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Full-Text Articles in Physics
Structural, Vibrational And Transport Properties Of Novel Complex Systems., Bhupendra Man Shing Karki
Structural, Vibrational And Transport Properties Of Novel Complex Systems., Bhupendra Man Shing Karki
Electronic Theses and Dissertations
Electron correlation effects in quantum materials are very strong. It is critical to investigate the structure of quantum materials to better understand and manipulate their physical properties. Quantum effects are prominent at the atomic microscopic length scale, which can not be examined by average long range structural measurements using traditional diffraction methods. Instead, pair distribution function (PDF) analysis, a local structure probe, can effectively unveil the mystery of local structure, which is more sensitive to local behavior than bulk average features. The first section of my dissertation will concentrate on the local structural study of the Iron oxy-chalcogenides, {\cSSe}, which …
A Structural Study Of Correlated Materials: Incipient Mott Insulators And Low-Dimensional Systesm., Alaa Alfailakawi
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 …
Computational Prediction, Characterization, And Methodology Development For Two-Dimensional Nanostructures: Phosphorene And Phosphide Binary Compounds., Congyan Zhang
Electronic Theses and Dissertations
In this thesis, a comprehensive computational simulation was carried out for predicting, characterizing, and applications of two-dimensional (2D) materials. The newly discovered GaP and InP layers were selected as an example to demonstrate how to explore new 2D materials using computational simulations. The performance of phosphorene as the anode material of Lithium-ion battery was discussed as the example of the application of 2D material. Furthermore, the semi-empirical Hamiltonian for phosphorous and lithium elements have been developed for our future work on the application of phosphorus and lithium-based systems. The novel 2D materials of GaP and InP binary compounds were found …