Physics Commons^™

First-Principles Studies Of Anion Engineering In Functional Ceramics, Steven Timothy Hartman

McKelvey School of Engineering Theses & Dissertations

Ceramic materials display a wide variety of valuable properties, such as ferroelectricity, superconductivity, and magnetic ordering, due to the partially covalent bonds which connect the cations and anions. While many breakthroughs have been made by mixing multiple cations on a sublattice, the equivalent mixed-anion ceramics have not received nearly as much attention, despite the key role the anion plays in the materials’ properties. There is great potential for functional ceramics design using anion engineering, which aims to tune the materials properties by adding and removing different types of anions in existing classes of ceramic materials. In this dissertation, I present …

Growth, Characterization, And Function Of Ferroelectric, Ferromagnetic Thin Films And Their Heterostructures, Mahesh Hordagoda

USF Tampa Graduate Theses and Dissertations

With recent trends in miniaturization in the electronics sector, ferroelectrics have gained popularity due to their applications in non-volatile RAM. Taking one step further researchers are now exploring multiferroic devices that overcome the drawbacks of ferroelectric (FE) and ferromagnetic (FM) RAM’s while retaining the advantages of both. The work presented in this dissertation focuses on the growth of FE and FM thin film structures. The primary goals of this work include, (1) optimization of the parameters in the pulsed laser deposition (PLD) of FE and FM films and their heterostructures, (2) development of a structure-property relation that leads to enhancements …

Static And Dynamical Properties Of Ferroelectrics And Related Material In Bulk And Nanostructure Forms, Zhigang Gui

Graduate Theses and Dissertations

Ferroelectrics (FE) and multiferroics (MFE) have attracted a lot of attentions due to their rich and novel properties. Studies towards FE and MFE are of both fundamental and technological importance. We use a first-principles-based effective Hamiltonian method, conventional ab-initio packages and linear-scale three-dimension fragment method to investigate several important issues about FE and MFE. Tuning the properties of FE and MFE films are essential for miniaturized device applications, which can be realized through epitaxial strain and growth direction. In this dissertation, we use the effective Hamiltonian method to study (i) BaTiO 3 films grown along the (110) pseudocubic direction on …

Modeling And Simulation Of Microstructures, Mechanisms, And Diffraction Effects In Energy Materials: Ferroelectrics And Lithium Ion Battery Cathode Materials, Jie Zhou

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

Ferroelectric materials, as a large family exploited for the application of sensors, transducers and random access memories, open up a remarkable ground both for fundamental science and industry. Dielectric and piezoelectric properties are of the most interest in ferroelectric materials, which motivate research to enhance ferroelectric properties based on various application purposes. Among the multitudinous candidates in ferroelectric family, pseudo binary solid solutions with ABO₃ lattice structure attract special attention in virtue of their large strain response when applying external loading. Furthermore, existence of morphological phase boundary (MPB) on their phase diagrams shed light on tuning material compositions to …

Acousto-Electric Impedance Of Ferroelectric Phononic Superlattice, Ola Hassan Nusierat

Electronic Theses and Dissertations

The Acousto-Electric Impedance z of a Ferroelectric Phononic Superlattice (fps) is investigated. The analytical derivation of z and its phase reveal that both are functions of physical parameters such as the electromechanical coupling coefficient, the mechanical quality factor, the domain length and the phase velocity of the plate acoustic waves (paw). Mathematical code is produced that allows for modeling z in a two dimensional fps. It is observed that z depends on the number of domains in the fps structure. Fewer domains in the structure might minimize z or make it approach zero at certain conditions. A series of experiments …

The Structure And Ferroelectric Properties Of Iron-Doped Lead Titanate, Michael Bartlein

Theses and Dissertations

Multiferroics are a class of poorly understood, but technologically important materials. Lead(II) titanate (PbTiO$_3$) is a known perovskite ferroelectric. By doping PbTiO$_3$ with Fe$^{3+}$ at the Ti site, we produce the multiferroic PbTi$_{1-x}$Fe$_x$O$_3$ (PTFO). Using selected area electron diffraction on a transmission electron microscope, the structure of PTFO is investigated. Of particular interest is identifying the cubic-to-tetragonal transition at the Curie temperature. As the concentration of Fe increases, the crystal becomes more cubic and experiences a lower transition temperature. I also establish a procedure for preparing bulk PTFO samples for ferroelectric testing and present preliminary results establishing ferroelectricity in these …

Multiscale Study Of Batio3 Nanostructures And Nanocomposites, Lydie Louis Louis

Graduate Theses and Dissertations

Advancements in integrated nanoelectronics will continue to require the use of unique materials or systems of materials with diverse functionalities in increasingly confined spaces.

Hence, research on finite-dimensional systems strive to unearth and expand the knowledge of fundamental physical properties in certain key materials which exhibit numerous concurrent and exploitable functions.

Correspondingly, ferroelectric nanostructures, which particularly display a plethora of complex phenomena, prevalent in countless fields of research, are noteworthy candidates. Presently, however, the assimilation of zero-(0D) and one-dimensional (1D) ferroelectric into micro- or nano-electronics has been lagging, in part due to a lack of applied and fundamental studies but …

Pulse Sharpening Effects Of Thin Film Ferroelectric Transmission Lines, Robert J. Sleezer

Graduate Theses and Dissertations

Advances in material science have resulted in the development of electrically nonlinear high dielectric thin film ferroelectrics, which have led to new opportunities for the creation of novel devices. This dissertation investigated one such device: a low voltage nonlinear transmission line (NLTL). A finite element simulation of ferroelectric transmission lines showed that NLTLs are capable of creating shockwaves. Additionally, if the losses are kept sufficiently low, it was shown that voltage gain should be possible. Furthermore, a method of accounting for material dispersion was developed. Results from simulations including material dispersion showed that temporal solitons might be possible from a …

Dynamical Properties Of Ferroelectric Perovskites (Ba,Sr)Tio3 And Pb(Zr,Ti)O3 Systems From First Principles, Jeevaka Weerasinghe

Graduate Theses and Dissertations

A first-principles-based effective Hamiltonian scheme which incorporates coupling between ferroelectric (FE) and antiferrodistortive (AFD) motions is applied to Pb(Zr,Ti)O₃ alloys. It validates the existence of two modes of E symmetry (rather than the single E(1TO) soft mode) in the 50-75 cm^-1 range for temperatures smaller than 200 K and for compositions falling within the Rhombohedral R3c phase. Coupling between long-range-ordered FE and AFD motions is shown to be the cause of the additional mode and more insight into its nature is provided. This scheme is further used to reveal a field-induced anticrossing involving FE and AFD degrees of …