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Other Materials Science and Engineering

Doctoral Dissertations

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Graphene

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Full-Text Articles in Engineering

Electrical Characterization Of Graphene And Nanodiamond Nanostructures, A Z M Nowzesh Hasan Nov 2018

Electrical Characterization Of Graphene And Nanodiamond Nanostructures, A Z M Nowzesh Hasan

Doctoral Dissertations

The electrical characterization on two-dimensional carbon-based graphene and nanodiamond materials was performed to improve charge transport properties for the label-free electrical biosensors. The charge transport in solution-gated graphene devices is affected by the impurities and disorders of the underlying dielectric interface and its interaction with the electrolytes. Advancement in field-effect ion sensing by introducing a dielectric isomorph, hexagonal boron nitride between graphene and silicon dioxide of a solution-gated graphene field-effect transistor was investigated. Increased transconductance due to increased charge carrier mobility is accompanied with larger ionic sensitivity. These findings define a standard to construct future graphene devices for biosensing and …


Computational Studies Of Structure–Function Relationships Of Supported And Unsupported Metal Nanoclusters, Hongbo Shi Nov 2017

Computational Studies Of Structure–Function Relationships Of Supported And Unsupported Metal Nanoclusters, Hongbo Shi

Doctoral Dissertations

Fuel cells have been demonstrated to be promising power generation devices to address the current global energy and environmental challenges. One of the many barriers to commercialization is the cost of precious catalysts needed to achieve sufficient power output. Platinum-based materials play an important role as electrocatalysts in energy conversion technologies. In order to improve catalytic efficiency and facilitate rational design and development of new catalysts, structure–function relationships that underpin catalytic activity must be understood at a fundamental level. First, we present a systematic analysis of CO adsorption on Pt nanoclusters in the 0.2-1.5 nm size range with the aim …


Surface Energy In Bond-Counting Models On Bravais And Non-Bravais Lattices, Tim Ryan Krumwiede May 2017

Surface Energy In Bond-Counting Models On Bravais And Non-Bravais Lattices, Tim Ryan Krumwiede

Doctoral Dissertations

Continuum models in computational material science require the choice of a surface energy function, based on properties of the material of interest. This work shows how to use atomistic bond-counting models and crystal geometry to inform this choice. We will examine some of the difficulties that arise in the comparison between these models due to differing types of truncation. New crystal geometry methods are required when considering materials with non-Bravais lattice structure, resulting in a multi-valued surface energy. These methods will then be presented in the context of the two-dimensional material graphene in a way that correctly predicts its equilibrium …