Physical Sciences and Mathematics Commons^™

Transitions Between Radial And Bipolar Liquid Crystal Drops In The Presence Of Novel Surfactants, Jake Shechter

Doctoral Dissertations

Liquid crystals (LCs) are a class of molecules that form a variety of configurations easily influenced by external interactions. Of particular interest are rod-like LC molecules confined to a spherical geometry, which have a competition between interfacial tension and elastic deformations. The configuration of the liquid crystal inside a droplet can be controlled using surfactants, influencing the boundary conditions, in an oil-in-water emulsion. I tested the effects of novel surfactants on the configuration of the LC droplets. These novel surfactant molecules, synthesized by collaborators, are oligomers with either a variable length hydrophobic domain or protein sensitive hydrophilic domain. I tested …

Static And Dynamical Properties Of Multiferroics, Sayed Omid Sayedaghaee

Graduate Theses and Dissertations

Since the silicon industrial revolution in the 1950s, a lot of effort was dedicated to the research and development activities focused on material and solid-state sciences. As a result, several cutting-edge technologies are emerging including the applications of functional materials in the design and enhancement of novel devices such as sensors, highly capable data storage media, actuators, transducers, and several other types of electronic tools. In the last two decades, a class of functional materials known as multiferroics has captured significant attention because of providing a huge potential for new designs due to possessing multiple ferroic order parameters at the …

Stability Of Group Four Monochalcogenides In Water And Air, William Shattuck

Graduate Theses and Dissertations

Previously published works have simulated the behavior of monolayer group IV monochalcogenides and predicted them to have very useful electronic properties. These simulations have also predicted that monolayers of group IV monochalcogenides will degrade quickly when exposed to water, even in extremely low concentrations. We hypothesize that thin samples of these materials will show signs of degradation if left in air and in water for an extended period of time.

Samples of each of the four monochalcogenides (GeS, GeSe, SnS and SnSe) were exfoliated onto clean oxidized silicon substrates. Chemical analysis showed the SnSe samples were contaminated, so they were …

Lattice And Charge Order In Layered Bi-Based Topological Insulators, Yanan Li

Theses and Dissertations

Bi2X3 (X=Se/Te) is a topological insulator, as well as a layered dichalcogenide. The topological properties of Bi2Se3 have gained a lot of interest over the past decade. However, as a layered chalcogenide, much of its uniqueness has not been fully discovered, e.g. hosting Charge Density Wave as reported in most other chalcogenides. With intercalation of Nb, Cu and Sr, Bi2Se3 becomes an unconventional superconductor. Together with its topological properties, A-Bi2X3 (A=Nb, Cu and Sr) have been proposed to be potential Topological superconductors. However, the mechanism of the unconventional SC in these compounds is still under discussion.

For my PhD research, …

Data Processing & Analysis For Atomic Force Microscopy (Afm), Molly Mcdonough, Polievkt Perov, Walter Johnson, Stevan Radojev

Undergraduate Theses and Capstone Projects

Scanning Probe Microscopy (SPM) has become a critical tool for characterization of materials in fields such as physics, material science, chemistry, and biology. Atomic Force Microscopy (AFM) is an increasingly useful technique because of its high resolution in three dimensions, the sample does not need to be conductive, and the technique does not need to take place in vacuum. AFM can image a wide variety of topographies and many different types of materials. AFM can deliver 3D topography information from the angstrom level to the micron scale with high resolution. One of the most important aspects of Atomic Force Microscopy …

Adsorption And Reconfiguration Of Amphiphiles At Silica-Water Interfaces: Role Of Electrostatic Interactions, Van Der Waals Forces And Hydrogen Bonds, Yao Wu

LSU Doctoral Dissertations

The ability to explore and predict metastable structures of hybrid self-assemblies is of central importance for the next generation of advanced materials with novel properties. As compared to their thermodynamically stable forms, the kinetically stabilized materials show improved functionality potentially over their stable counterparts. The self-assembly processes usually originate from weak intermolecular interactions, involving a dynamic competition between attractive and repulsive interactions. These weak forces, including van der Waals (vdW), electrostatic interaction and the hydrogen bonding (H-bonding), can be tuned by external stimuli, e.g., confinement, temperature and ionization, and consequently driving hybrid materials into different configurations. It is challenging to …

Using Current-Voltage Characteristics To Probe The Transport Mechanism In Carbon Nanotube Networks, Alejandro Jimenez

Physics

Carbon nanotube (CNT) random networks have shown great promise in electronic applications. For example, they have been used as the active layer in thin film transistor biosensors and as electrodes in supercapacitors (Hu, 2010). Although CNT networks applications are numerous, some of the key details of their electrical behavior are not fully understood. In particular, it is known that the junctions between tubes in CNT networks play a key role in determining the sensing properties of the network (Thanihaichelvana, et al., 2018), however, the mechanism by which metallic-semiconducting (m-s) tube junctions affect the electrical sensing properties of the network is …

Wave Propagation In Random And Topological Media, Yuhao Kang

Dissertations, Theses, and Capstone Projects

This thesis discusses wave propagation in two kinds of systems, random media and topological insulators. In a disordered system, the wave is randomized by multiple scattering. The scattering matrix and associated delay times are powerful tools with which to describe wave transport. We discuss the relation among the Wigner time, the transmission time, and energy density in a lossless or lossy system. We propose the zeros of the transmission matrix and show how to manipulate the zero-transmission mode in a nonunitary system. In a photonic topological insulator, we realize an edge mode and discuss its robustness in the face of …

Emulating Condensed Matter Systems In Classical Wave Metamaterials, Matthew Weiner

Dissertations, Theses, and Capstone Projects

One of the best tools we have for the edification of physics is the analogy. When we take our classical set of states and dynamical variables in phase space and treat them as vectors and Hermitian operators respectively in Hilbert space through the canonical quantization, we lose out on a lot of the intuition developed with the previous classical physics. With classical physics, through our own experiences and understanding of how systems should behave, we create easy-to-understand analogies: we compare the Bohr model of the atom to the motion of the planets, we compare electrical circuits to the flow of …

Control Of Molecular Energetics And Transport Via Strong Light-Matter Interaction, Rong Wu

Dissertations, Theses, and Capstone Projects

Strong light-matter coupling in excitonic systems results in the formation of half-light half-matter quasiparticles called exciton polaritons. These hybrid quasiparticles take on the best of both systems, namely, the long-range propagation and coherence arising from the photonic component and the nonlinear interaction from the excitonic component. We develop methods for making high quality factor cavities and investigate the potential applications of these strongly coupled states arising specifically in organic molecular systems.

In the first project we investigate the potential of organic dye molecules to undergo condensation in an optical cavity at room temperature. The second study involves the use of …

Linear And Non-Linear Elastic Constants Of Crystalline Materials From First-Principles Calculations, David Cuffari

Dissertations, Theses, and Capstone Projects

Novel methods based on the use of density functional theory (DFT) calculations are developed and applied to calculate linear and non-linear elastic constants of materials at zero and finite temperature. These methods rely on finite difference techniques and are designed to be general, numerically accurate, and suitable to investigate the thermoelastic properties of anharmonic materials. A first method was developed to compute the third-order elastic constants of crystalline materials at zero temperature, a task that is numerically challenging and is currently undertaken by using approaches typically applicable to cubic and hexagonal crystalline systems. This method relies on numerical differentiation of …

Yield-Stress Fluids In Confined Geometries, Thalia Magyar

Electronic Thesis and Dissertation Repository

A yield-stress fluid is a material that has properties of both solids and conventional liquids that only begins to flow when subject to a finite stress. The behaviour of yield-stress fluids is interesting and important in many applications. It is expected that the rheological properties of a yield-stress fluid will change when confined to a region with a length scale comparable to the characteristic scale of its microstructure. The particle size and polydispersity of two yield-stress fluids, Carbopol and poly(N-isopropylacrylamide), were determined using dynamic light scattering. A rheological characterization was performed on these two yield-stress fluids. Flow of …

Electronic And Local Structures Of Pt-Based Bimetallic Alloy And Core-Shell Systems, Jiatang Chen

Electronic Thesis and Dissertation Repository

This thesis investigates the electronic structure of Pt for catalysis applications. The importance of the Pt 5d band is discussed in terms of the bonding capability of Pt. The oxygen reduction reaction in proton exchange membrane fuel cells is chosen as the catalytic reaction model to illustrate the effect of Pt 5d states on Pt-O interaction. Pt-based bimetallic systems are introduced as a solution for the high price and limited resources of Pt. Despite lower usage of Pt, the tuning capability to optimize the Pt 5d band in bimetallic catalysts is supposed to provide superior catalytic activity. Advanced synchrotron X-ray …

Understanding The Magnetic Properties Of Ii-Vi Semiconductor Nanocrystals, Alex Khammang

Electronic Theses and Dissertations

Semiconductor nanocrystals (NC) are well known for their unique size tunable optical properties making them suitable candidates for devices such as light emitting diodes (LEDs), solar cells, and cellular labels. II-VI semiconductors in the bulk form behave diamagnetically, but can inherit paramagnetic (PM) or ferromagnetic (FM) properties at the nanoscale. Reports suggest that the emergence of weak PM or FM behavior in undoped NCs are attributed to the increased surface to volume ratio compared for NCs. Traditionally, these NCs only obtain magnetic properties after doping with certain transition metals, such as Co, Mn, or Fe. Many mechanisms have been proposed …

Exploring Structural And Electronic Properties Of Triangular Adatom Layers On The Silicon Surface Through Adsorbate Doping, Tyler S. Smith

Doctoral Dissertations

The analysis of the electronic structure and morphology of 1/3 monolayers (ML) of Sn or Pb on Si(111) and Ge(111) has played an important role in understanding the role of electronic correlations in two dimensions. Specifically, the two-dimensional lattice of partially filled dangling bonds of these so-called α-phases has been an important testbed for studying structural phase transitions and correlated electronic phenomena ever since the discovery of a surface charge density wave in the Pb/Ge(111) system more than two decades ago. With the exception of the novel Sn/Si(111) system, all $\alpha$-phases undergo a charge ordering transition at low temperature. The …

Numerical Studies Of Multi-Orbital Hubbard Models, Nitin Kaushal

Doctoral Dissertations

This thesis examines the emergence of exotic phases in multi-orbital Hubbard models due to competition between Coulomb interaction, spin-orbit coupling and kinetic energy. Exact diagonalization and numerically accurate density matrix renormalization group methods are used to study small clusters and one dimensional chains. Two dimensional lattices are solved using unrestricted real-space Hartree-Fock approximation. Novel excitonic insulators, due to condensation of spin-orbit excitons, are found in the spin-orbit coupling vs Coulomb interation phase diagrams of (t_2g)ⁿ systems for n = 4 and 3.5. Moreover, the presence of a BCS-BEC crossover in the (t_2g)4 excitonic insulator is …

Electron Emission And Transport Properties Database For Spacecraft Charging Models, Phil Lundgreen

Theses and Dissertations

Modeling the rate and likelihood of spacecraft charging during spacecraft mission is critical to determine mission length, proposed spacec­raft attitude, and spacecraft design. The focus of this work is the creation and utilization of a database of secondary electron yield (SEY) measurements for a host of materials to increase accuracy in spacecraft modeling. Traditional methods of SEY data selection for input into spacecraft charging codes typically include the use of compiled materials databases incorporated in charging codes or selecting values from a specific scientific study. The SEY database allows users to select data inputs based upon the details associated with …

Heterostructure Of 2d Materials: Hfs2/Hfo2/Si, Christopher J. Robledo

MSU Graduate Theses

Heterostructures have been utilized in electronic devices for over 50 years with the proposal for the first heterostructure transistor in 1957. With the scaling of devices, it is necessary to create new heterostructures that will comply with Moore’s Law, as well as make devices faster and consume less power. Novel 2D materials, such as hafnium disulfide, have shown promise as an active channel layer, while hafnium dioxide is already proven to be a replacement of silicon dioxide for the gate insulating layer. However, fabrication techniques for wide-scale integration of these heterostructures have not yet been achieved. Also, the dielectric properties …

A Structural Study Of Correlated Materials: Incipient Mott Insulators And Low-Dimensional Systesm., Alaa Alfailakawi

Electronic Theses and Dissertations

Current theories of high-temperature superconductivity suggest that electrons must organize into Cooper pairs in order for a material to exhibit a superconducting phase. Electrons in insulators experience significant repulsive interactions that tend to keep electrons localized at atomic positions. In contrast, electrons in metals are delocalized, interact weakly, and are free to conduct electricity. Therefore, the formation of Cooper pairs should have different mechanisms for metals compared to insulators. This contrast raises the debate about the origin of high-temperature superconductivity in iron-based material, whether it depends on the strong or weak coupling. Many iron-based materials are metallic in the normal …

Theoretical Modeling Of Metallic Compounds With Versatile Properties By Combining First-Principles Calculations And Global Structure Prediction Algorithms, Jinseon Park

Doctoral Dissertations

Improving the target properties of existing materials or finding new materials with enhanced functionality for practical applications is at the heart of the materials research. In this respect, the first-principles approaches, which have been successfully integrated into modern high- performance computers, have become an indispensable part of the materials research, providing a better understanding of existing materials and guidance on the design of new materials. Using state-of-the-art computational/theoretical approaches that couple global structure prediction with ab initio density functional theory calculations, we investigate structural and electronic properties of Cs_xO [cesium oxides], Li_1+xMn₂O₄ [lithium …

High Pressure Synchrotron Xrd, Nfs, And Nrixs Studies Of Fesb2, Melanie Alden White

UNLV Theses, Dissertations, Professional Papers, and Capstones

This work combines high pressure synchrotron X-ray diffraction (XRD), nuclear forward scattering (NFS), and nuclear resonant inelastic X-ray scattering (NRIXS) experiments on iron diantimonide (FeSb2), a promising thermoelectric material. NRIXS uses the interaction between excited nuclear and lattice states to directly measure the phonon density of states (PDOS) for samples containing certain Mössbauer isotopes. For our experiments, we synthesized FeSb2 enriched with the isotope 57Fe and measured the partial PDOS for 57Fe sites in the FeSb2 lattice. NFS, also known as synchrotron Mössbauer spectroscopy, is a sister technique to NRIXS that studies the hyperfine structure of the excited Mössbauer nuclei. …

Kinetics Of The Crystal-Melt Phase Transformation In Semicrystalline Polymers, Kiran Subramaniam Iyer

Doctoral Dissertations

The assembly of long-chain polymers into an ordered state is a process that has puzzled polymer scientists for several decades. A process that is largely controlled by the strength of intermolecular attractions in small molecular systems, this crystallization in the case of polymers is controlled by a competition between the aforementioned force of attraction between monomers and the formidable conformational entropy of polymer chains. Any factor that affects this conformational entropy, whether that is an equilibrium thermodynamic factor or a kinetic factor, has the ability to control polymer crystallization. In this thesis, we focus on understanding the underlying kinetic processes …

Quantum Criticality In Strongly Correlated Electron Systems, Samuel Obadiah Kellar

LSU Doctoral Dissertations

The study of the Hubbard model in three dimensions contains a variety of phases dependent upon the chosen parameters. This thesis shows that there is the indication of a zero temperature phase transition at a finite doping. The Hubbard model has been used to identify a similar quantum critical point in two dimensions. The presented results continue these investigations. The system demonstrates a strange metal phase at finite temperature which cannot be described in term of the conventional Fermi liquid. While there have been extensive studies over the past three decades for such materials in two dimensions, there are few …

Identifying Structure Transitions Using Machine Learning Methods, Nicholas Walker

LSU Doctoral Dissertations

Methodologies from data science and machine learning, both new and old, provide an exciting opportunity to investigate physical systems using extremely expressive statistical modeling techniques. Physical transitions are of particular interest, as they are accompanied by pattern changes in the configurations of the systems. Detecting and characterizing pattern changes in data happens to be a particular strength of statistical modeling in data science, especially with the highly expressive and flexible neural network models that have become increasingly computationally accessible in recent years through performance improvements in both hardware and algorithmic implementations. Conceptually, the machine learning approach can be regarded as …

Modeling Single Microtubules As A Colloidal System To Measure The Harmonic Interactions Between Tubulin Dimers In Bovine Brain Derived Versus Cancer Cell Derived Microtubules, Arooj Aslam

Dissertations

The local properties of tubulin dimers dictate the properties of the larger microtubule assembly. In order to elucidate this connection, tubulin-tubulin interactions are be modeled as harmonic interactions to map the stiffness matrix along the length of the microtubule. The strength of the interactions are measured by imaging and tracking the movement of segments along the microtubule over time, and then performing a fourier transform to extract the natural vibrational frequencies. Using this method the first ever reported experimental phonon spectrum of the microtubule is reported. This method can also be applied to other biological materials, and opens new doors …

D-Orbital Occupancy Of Transition Metal Oxides By X-Ray Absorption Near Edge Structure (Xanes), Eric Kurywczak

Seton Hall University Dissertations and Theses (ETDs)

XANES L₂ and L₃-edge X-Ray Absorption Near Edge Spectra (XANES) for 4d and 5d row transition metals (TM) oxides are assumed to be directly reflecting unoccupied d orbitals influenced by the local symmetry of the metal ion. XANES L₂- and L₃-edge data analysis through non-linear curve fitting allows for a unique, efficient look at the structural eccentricities of transition metal oxides. In this way it is possible to determine the oxidation state of a material as well as its site symmetry. We have used non-linear least-squares fitting across the near-edge region …

Measurement, Dissipation, And Quantum Control With Superconducting Circuits, Patrick Harrington

Arts & Sciences Electronic Theses and Dissertations

The interaction between a superconducting circuit and its environment can cause decoherence. However, interactions with an environment are necessary for quantum state preparation and measurement. Through the dynamics of open quantum systems, the environment is a resource to control and readout superconducting circuit states. I present an experimental result demonstrating qubit state stabilization from engineered dissipation with a microwave photonic crystal. In addition, I discuss the statistical arrow of time in the dynamics of continuous quantum measurement. These results demonstrate an interplay between open quantum system dynamics and statistics, which highlights the role of both dissipation and measurement for quantum …

Density Functional Theory Calculations Of Al Doped Hafnia For Different Crystal Symmetry Configurations, Joshua Steier

Seton Hall University Dissertations and Theses (ETDs)

Dogan et al.[1], investigated the causes of ferroelectricity in doped hafnia using ab initio methods. Similarly, we investigated the stability of Al doped hafnia using quantum mechanical methods.

There are many different phases of Hafnia: monoclinic, tetragonal, cubic and orthorhombic. Starting with the monoclinic phase of Hafnia, Hafnia undergoes phase transitions which result in different space groups. The temperature at which the tetragonal phase is induced is 2000 K and cubic phase is induced at 2900 K[1]. Different dielectric constants vary from phase to phase. The average dielectric constants are highest for the cubic and tetragonal phases. In order to …

Studies Of Maximum Supercooling And Stirring In Levitated Liquid Metallic Alloys, Mark Edward Sellers

Arts & Sciences Electronic Theses and Dissertations

Nucleation—or the formation of some cluster in a medium undergoing a phase transition—is usually the initial step in a phase transition. However, this process is still not fully understood, as outstanding questions related to the role of structure, local order, and diffusion remain unanswered. Systematic supercooling studies on metallic liquids performed using electrostatic and electromagnetic (ESL and EML, respectively) will be presented and discussed within the context of several nucleation theories, such as the Classical Nucleation Theory, Diffuse Interface Theory, and Coupled-Flux theory. To study the role of diffusion on nucleation, studies on the International Space Station using the on-board …

Thermophysical Properties And Phase Transformations In Metallic Liquids And Silicate Glasses, Daniel Christian Van Hoesen

Arts & Sciences Electronic Theses and Dissertations

The first quantitative measurements of the electrical resistivity in binary metallic liquids, used to probe local order in the liquid, are reported in this dissertation. The electrical resistivity is very sensitive to short and medium range ordering because the electron mean free path is approximately the same length scale as the atomic spacing. Particular attention is given to the resistivity value at a crossover temperature that, based on molecular dynamics (MD) simulations, is the onset of cooperative motion in liquid alloys. Experimental evidence for the crossover is found in measurements of the shear viscosity, a dynamical property. An indication of …