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Author:

Hall, Nicole

Title:

Discovering Photocatalytic Materials From First Principles

Graduate Program:

Materials Science and Engineering (PHD)

Keywords:

Density-functional theory
Photocatalyst
DFT+U

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Committee Members:

John Mauro, Program Head/Chair
Raymond Schaak, Outside Unit & Field Member
Wesley Reinhart, Major Field Member
Susan Sinnott, Major Field Member
Ismaila Dabo, Chair & Dissertation Advisor

Author:

Gesualdi, Jarrod

Title:

Chemistry-structure-property relations in the AlCrFeMnNi alloy system

Graduate Program:

Materials Science and Engineering (PHD)

Keywords:

electrochemistry
metallurgy
corrosion
microstructure
thermodynamics

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Committee Members:

Amanda Johnsen, Outside Unit & Field Member
Hojong Kim, Chair & Dissertation Advisor
Allison Beese, Major Field Member
Susan Sinnott, Major Field Member
John Mauro, Program Head/Chair

Author:

Slapikas, Robert

Title:

Atomistic Simulations: Atomistic level investigation of the dissolution, precipitation, and surface diffusion dynamics at the aqueous metal interface for renewable energy applications and the oxidation of silicon carbide for aero-propulsion

Graduate Program:

Materials Science and Engineering (PHD)

Keywords:

Molecular Dnamics
Pt
Platinum nanoparticles
ultra-high temperature ceramics

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Committee Members:

Kristen Fichthorn, Outside Unit & Field Member
Ismaila Dabo, Major Field Member
Wesley Reinhart, Major Field Member
Susan Sinnott, Co-Chair & Dissertation Advisor
Douglas Wolfe, Co-Chair & Dissertation Advisor
Zuleima T Karpyn, Special Signatory

Author:

Campbell, Ian

Title:

Experimental and Computational Investigations of Platinum and Gallium Nitride Vapor Deposition Processes

Graduate Program:

Materials Science and Engineering (PHD)

Keywords:

atomic layer deposition
chemical vapor deposition
platinum
gallium nitride
density functional theory
mesoporous nitrogen doped carbon
nuclei
particle
thin film

File:

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Committee Members:

Suzanne Mohney, Chair & Dissertation Advisor
Susan Sinnott, Major Field Member
Feifei Shi, Outside Unit & Field Member
Joan Redwing, Major Field Member
John Mauro, Program Head/Chair

Author:

Agyapong, Ama Duffie

Title:

A Study of Metal Interactions with Transition Metal Dichalcogenides

Graduate Program:

Materials Science and Engineering (PHD)

Keywords:

TMDS
physical vapor deposition
2D materials
MoS2
WS2
contact metals
Raman spectroscopy
intermetallics
alloys
interfacial reactions
monolayer

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Committee Members:

John Mauro, Program Head/Chair
Robert Rioux, Outside Field Member
Suzanne Mohney, Chair & Dissertation Advisor
Susan Sinnott, Major Field Member
Saptarshi Das, Outside Unit & Field Member

Author:

Castro Baldivieso, Stephanie

Title:

ELECTROCHEMICAL RECOVERY OF RARE EARTH ELEMENTS IN MOLTEN SALT SYSTEMS: DESIGN AND DEVELOPMENT OF ELECTRODE MATERIALS

Graduate Program:

Materials Science and Engineering (PHD)

Keywords:

electrochemical recovery
electromotive force measurements
Gd-Bi alloys
oxide reduction
recovery efficiency of rare earth elements
Gd-Bi kinetic properties

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Committee Members:

John Mauro, Program Head/Chair
Feifei Shi, Outside Unit & Field Member
Zi-Kui Liu, Major Field Member
Hojong Kim, Chair & Dissertation Advisor
Susan Sinnott, Major Field Member

Author:

Wang, Yuxiang

Title:

COMPUTATIONAL INVESTIGATION OF THE INTERACTION OF MULTI-FUNCTIONALIZED POROUS AROMATIC FRAMEWORKS WITH PURE SO2 AND GAS MIXTURES

Graduate Program:

Materials Science and Engineering (PHD)

Keywords:

Functionalized Porous Aromatic Frameworks
Acid Gas Adsorption
Grand Canonical Monte Carlo Simmulations

File:

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Committee Members:

Susan Sinnott, Chair & Dissertation Advisor
Ismaila Dabo, Major Field Member
Lauren Zarzar, Outside Field Member
Adri van Duin, Outside Unit & Field Member
John Mauro, Program Head/Chair