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New Features In Landyne 5 - A Software Suite For Materials Characterization And Crystallography By Transmission Electron Microscopy, Xing-Zhong Li 2023 University of Nebraska-Lincoln

New Features In Landyne 5 - A Software Suite For Materials Characterization And Crystallography By Transmission Electron Microscopy, Xing-Zhong Li

Nebraska Center for Materials and Nanoscience: Faculty Publications

Landyne software suite (version 5) includes fifteen standalone computer programs for materials characterization and crystallography by transmission electron microscopy [1]. A launcher interface is provided for users to access all components conveniently. The purpose of this software suite is twofold: i) as research tools to analyze experimental results, ii) as teaching tools to explore the varieties of electron diffraction methods and crystallographic image processing principles.

The Landyne suite previously included: PTable, an interactive periodic table of elements; SVAT, a structural visual and analytical tool; SAED and PCED, simulation and analysis of electron diffraction (spot and ring) patterns; QSAED and QPCED, …


Structural, Electronic, And Magnetic Properties Of Cofevge-Based Compounds: Experiment And Theory, Parashu Kharel, Zachary Lehmann, Gavin Baker, Lukas Stuelke, Shah R. Valloppilly, Paul M. Shand, Pavel V. Lukashev 2023 South Dakota State University

Structural, Electronic, And Magnetic Properties Of Cofevge-Based Compounds: Experiment And Theory, Parashu Kharel, Zachary Lehmann, Gavin Baker, Lukas Stuelke, Shah R. Valloppilly, Paul M. Shand, Pavel V. Lukashev

Nebraska Center for Materials and Nanoscience: Faculty Publications

We have carried out a combined theoretical and experimental investigation of both stoichiometric and nonstoichiometric CoFeVGe alloys. In particular, we have investigated CoFeVGe, Co1.25Fe0.75VGe, Co0.75Fe1.25VGe, and CoFe0.75VGe bulk alloys. Our first principles calculations suggest that all four alloys show ferromagnetic order, where CoFeVGe, Co1.25Fe0.75VGe, and Co0.75Fe1.25VGe are highly spin polarized with spin polarization values of over 80%. However, the spin polarization value of CoFe0.75VGe is only about 60%. We have synthesized all four samples using arc melting and high-vacuum annealing …


Tem Studies Of A New Modulated Structure In Mn2Rusn Alloy And Intermetallic Phases In Fe3+XCo3–XTi2 (X = 0, 1, 2, 3) Alloys, Xing-Zhong Li, Shah R. Valloppilly 2023 University of Nebraska-Lincoln

Tem Studies Of A New Modulated Structure In Mn2Rusn Alloy And Intermetallic Phases In Fe3+XCo3–XTi2 (X = 0, 1, 2, 3) Alloys, Xing-Zhong Li, Shah R. Valloppilly

Nebraska Center for Materials and Nanoscience: Faculty Publications

Heusler compounds are a remarkable class of intermetallic materials with wide-ranging and tunable properties. The Mn2RuSn Heusler compound was reported as an L21B-type cubic phase, a = 0.62195 nm, distinguishing from the original L21 structure (or L21A-type). The L21B-type structure is a disordered variant of the inverse Heusler structure, XA-type (Prototype-CuHg2Ti, space group No. 216, F4–3m).

In our recent work [1], we observed a new modulated structure derived from the XA-type structure and its orthogonal domains in the Mn2RuSn Heusler alloy. The structural characterization was carried out …


Using Superatomic Clusters And Charge Transfer Ligands To Control Electronic Characteristics Of Phosphorene Nanoribbons And Phosphorene Monolayer, Ryan Lambert 2023 Virginia Commonwealth University

Using Superatomic Clusters And Charge Transfer Ligands To Control Electronic Characteristics Of Phosphorene Nanoribbons And Phosphorene Monolayer, Ryan Lambert

Theses and Dissertations

Phosphorene is a two-dimensional electron poor p-type semiconductor with high carrier mobility and great promise for applications in electronics and optoelectronics. As the main theme in this dissertation, the following work represents different investigations of various electronic properties associated with phosphorene. Most notable are the findings on charge transfer doping with metal-chalcogenide superatoms which displays novel control of the two most important properties of a semiconductor – the band gap energy and the nature of carriers. By tuning the width of the gap and p-/n-type character of conduction, we gain control over a material’s capacity to play a certain role …


Nonequilibrium Dynamics Of Correlated Disordered Systems Under Interaction Quenches, Eric A. Dohner 2023 University at Albany, State University of New York

Nonequilibrium Dynamics Of Correlated Disordered Systems Under Interaction Quenches, Eric A. Dohner

Legacy Theses & Dissertations (2009 - 2024)

Correlated, disordered lattice fermion systems out of equilibrium have been understudied, at least in part for lack of tools to study them. The development of a new method, the NE-DMFT+CPA, is explicated, for investigating the properties of these systems. This method combines DMFT and the CPA using the Kadanoff-Baym-Keldysh contour-time formalism to study the dynamics of interacting disordered systems out of equilibrium. The method is detailed, then applied to the case of the Anderson-Hubbard model: first to replicate well-known equilibrium results, then to study the case of the model under the effect of an interaction quench. Here the effect of …


Surface Reconstruction In Iron Garnets, Sushree Dash 2023 Michigan Technological University

Surface Reconstruction In Iron Garnets, Sushree Dash

Dissertations, Master's Theses and Master's Reports

This dissertation presents the results of a study investigating the physical mechanisms underlying an unexpectedly large increase in magneto-optic efficiency observed in iron garnet. Such materials are technologically important for telecommunications due to their nonreciprocal optical action. In the past, our group had found evidence of an enhanced Faraday rotation in bismuth-substituted iron garnet films less than 50 nm thick. Subsequent investigation revealed that this enhancement could be traced to surface effects. This is significant because understanding these phenomena could be used to formulate engineering solutions for device miniaturization. In this dissertation, we present the result of a research project …


Development Of Sustainable Radiation-Shielding Blend Using Natural Rubber/Nbr, And Bismuth Filler, Elsayed Salama, Ola Aziz, Doaa E. El-Nashar, Assem Bakry 2023 The British University in Egypt

Development Of Sustainable Radiation-Shielding Blend Using Natural Rubber/Nbr, And Bismuth Filler, Elsayed Salama, Ola Aziz, Doaa E. El-Nashar, Assem Bakry

Basic Science Engineering

This research entailed the production of composite materials through the combination of natural rubber and acrylonitrile butadiene rubber, along with nano-silica-loaded bismuth (III) oxide, in varying concentrations ranging from 0 to 45 parts per hundred parts of rubber (phr). The gamma attenuation properties of the composites at different concentrations of Bi2O3 were measured. Additionally, the mechanical properties of the resulting composites, including hardness, tensile strength, and elongation, were tested. The composites with a concentration of 20 phr exhibited the highest tensile strength and elongation at break, followed by a subsequent decrease as the concentration of Bi2O3 increased. The gamma mass-attenuation …


Structural And Magnetic Study Of Epitaxial Ni/Nio Thin Films On Various Single Crystalline Substrates Using Pulsed Laser Deposition, Md Shaihan Bin Iqbal 2023 Missouri State University

Structural And Magnetic Study Of Epitaxial Ni/Nio Thin Films On Various Single Crystalline Substrates Using Pulsed Laser Deposition, Md Shaihan Bin Iqbal

Graduate Theses/Dissertations

In recent years, magnetic thin films have gained significant attention in the field of spintronics, which is a branch of electronics that utilizes the spin of electrons in addition to their charge. The applications in the spintronic sector rely on the magnetic properties of the thin films. To address this, Ni (FM)/NiO (AFM) thin films on single crystalline sapphire and lithium niobate substrates have been investigated using pulsed laser deposition (PLD) technique prior to hydrogen-reduction annealing to explore new functionalities. The manufactured films were extensively analyzed by state-of-the-art characterization techniques. X-ray diffraction (XRD) and X-ray reflectometry (XRR) show the structural …


Synthesis And Characterization Of Cage-Structured Compounds As Promising Thermoelectric Materials, NUSRAT YASMIN 2023 Missouri State University

Synthesis And Characterization Of Cage-Structured Compounds As Promising Thermoelectric Materials, Nusrat Yasmin

Graduate Theses/Dissertations

The development of new thermoelectric materials is of great interest due to their potential to convert waste heat into useful electricity. The primary problem is that the physical factors that are utilized to assess thermoelectric performance conflict with one another. One way to improve their performance is to hinder the lattice from conducting heat through its vibrations while maintaining the heat conduction via the electrons. This can be done by creating cage structures that allow heavy atoms to jiggle. In this study, we report the synthesis of a group of such compounds, using the self-flux method. They all belong to …


Study Of Electronic And Magnetic Properties Of Bilayer Graphene Nanoflakes And Bimetallic Chalcogenides Using First-Principles Density Functional Theory And Machine Learning, Dharmendra Pant 2023 Michigan Technological University

Study Of Electronic And Magnetic Properties Of Bilayer Graphene Nanoflakes And Bimetallic Chalcogenides Using First-Principles Density Functional Theory And Machine Learning, Dharmendra Pant

Dissertations, Master's Theses and Master's Reports

Graphene, a one-atom-thick material, has been a wonder material since its discovery because of its superlative electronic, mechanical, and optical properties. When a layer of graphene is rotated over another layer, it exhibits many intriguing behaviors, ranging from superconductivity to the anomalous Hall effect to ferromagnetism at a magic angle of 1°, and hence the twisted bilayer graphene has been the subject of intense research in recent years. The surge in interest in this moiré structure can be attributed to the emergence of electronic flat minibands near the magic angle. Here, we studied the electronic and magnetic properties of twisted …


Growth And Characterization Of Sm3hfbi5, Patrick Lambdin 2023 Missouri State University

Growth And Characterization Of Sm3hfbi5, Patrick Lambdin

Graduate Theses/Dissertations

First found experimentally in 2015, topological Weyl materials are desirable compounds that have garnered much interest due to their ability to conduct electricity via their surface states even though the bulk material is a semimetal. Such a candidate, Sm3HfBi5, was discovered with a flux crystal growth method, following an extensive amount of reaction syntheses. This thesis reports on the discovery, growth, structural characterization via x-ray diffraction, and magnetization measurements on Sm3HfBi5.


Investigating The Structural Properties Of Licoo2 Through Annealing In A Reducing Atmosphere And Characterization Using Raman Spectroscopy And X-Ray Diffraction, Mathew A. Boeser 2023 Missouri State University

Investigating The Structural Properties Of Licoo2 Through Annealing In A Reducing Atmosphere And Characterization Using Raman Spectroscopy And X-Ray Diffraction, Mathew A. Boeser

Graduate Theses/Dissertations

The electrochemical performance of lithium cobalt oxide (LiCoO2) cathode materials in lithium-ion batteries is strongly influenced by their structural and chemical characteristics. Annealing in a reducing atmosphere is able to modify the crystal structure of LiCoO2 by inducing oxygen vacancies, ideally enhancing its electrochemical performance. This master's thesis presents an investigation into the effects of low to mid-range annealing temperatures in a reducing atmosphere on bulk LiCoO2 powder, utilizing Raman spectroscopy and X-ray Diffraction (XRD).


Diffuse Scattering And 3d-∆Pdf Analyses: Order-Disorder Phase Transitions In (Sr1−Xcax)3rh4sn13 And Nano2, Puspa Upreti 2023 Northern Illinois University

Diffuse Scattering And 3d-∆Pdf Analyses: Order-Disorder Phase Transitions In (Sr1−Xcax)3rh4sn13 And Nano2, Puspa Upreti

Graduate Research Theses & Dissertations

Classification of structural phase transitions as being of the displacive or order-disorder types is usually done based on spectroscopic measurements performed above the transition. Transitions of the displacive type typically occur when soft phonon modes condense upon approaching the phase transition, whereas those of the order-disorder type are characterized by structures in which the atoms are located randomly above the phase transition at T* at the minima of a multiwell potential. In the ordered state, i.e., when T

We have performed single crystal x-ray scattering experiments and three-dimensional pair distribution functions (3D-∆PDF) analyses to understand the nature of phase transitions …


Mechanical And Morphological Characterization Of Energy Materials By Nanoindentation And Scanning Probe Microscopy, Jacob Hempel 2023 University of Kentucky

Mechanical And Morphological Characterization Of Energy Materials By Nanoindentation And Scanning Probe Microscopy, Jacob Hempel

Theses and Dissertations--Physics and Astronomy

The demand for robust materials in energy-based applications such as solid electrolytes for batteries, piezoelectric composites for mechanical energy harvesting, or new polymer materials for polymer binders in composite electrodes is on the rise. Mechanical degradation is the most common way for devices to fail in operation, thus a thorough understanding of a material’s mechanical properties is essential for application purposes.

In this dissertation, the mechanical characterization of novel boron cluster solid electrolytes is presented. Therein, we determine the elastic modulus and hardness of these compounds using instrumented indentation. A comparison is made against other solid electrolytes. It is found …


Aspects Of Topology In Moiré Graphene, Ahmed Khalifa 2023 University of Kentucky

Aspects Of Topology In Moiré Graphene, Ahmed Khalifa

Theses and Dissertations--Physics and Astronomy

Moiré materials, such as twisted bilayer graphene, have provided a rich platform for fundamental physics and potential technological applications. Superconductivity,
correlated insulators, and Chern insulators are examples of phenomena that have been found experimentally in moiré systems. The interplay of strong electron-electron interactions and topology lies at the heart of the mechanism driving these phenomena. In this work, we study the topological aspects of moiré graphene materials, such as the valley Chern and Chern insulating phases. To study the topological response of these phases, we construct models to describe the edge states which are the telltale signs of nontrivial topology. …


Investigations Of Epitaxial Heterostructures Of Layered Iridates With Resonant X-Ray Techniques, Sujan Shrestha 2023 University of Kentucky

Investigations Of Epitaxial Heterostructures Of Layered Iridates With Resonant X-Ray Techniques, Sujan Shrestha

Theses and Dissertations--Physics and Astronomy

In layered 5d transition metal oxides, like Sr2IrO4, strong spin-orbit interaction comparable to the relevant interactions such as electron correlation and crystal field splitting provides fertile ground for emergent non-trivial phenomena. Some of these phenomena include metal-insulator transition, high-temperature superconductivity, and spin-orbit Mott insulator. The ground state is governed by the spin-orbit-entangled pseudospins Jeff =1/2, which have a significant orbital contribution. Therefore, magnetic exchange interactions and anisotropies are highly susceptible to external stimuli such as strain and heterointerface. As a result, it has a significant impact on the magnetic properties of the system. However, …


Collective Relaxation Processes In Nonchiral Nematics, Neelam Yadav, Yuri Panarin, Wanhe Jiang, Georg H. Mehl, Jagdish Vij 2023 Trinity College Dublin, Ireland

Collective Relaxation Processes In Nonchiral Nematics, Neelam Yadav, Yuri Panarin, Wanhe Jiang, Georg H. Mehl, Jagdish Vij

Articles

Nematic–nematic transitions in a highly polar nematic compound are studied, in thick cells in which the molecules are aligned parallel to the substrates but perpendicular to the applied electric field, using dielectric spectroscopy in the frequency range 1 Hz to 10 MHz over a wide temperature range. The studied compound displays three nematic phases under cooling from the isotropic phase: ubiquitous nematic N; high polarizability NX; and ferroelectric nematic NF. Two collective processes were observed. The dielectric strength and relaxation frequency of one of the processes P2 showed a dependence on the thickness of the cell. The process P1 is …


Investigations Into The Electronic And Magnetic Properties Of (Crps4)N Layers, Alexandria R. Alcantara 2023 University of North Florida

Investigations Into The Electronic And Magnetic Properties Of (Crps4)N Layers, Alexandria R. Alcantara

UNF Graduate Theses and Dissertations

2D magnetic semiconductors have become of interest due to their magneto-optical effects in lower dimensionality. More specifically, CrPS4 has gained renewed attention due to its A-type AFM order and air stability prompting analysis and stability studies in its layered forms for use in scalable technology such as spintronic and optoelectronic devices. In this study, we benchmark our approach using the SCAN meta-GGA functional used without U-parameterization on bulk CrPS4 to demonstrate the accuracy of our methodology to use as tools to go beyond current CrPS4 theoretical studies. We examine the 2D electronic nature and optical spectrum for use in experimental …


Development Of High Kinetic Inductance Superconducting Nanowire Devices On High Permittivity Strontium Titanate Substrates, Jamie Timmons 2023 University of North Florida

Development Of High Kinetic Inductance Superconducting Nanowire Devices On High Permittivity Strontium Titanate Substrates, Jamie Timmons

UNF Graduate Theses and Dissertations

This thesis involves the fabrication and characterization of devices made from two different superconducting materials: yttrium barium copper oxide (YBCO), a high-TC complex oxide, and niobium nitride (NbN), a low-TC transition metal nitride. Both types of devices are fabricated on strontium titanate substrates, which provides a good lattice match to YBCO and also an extremely large permittivity at low temperature. We demonstrate that wet etching of YBCO thin films via bromine can be a viable microfrabriation technique for the material. Using approximately 35 nm thick epitaxially grown YBCO on an STO substrate, we were able to fabricate YBCO “microwires” with …


Exploring Mottness And Electronic Order In Strongly Correlated Vanadate Thin Films, Nathan Bairen 2023 University of North Florida

Exploring Mottness And Electronic Order In Strongly Correlated Vanadate Thin Films, Nathan Bairen

UNF Graduate Theses and Dissertations

Mott insulators provide a window into some of the most intensely investigated phenomena in physics. Recent discoveries—including the emergence of high-temperature superconductivity in doped Mott insulators not from the cuprate family of superconductors—have inspired investigation into systems with strong electron-electron interactions. One of these systems is La1-xSrxVO3, in which one end-member, LaVO3, is a Mott insulator and the other, SrVO3, is a strongly correlated metal.

Herein, we detail two studies regarding this system. In our oxidation study, we optimized the growth parameters for LaVO3, finding that the ultra-high vacuum technique …


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