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Author:

Burgess, Maximiliano

Title:

The Acetophenone Radical Anion: A Computational Investigation of Preferred Geometries

Graduate Program:

Materials Science and Engineering

Keywords:

Acetophenone
Crosslinked polyethylene (XLPE)
DFT
Molecular dynamics
Reactive force fields
High-voltage cables

File:

Download BurgessM_Thesis_Final_Submission.pdf

Committee Members:

Ismaila Dabo, Thesis Advisor/Co-Advisor
Adrianus C Van Duin, Thesis Advisor/Co-Advisor
Michael T Lanagan, Committee Member
John C Mauro, Program Head/Chair

Author:

Maghirang, Kayla

Title:

Palladium Zinc Based Intermetallic Catalysts to Probe Hydrogenation Active Site Ensembles

Graduate Program:

Chemical Engineering

Keywords:

Intermetallic compounds
Intermetallic catalysis
Catalysis
Hydrogenation
Palladium Zinc
Pd-Zn
Gamma brass
DFT

File:

Download KaylaBonifacioMaghirang_MSThesis.pdf

Committee Members:

Robert Rioux, Thesis Advisor/Co-Advisor
Michael John Janik, Thesis Advisor/Co-Advisor
Hilal Ezgi Toraman, Committee Member
Phillip E Savage, Program Head/Chair

Author:

Wang, Linxi

Title:

KINETIC STUDY OF CO2 SORPTION BY SOLID AMINE MATERIALS AND CATALYTIC OXIDATION OF CARBON MONOXIDE BY CERIA-SUPPORTED SINGLE-ATOM NOBLE-METAL CATALYSTS

Graduate Program:

Chemical Engineering

Keywords:

CO2 sorption
solid amine sorbents
heat of sorption
single-atom catalysis
kinetics
DFT

File:

Download Linxi_Wang_-_Ph.D_thesis_-_Fall_2020.pdf

Committee Members:

Robert Rioux, Dissertation Advisor/Co-Advisor
Robert Rioux, Committee Chair/Co-Chair
Phillip E Savage, Committee Member
Michael John Janik, Committee Member
Hilal Ezgi Toraman, Outside Member
Phillip E Savage, Program Head/Chair