Condensed Matter Physics Commons^™

Niobium Titanium Nitride Thin Film Deposition, Optimization, And Characterization, Hudson Horne

UNF Graduate Theses and Dissertations

Superconducting thin film devices such as Josephson junctions are a staple of cutting-edge quantum and classical computing architectures. Functional devices require optimized materials with properties suited to the device application; properties like superconducting critical temperature, critical current density, resistivity, and surface roughness are important depending on the intended device application. Niobium titanium nitride (NbTiN), a fcc transition metal nitride, is a promising material for these applications, with a superconducting critical temperature among the highest of the superconductors described by Bardeen, Cooper, and Schreiffer (BCS) theory. NbTiN has excellent mechanical and electrical characteristics and is easily deposited via reactive magnetron sputtering …

Quantum Hall Phases In Monolayer Graphene, Jincheng An

Theses and Dissertations--Physics and Astronomy

In the presence of a perpendicular magnetic field, monolayer graphene at and near charge neutrality forms a quantum Hall ferromagnet—a correlated electronic state where the interplay of interactions, spin, and valley degrees of freedom leads to spontaneous symmetry breaking. While the dominant Coulomb interaction has $SU(4)$ symmetry, the ground state is ultimately determined by subdominant terms: residual lattice-scale anisotropic interactions, Zeeman, and sublattice couplings. Relaxing the ultra-short-range limit of anisotropic interactions unveils diverse symmetry-breaking phases in both integer and fractional quantum Hall regimes. Haldane pseudopotentials, which quantify interactions between particle pairs with fixed relative angular momentum, provide a readily parameterizable …

Structural And Physical Properties Of Solid State Materials: Cegage, Cssni3, And Yb2Si2-XGeXAl, Liam J. Scanlon

Theses and Dissertations--Physics and Astronomy

We present studies of three independent solid state materials: CeGaGe, CsSnI₃, and Yb₂Si_2-xGe_xAl.

CeGaGe is a magnetic candidate Weyl semimetal. Magnetic Weyl semimetals have possible technological applications due to their electronically conducting bulk states, magnetic states, and topologically protected surface states. We grew single crystals of CeGaGe using the zone-refinement method and flux-growth method. With single crystal X-ray and neutron diffraction, we found that zone-refined CeGaGe crystallizes with the I4₁md symmetry (space group 109). With single crystal X-ray diffraction, we found that flux-grown samples of CeGaGe have the …

Photocarrier Dynamics In Dielectric And Metal-Dielectric Nanocatalysts In Ambient And Operando Conditions, Sunil Gyawali

Graduate Theses, Dissertations, and Problem Reports (ETD)

Photocatalysis, a promising method for solar-to-chemical energy conversion, relies on sunlight to generate excited charge carriers in catalysts with sufficient lifetimes and mobilities to drive photoreactions. Thin-film semiconductors are essential for reducing charge recombination and enhancing mobility but suffer from a low surface-to-volume ratio problems, resulting in a reduced absorption coefficient and limiting solar-energy-conversion efficiency. Nanostructures address these limitations by enhancing light absorption and surface reactivity. However, efficient photocatalysis also requires that the semiconductor’s band edges align with the redox potential of the desired photoreaction, limiting light absorption to just some of the whole solar spectrum. In hybrid and composite …

Theoretical Study Of Phase-Ordering Kinetics With An Anisotropic Surface Tension, Arjun Anand, Ben Vollmayr-Lee

Honors Theses

Coarsening describes the phase-separation dynamics that follows after a temperature quench from a stable to unstable region of the phase diagram in binary systems. Whereas binary systems with an isotropic surface tension have been thoroughly examined and modeled, the case of an anisotropic surface tension lacks the same degree of analysis and development. In this thesis, we demonstrate the self-consistency of the scaling hypothesis with an anisotropic surface tension in the dilute limit. We begin by assuming weak anisotropy in the surface tension and working only to first order in perturbation theory. Following a similar approach laid out in the …

Effect Of Reduction Annealing On The Structural And Electrical Properties Of Α-Moo3 Thin Films, Sandipani Ghosh

Graduate Theses/Dissertations

2D layered molybdenum oxide has attracted significant research interest due to its tuneable bandgap and diverse structural, chemical, electrical, and optical properties influenced by growth parameters and synthesis techniques. In this study, the effects of reduction annealing on the structural and electrical properties of few-layer MoO₃ thin films, deposited on Si/SiO₂ substrates via pulsed laser deposition, were investigated. X-ray diffraction revealed nanocrystalline structures with a preferred (020) orientation, reduction annealing produced highly crystalline orthorhombic α-MoO₃ with reduced unit cell volume. FESEM/EDS provided detailed analyses of microstructures and elemental compositions. Raman spectroscopy confirmed the orthorhombic structure, with characteristic peaks at 667, …

Development And Application Of Computational Tools For Data-Driven Materials Science., Logan L. Lang

Graduate Theses, Dissertations, and Problem Reports (ETD)

Modern materials science generates vast amounts of data from computational simulations and experiments, creating significant challenges for data processing and analysis. This thesis addresses these challenges through the development and application of computational tools within the framework of Material Data Science (MDS). Contributions span the four pillars of MDS: Material/Molecular Data, Algorithms, Databases, and High-Throughput Processes—with a primary focus on the Algorithm, Data, Database pillars.

For the Algorithm pillar, two Python libraries were developed to streamline common analysis tasks. PyProcar simplifies the post-processing and visualization of electronic structure data (band structures, density of states, Fermi surfaces) obtained from various Density …

Systematic Methodologies For Magnetic Materials Design, Andres Tellez Mora

Graduate Theses, Dissertations, and Problem Reports (ETD)

Understanding and predicting the magnetic behavior of materials from first principles is one of the central challenges in condensed matter physics. This dissertation presents a systematic framework that bridges ab initio calculations, many-body physics, and effective spin models to analyze magnetic materials in particular, but also more general quantum systems. Starting from the electron many-body Hamiltonian and the second quantization formalism, we derive Density Functional Theory (DFT) and explain how magnetic properties emerge from exchange interactions and can be interpreted as perturbations to the magnetization density. To capture these effects efficiently, we construct Heisenberg models from first principles using the …

0th Order Solutions Of The Wavefunctions For The Quantum Elliptical Box And Microstrip Antenna, Nishtha Tikalal

Honors Undergraduate Theses

For a quantum particle confined to a two-dimensional elliptical box or electromagnetic wave in a microstrip antenna, geometrical and boundary condition interplay result in a spectrum of spatial patterns. Due to the asymmetrical nature of the ellipse, we are faced with continuous symmetry reductions, leaving both degenerate and nondegenerate solutions. Here, we present a complete derivation of an analytical solution and visualizations of the fundamental wavefunctions for both Dirichlet and Neumann boundary conditions respectively corresponding to the quantum elliptical box and the elliptical microstrip antenna.

We demonstrate that the eigenmodes, governed by eccentricity, directly correspond to the modal field distributions …

Periodic Trends In The Electronic And Magnetic Structure Of Superatomic 3d Transition Metal Chalcogenide Clusters, Gabriel Bohannon

Theses and Dissertations

We have systematically investigated the electronic structure of octahedral transition metal chalcogenide clusters, TM₆S₈(CO)₆, in which the transition metal atoms are from the 3d series in order to identify if periodic properties emerge. We were motivated by the identification of closed electronic shells with electron counts of 96, 100 and 114 in similar clusters from the 4d and 5d transition metal series. Further motivation was the finding of a dual-shell closing in the Fe₆S₈(CN)₆^5- cluster. This cluster is stabilized with a large spin magnetic moment due to the …

Beyond The Phonon Gas Model (Pgm): Unraveling The Unique Mechanistic Processes Dictating Thermal Transport In Highly Anharmonic And Disordered Materials, Sandip Thakur

Open Access Dissertations

Thermal transport in nonmetallic solids has traditionally been described by the phonon gas model (PGM), in which heat is carried by weakly interacting phonon quasiparticles in an ordered crystalline lattice. However, this model breaks down in materials characterized by strong anharmonicity, dynamic disorder, or structural complexity, features prevalent in many next-generation materials used in energy conversion, optoelectronics, and thermal management. This dissertation investigates thermal transport in such complex materials, including metal halide perovskites (MHPs), covalent organic frameworks (COFs), metal organic frameworks (MOFs), and 2D-3D heterostructures, through large-scale molecular dynamics (MD) simulations and frequency-resolved spectral analyses.

In MHPs, the work reveals …

Novel Phenomena In Chiral And Disordered Crystals, Zachary Louis Romestan

Graduate Theses, Dissertations, and Problem Reports (ETD)

The concept of symmetry is central to our understanding of the physical world. Core symmetries—comprising time reversal, charge conjugation, spatial inversion, and rotation—are integral in maintaining essential conservation laws. They also play a critical role in the manifestation of new quantum phases that arise when these symmetries are disrupted. At the heart of contemporary research in condensed matter physics is the exploration of how basic symmetries interact with material imperfections. This examination delves deeply into the ways that inherent symmetrical properties and structural anomalies within materials influence each other, providing crucial insights into the field. This dissertation presents an investigation …

Synthesis And Characterization Of Doped Rare-Earth Zinc Alloys, Partha Das

Graduate Theses/Dissertations

Rare-Earth-Zinc (RE-Zn) alloys doped with manganese represent a promising class of materials with diverse applications in magnetic, electronic, and thermoelectric devices. These alloys hold significant potential owing to the unique combination of rare-earth elements' properties with the versatility of zinc, augmented by manganese doping. In this study, I present the successful synthesis of ErMn_0.2Zn_11.8 alloys, achieved through self-flux method. The synthesized crystals were characterized using electron dispersive spectroscopy (EDS) and single crystal X-ray diffraction (XRD). Additionally, magnetic measurements were performed to investigate the magnetic properties. Future plans include DFT calculations and comparison study between Rare-Earth-Zinc alloys with …

Effects Of A-Site Cation Structure And B-Site Metal On Optical And Electronic Properties Of 2d Ruddlesden-Popper Phase Tin-Based Hybrid Perovskites, Henry Pruett

Theses and Dissertations--Chemistry

Organic metal halide perovskites (HPs) are attractive materials for a variety of electronic applications due to their low cost, tunable band gaps, excellent charge transport properties, and high photoluminescence efficiency. As such, HPs are being investigated for use in solar cells, photodetectors, X-ray detectors, light emitting diodes, field effect transistors, lasers, resistive random-access memory, etc. Currently the most popular metal used in HPs is lead, but the use of lead comes with the potential for heavy metal exposure. Tin-based perovskites offer a less hazardous alternative, but their optoelectronic properties lag behind those of lead and less work has been done …

Frustrated Quantum Magnetism: The Interplay Of Isotropic And Anisotropic Interactions With Application To Α-Rucl3, Evan M. Wilson

UNF Graduate Theses and Dissertations

We investigate how anisotropic spin interactions, including Dzyaloshinskii–Moriya and Kitaev terms, manifest across quantum spin systems ranging from a single S = 1/2 dimer to molecular spin clusters and layered magnetic materials. Beginning with an exact analysis of the spin dimer, we demonstrate how singlet–triplet mixing induced by Dzyaloshinskii–Moriya interaction directly influences both thermodynamic observables and inelastic neutron scattering spectra. These microscopic fingerprints are then extended to trimer, tetramer, and tetrahedron geometries, where field-induced phase transitions and heat capacity anomalies reveal the interplay between isotropic Heisenberg and anisotropic Kitaev exchanges. In the frustrated zigzag honeycomb lattice, we show that a …

Effect Of Temperature And Rhenium Content In Precipitates On Dispersion Hardening Of Tungsten, Yulia R. Sharapova, Arseny M. Kazakov, Elena A. Korznikova, Alexandr Zinovev, Dmitry Terentyev, Sergey V. Dmitriev

Karbala International Journal of Modern Science

Tungsten (W) is being developed as a plasma-facing material for fusion reactors, where it is subjected to MeV neutron irradiation, low-energy helium isotope particles, and high temperatures. These conditions lead to the formation of point defects, dislocation loops, voids, and transmutation into rhenium (Re) and osmium (Os), which form precipitates that significantly impact dislocation motion and increase hardness. This study uses molecular dynamics modeling to examine the interaction between an edge dislocation and Re-rich particles of various stoichiometries, specifically coherent bcc-phase particles and noncoherent σ-phase precipitates. Results show that shear stress increases by approximately 20-40% with larger particle size (3-5 …

Ge/Sige Quantum Wells: Material For The Post-Moore Era, Troy Alexander Hutchins-Delgado

Optical Science and Engineering ETDs

This dissertation demonstrates high-quality germanium quantum wells on a 200 mm silicon wafer platform, enabling novel device possibilities. Partnering with a commercial silicon-germanium epitaxy supplier, we obtained shallow, undoped germanium quantum wells with high-crystalline quality, confirmed through x-ray diffraction, secondary ion mass spectroscopy, high-resolution scanning transmission electron microscopy, and energy dispersive x-ray spectroscopy. Hall bar devices fabricated on single quantum wells revealed that surface preparation can tune transport properties while maintaining peak mobilities around 10⁵ cm²V⁻¹s⁻¹. Manganese-germanide spintronic contacts were integrated via solid-state reaction, with contact quality assessed through Schottky diodes, transfer length …

Characterizing 2d Materials Using Positron Impact Induced Electron Spectroscopy And Development Of A Novel Thin Film Zno Based Piezo-Photonic Detector For Cryogenic And Mems Applications, Pratyanik Sau

2024 Fall Honors Capstone Projects - Archive

Surface analytical techniques are essential for engineering nano-detectors allowing characterization of their chemical composition, electromechanical properties, and physical structure. In the first chapter, the positron impact-induced secondary electron (PIISE) energy spectra and yield from single-layer graphene (SLG) and multi-layer graphene (MLG) grown on a polycrystalline Cu substrate have been presented. In the second chapter, an extensive catalog of Positron Induced Auger Spectra is presented to aid in the analysis of elemental composition of various materials. Additionally, in the third chapter, a novel detection scheme utilizing the piezo-pyroelectric properties of Zinc Oxide (ZnO) thin films have been demonstrated for its application …

Charge Transport In Two Dimensional Systems With Arbitrary Rashba And Dresselhaus Interactions, Abhishek Khanal

All Dissertations

In this thesis we discuss two different transport phenomena that occur in a two-dimensional electron system endowed with linear Rashba and Dresselhaus spin-orbit interactions of arbitrary values. First, in a semiclassical formalism we calculate the non-linear charge currents that appear in response to the simultaneous application of in-plane electric and magnetic fields. Working in a rotated system of coordinates that introduces $\alpha \pm \beta$ as effective couplings on perpendicular directions, we formulate a transport theory that relies on a second order distribution function derived in a local energy approximation and on chiral dependent relaxation times to show that the currents …

Single-Shot Mev-Resolution Hard X-Ray Spectrograph For Cavity-Based X-Ray Free Electron Laser, Keshab Kauchha

Dissertations

The Cavity-Based X-ray Free Electron Laser (CBXFEL) is a possible future direction in the development of fully coherent hard X-ray sources of high spectral brilliance, a narrow spectral bandwidth of ≃ 1 − 100 meV, and a high repetition rate of ≃ 1 MHz. A diagnostic tool is required to measure CBXFEL spectra with a meV resolution on a shot-to-shot basis.

The CBXFEL hard X-ray spectrograph is designed to image 9.831 keV X-rays in a ≃ 200 meV spectral window and with a spectral resolution of a few meV using an LCLS XFEL (Linac Coherent Light Source X-ray Free Electron …