The goal of this work was to determine if optimized pulse supercooling operation could improve cooling capacity or efficiency of a thermoelectric device. The basis of this research is a thermal-electrical analogy based modeling study using SPICE. Two models were developed. The first model, a standalone thermocouple with no …

In-Situ Tem Plasma Chip Nanofabrication And Characterization, Xuebo Cui

Dissertations, Master's Theses and Master's Reports - Open

A silicon-based microcell was fabricated with the potential for use in in-situ transmission electron microscopy (TEM) of materials under plasma processing. The microcell consisted of 50 nm-thick film of silicon nitride observation window with 60μm distance between two electrodes. E-beam scattering Mont Carlo simulation showed that the silicon nitride thin film would have very low scattering effect on TEM primary electron beam accelerated at 200 keV. Only 4.7% of primary electrons were scattered by silicon nitride thin film and the Ar gas (60 μm thick at 1 atm pressure) filling the space between silicon nitride films. Theoretical calculation also showed …

Effect Of External Electric Field On Hydrogen Adsorption Over Activated Carbon Separated By Dielectric Materials, Zheng Zhang

Dissertations, Master's Theses and Master's Reports - Open

Energy crisis and worldwide environmental problem make hydrogen a prospective energy carrier. However, storage and transportation of hydrogen in large quantities at small volume is currently not practical. Lots of materials and devices have been developed for storage hydrogen, but to today none is able to meet the DOE targets.

Activated carbon has been found to be a good hydrogen adsorbent due to its high surface area. However, the weak van der Waals force between hydrogen and the adsorbent has limited the adsorption capacity. Previous studies have found that enhanced adsorption can be obtained with applied electric field. Stronger interaction …

Heat Transfer In Microwave Heating, Zhiwei Peng

Dissertations, Master's Theses and Master's Reports - Open

Heat transfer is considered as one of the most critical issues for design and implement of large-scale microwave heating systems, in which improvement of the microwave absorption of materials and suppression of uneven temperature distribution are the two main objectives. The present work focuses on the analysis of heat transfer in microwave heating for achieving highly efficient microwave assisted steelmaking through the investigations on the following aspects: (1) characterization of microwave dissipation using the derived equations, (2) quantification of magnetic loss, (3) determination of microwave absorption properties of materials, (4) modeling of microwave propagation, (5) simulation of heat transfer, and …

Microwave-Assisted Wet Chemical (Mawc) Synthesis Of Lithium Iron Phosphate, Shangzhao Shi

Dissertations, Master's Theses and Master's Reports - Open

LiFePO4 is a Co-free battery material. Its advantages of low cost, non-toxic and flat discharge plateau show promising for vehicle propulsion applications. A major problem associated with this material is its low electrical conductivity. Use of nanosized LiFePO4 coated with carbon is considered a solution because the nanosized particles have much shorter path for L+ ions to travel from the LiFePO4 crystal lattice to electrolytes. As other nano material powders, however, nano LiFePO4 could have processing and health issues.

In order to achieve high electrical conductivity while maintaining a satisfactory manufacturability, the particles should possess both of the nano- and …

Molecular Modeling Of Epon 862-Detda Polymer , Ananyo Bandyopadhyay

Dissertations, Master's Theses and Master's Reports - Open

EPON 862 is an epoxy resin which is cured with the hardening agent DETDA to form a crosslinked epoxy polymer and is used as a component in modern aircraft structures. These crosslinked polymers are often exposed to prolonged periods of temperatures below glass transition range which cause physical aging to occur. Because physical aging can compromise the performance of epoxies and their composites and because experimental techniques cannot provide all of the necessary physical insight that is needed to fully understand physical aging, efficient computational approaches to predict the effects of physical aging on thermo-mechanical properties are needed. In this …

Technique To Measure Heats Of Reaction Of Ti-B, Al-Ti-B, And Al-Ti-B4c Powder Blends, Andrew H. Baker

Dissertations, Master's Theses and Master's Reports - Open

In this research, a modification to initiation aid ignition in bomb calorimetry that involves systemically blending levels of boron and potassium nitrate initiation aids with a bulk structural energetic elemental power blend is developed. A regression is used to estimate the nominal heat of reaction for the primary reaction. The technique is first applied to the synthesis of TiB2 as a validation study to see if close proximity to literature values can be achieved. The technique is then applied to two systems of interest, Al-Ti-B, and Al-Ti-B4C. In all three investigations, x-ray diffraction is used to characterize the product phases …

Processing And Mechanical Properties Of Cast Aluminum Containing Scandium, Zirconium, And Ytterbium , Nicholas D. Johnson

Dissertations, Master's Theses and Master's Reports - Open

A series of aluminum alloys containing additions of scandium, zirconium, and ytterbium were cast to evaluate the effect of partial ytterbium substitution for scandium on tensile behavior. Due to the high price of scandium, a crucible-melt interaction study was performed to ensure no scandium was lost in graphite, alumina, magnesia, or zirconia crucibles after holding a liquid Al-Sc master alloy for 8 hours at 900 °C in an argon atmosphere. The alloys were subjected to an isochronal aging treatment and tested for conductivity and Vickers microhardness after each increment. For scandium-containing alloys, peak hardnesses of 520-790 MPa, and peak tensile …

Effects Of Silicon Content And Cooling Rate On Mechanical Properties Of Heavy Section Ductile Cast Iron , Meghan Haycock

Dissertations, Master's Theses and Master's Reports - Open

The effects of Si and cooling rate are investigated for their effect on the mechanical properties and microstructure. Three alloys were chosen with varying C and Si contents and an attempt to keep the remainder of the elements present constant. Within each heat, three test blocks were poured. Two blocks had chills – one with a fluid flowing through it to cool it (active chill) and one without the fluid (passive) – and the third block did not have a chill. Cooling curves were gathered and analyzed. The mechanical properties of the castings were correlated to the microstructure, cooling rate …

High Temperature, Low Cycle Fatigue Of A Hybrid Particulate/Fiber Aluminum Metal-Matrix Composite , Justin Clark

Dissertations, Master's Theses and Master's Reports - Open

The effect of shot particles on the high temperature, low cycle fatigue of a hybrid fiber/particulate metal-matrix composite (MMC) was studied. Two hybrid composites with the general composition A356/35%SiC particle/5%Fiber (one without shot) were tested. It was found that shot particles acting as stress concentrators had little effect on the fatigue performance. It appears that fibers with a high silica content were more likely to debond from the matrix. Final failure of the composite was found to occur preferentially in the matrix. SiC particles fracture progressively during fatigue testing, leading to higher stress in the matrix, and final failure by …

Structure And Properties Of Graphene Nano Disks (Gnd) With And Without Edge-Dopants, Pubodee Ratana-Arsanarom

Dissertations, Master's Theses and Master's Reports - Open

Graphene is one of the most important materials. In this research, the structures and properties of graphene nano disks (GND) with a concentric shape were investigated by Density Functional Theory (DFT) calculations, in which the most effective DFT methods - B3lyp and Pw91pw91 were employed.

It was found that there are two types of edges - Zigzag and Armchair in concentric graphene nano disks (GND). The bond length between armchair-edge carbons is much shorter than that between zigzag-edge carbons. For C24 GND that consists of 24 carbon atoms, only armchair edge with 12 atoms is formed. For a GND larger …

Investigation Into The Impact Of Grain Boundaries, Film Interface, And Crystallographic Orientation On The Ionic Conductivity Of Thin Film Gadolinium-Doped Ceria, Matthew M. Swanson

Dissertations, Master's Theses and Master's Reports - Open

The research reported in this dissertation investigates the impact of grain boundaries, film interface, and crystallographic orientation on the ionic conductivity of thin film Gd-doped CeO2 (GDC).

Chapter 2 of this work addresses claims in the literature that submicron grain boundaries have the potential to dramatically increase the ionic conductivity of GDC films. Unambiguous testing of this claim requires directly comparing the ionic conductivity of single-crystal GDC films to films that are identical except for the presence of submicron grain boundaries. In this work techniques have been developed to grow GDC films by RF magnetron sputtering from a GDC target …

Measuring The Elastic Modulus Of Polymers Using The Atomic Force Microscope, Daniel Hoffman

Dissertations, Master's Theses and Master's Reports - Open

Testing a new method of nanoindentation using the atomic force microscope (AFM) was the purpose of this research. Nanoindentation is a useful technique to study the properties of materials on the sub-micron scale. The AFM has been used as a nanoindenter previously; however several parameters needed to obtain accurate results, including tip radius and cantilever sensitivity, can be difficult to determine. To solve this problem, a new method to determine the elastic modulus of a material using the atomic force microscope (AFM) has been proposed by Tang et al. This method models the cantilever and the sample as two springs …

Charge Induced Enhancement Of Adsorption For Hydrogen Storage Materials, Xiang Sun

Dissertations, Master's Theses and Master's Reports - Open

The rising concerns about environmental pollution and global warming have facilitated research interest in hydrogen energy as an alternative energy source. To apply hydrogen for transportations, several issues have to be solved, within which hydrogen storage is the most critical problem. Lots of materials and devices have been developed; however, none is able to meet the DOE storage target. The primary issue for hydrogen physisorption is a weak interaction between hydrogen and the surface of solid materials, resulting negligible adsorption at room temperature. To solve this issue, there is a need to increase the interaction between the hydrogen molecules and …

High Cycle Fatigue Of Aa6082 And Aa6063 Aluminum Extrusions , Nicholas E. Nanninga

Dissertations, Master's Theses and Master's Reports - Open

The high cycle fatigue behavior of hollow extruded AA6082 and AA6063 aluminum extrusions has been studied. Hollow extruded aluminum profiles can be processed into intricate shapes, and may be suitable replacements for fatigue critical automotive applications requiring reduced weight. There are several features inherent in hollow aluminum extrusions, such as seam welds, charge welds, microstructural variations and die lines. The effects of such extrusion variables on high cycle fatigue properties were studied by taking specimens from an actual car bumper extrusion. It appears that extrusion die lines create large anisotropy differences in fatigue properties, while welds themselves have little effect …

Shear Band Evolution In Zr/Hf-Based Bulk Metallic Glasses Under Static And Dynamic Indentations, Hongwen Zhang

Dissertations, Master's Theses and Master's Reports - Open

Bulk metallic glasses (BMGs) exhibit superior mechanical properties as compared with other conventional materials and have been proposed for numerous engineering and technological applications. Zr/Hf-based BMGs or tungsten reinforced BMG composites are considered as a potential replacement for depleted uranium armor-piercing projectiles because of their ability to form localized shear bands during impact, which has been known to be the dominant plastic deformation mechanism in BMGs. However, in conventional tensile, compressive and bending tests, limited ductility has been observed because of fracture initiation immediately following the shear band formation. To fully investigate shear band characteristics, indentation tests that can confine …

Effect Of Microstructure And Alloying Elements On The Resistance Of Fastener Grade Steels To Hydrogen Assisted Cracking , Nicholas E. Nanninga

Dissertations, Master's Theses and Master's Reports - Open

Fastener grade steels with varying alloy contents and heat treatments were employed to measure changes in resistance to hydrogen assisted cracking. The testing procedure compared notched tension specimens fractured in air to threshold stress values obtained during hydrogen charging, utilizing a rising step load procedure. Bainitic structures improved resistance by 10-20% compared to tempered martensite structures. Dual phase steels with a tempered martensite matrix and 20% ferrite were more susceptible and notch sensitive. High strength, fully pearlitic structures showed an improvement in resistance. Carbon content, per se, had no effect on the resistance of steel to hydrogen assisted cracking. Chromium …