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Author:

Saengdeejing, Arkapol

Title:

A Computational Study of Superconducting Materials: A Case Study in Carbon-Doped MgB₂

Graduate Program:

Materials Science and Engineering

Keywords:

thermodynamic modeling
density functional theory
superconductor
CALPHAD
MgB₂

File:

Download Saengdeejing-Dissertation.pdf

Committee Members:

Zi Kui Liu, Dissertation Advisor/Co-Advisor
Zi Kui Liu, Committee Chair/Co-Chair
Joan Marie Redwing, Committee Member
Vincent Henry Crespi, Committee Member
Qi Li, Committee Member

Author:

Zhou, Bicheng

Title:

A computational study of the effects of alloying elements on the thermodynamic and diffusion properties of Mg alloys

Graduate Program:

Materials Science and Engineering

Keywords:

Mg alloys
thermodynamics
diffusion
thermodynamic modeling
CALPHAD
first-principles calculations
DFT
kinetics

File:

Download Bi-Cheng_Zhou-Dissertation.pdf

Committee Members:

Zi Kui Liu, Dissertation Advisor/Co-Advisor
Zi Kui Liu, Committee Chair/Co-Chair
Long Qing Chen, Committee Member
Jorge Osvaldo Sofo, Committee Member
Tarasankar Debroy, Committee Member

Author:

Saal, James Edward

Title:

Thermodynamic Modeling of Phase Transformations and Defects: from Cobalt to Doped Cobaltate Perovskites

Graduate Program:

Materials Science and Engineering

Keywords:

ceramics
thermodynamic modeling
defect chemistry
perovskites
CALPHAD
density functional theory

File:

Download Saal-Dissertation.pdf

Committee Members:

Zi-Kui Liu, Committee Chair/Co-Chair
Long-Qing Chen, Committee Member
Clive Randall, Committee Member
Jorge Sofo, Committee Member
Michael Carolan, Committee Member