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Open Access

Author:: Kim, DongEung
Title:: THERMODYNAMIC MODELING AND PREDICTION OF ELASTIC AND THERMAL EXPANSION PROPERTIES OF NI-BASE SUPERALLOYS: APPLICATION TO NI-AL-PT-CR-HF SYSTEM WITH γ AND γ' PHASES
Graduate Program:: Materials Science and Engineering
Keywords:: thermodynamic modeling
Ni-base superalloys
elastic property
thermal expansion property
File:: Download DongEung_Kim-Dissertation-Final.pdf
Committee Members:: Zi Kui Liu, Dissertation Advisor/Co-Advisor
Zi Kui Liu, Committee Chair/Co-Chair
Long Qing Chen, Committee Member
Digby D Macdonald, Committee Member
Jorge Osvaldo Sofo, Committee Member

Open Access

Author:: Shin, Dongwon
Title:: Thermodynamic properties of solid solutions from special quasirandom structures and CALPHAD modeling: Application to Al-Cu-Mg-Si and Hf-Si-O
Graduate Program:: Materials Science and Engineering
Keywords:: special quasirandom structures
thermodynamic modeling
first-principles calculations
solid solution phases
File:: Download DongwonShin.pdf
Committee Members:: Zi Kui Liu, Committee Chair/Co-Chair
Long Qing Chen, Committee Chair/Co-Chair
Jorge Osvaldo Sofo, Committee Member
Vincent Henry Crespi, Committee Member

Open Access

Author:: Sheng, Guang
Title:: PHASE-FIELD SIMULATION OF PHASE TRANSITIONS, DOMAIN STABILITIES AND STRUCTURES IN FERROELECTRIC THIN FILMS
Graduate Program:: Materials Science and Engineering
Keywords:: thin film
ferroelectric
phase-field
domain stability
File:: Download Guang_Sheng_PhD_thesis.pdf
Committee Members:: Long Chen, Dissertation Advisor/Co-Advisor
Long Qing Chen, Committee Chair/Co-Chair
Zi Kui Liu, Committee Chair/Co-Chair
Venkatraman Gopalan, Committee Member
Qiang Du, Committee Member
Qi Li, Committee Member

Open Access

Author:: Zhang, Hui
Title:: THERMODYNAMIC PROPERTIES OF MG BASED ALLOYS BY CALPHAD APPROACH COUPLED WITH FIRST-PRINCIPLES: APPLICATION TO MG-AL-CA-CE-SI SYSTEM
Graduate Program:: Materials Science and Engineering
Keywords:: Mg alloys
Intermetallics
First-principles
Calculation of phase diagram
File:: Download Hui_thesis.pdf
Committee Members:: Dr Zi Kui Liu And Dr Long Qing Chen, Dissertation Advisor/Co-Advisor
Zi Kui Liu, Committee Chair/Co-Chair
Long Qing Chen, Committee Chair/Co-Chair
Jorge Osvaldo Sofo, Committee Member
Digby D Macdonald, Committee Member

Open Access

Author:: Lee, June Hyuk
Title:: GROWTH OF MULTIFERROIC OXIDES BY MOLECULAR-BEAM EPITAXY
Graduate Program:: Materials Science and Engineering
Keywords:: Molecular-beam epitaxy
Multiferroics
Ferroelectrics
Ferromagnet
File:: Download Thesis-2010-v10.pdf
Committee Members:: L Q Chen, Dissertation Advisor/Co-Advisor
Long Qing Chen, Committee Chair/Co-Chair
Venkatraman Gopalan, Committee Member
Zi Kui Liu, Committee Member
Peter E Schiffer, Committee Member

Open Access

Author:: Zhang, Jingxian
Title:: PHASE-FIELD SIMULATIONS OF MICORSTRUCTURES INVOLVING LONG-RANGE ELASTIC, MAGNETOSTATIC AND ELECTROSTATIC INTERACTIONS
Graduate Program:: Materials Science and Engineering
Keywords:: multiferroic
ferromagnetic
ferroelectric
phase-field
File:: Download JingxianThesis.pdf
Committee Members:: Long Qing Chen, Committee Chair/Co-Chair
Zi Kui Liu, Committee Chair/Co-Chair
Darrell G Scholm, Committee Member
Qiang Du, Committee Member

Open Access

Author:: Mantina, Manjeera
Title:: A FIRST-PRINCIPLES METHODOLOGY FOR DIFFUSION COEFFICIENTS IN METALS AND DILUTE ALLOYS
Graduate Program:: Materials Science and Engineering
Keywords:: First-principles
tracer diffusion coefficients
metals
dilute alloys
fcc
bcc
hcp
self-diffusion
impurity diffusion
File:: Download Manjeera-Dissertation.pdf
Committee Members:: Zi Kui Liu, Committee Chair/Co-Chair
Long Qing Chen, Committee Chair/Co-Chair
Suzanne E Mohney, Committee Member
Jorge Osvaldo Sofo, Committee Member

Open Access

Author:: Lee, Sung Hoon
Title:: A STUDY OF IONIC MATERIALS FOR THE ENERGY APPLICATIONS THROUGH FIRST-PRINCIPLES CALCULATIONS AND CALPHAD MODELING
Graduate Program:: Materials Science and Engineering
Keywords:: Ionic materials
energy
CALPHAD
first-principles
File:: Download Sunghoon.pdf
Committee Members:: Dr Zi Kui Liu, Dissertation Advisor/Co-Advisor
Zi Kui Liu, Committee Chair/Co-Chair
Long Qing Chen, Committee Member
Clive A Randall, Committee Member
Jorge Osvaldo Sofo, Committee Member

Open Access

Author:: Zhang, Shengjun
Title:: THERMODYNAMIC INVESTIGATION OF THE EFFECT OF ALKALI METAL IMPURIES ON THE PROCESSING OF AL AND MG ALLOYS
Graduate Program:: Materials Science and Engineering
Keywords:: Mg alloys
High temperature embrittlement
alkali metal impurities
Al alloys
first-principles
Thermodynamics
File:: Download Zhang-Thesis-04.pdfDownload Corrected_Title_Page_S_Zhang.pdf
Committee Members:: Zi Kui Liu, Committee Chair/Co-Chair
Long Qing Chen, Committee Member
Earle Richard Ryba, Committee Member
Robert Carl Voigt, Committee Member

Open Access

Author:: Wang, Tao
Title:: AN INTEGRATED APPROACH FOR MICROSTRUCTURE SIMULATION: APPLICATION TO NI-AL-MO ALLOYS
Graduate Program:: Materials Science and Engineering
Keywords:: Microstructure evolution
Ni-base superalloy
First-principle
CALPHAD
Phase-field
File:: Download PhD_Thesis_TaoWang.pdf
Committee Members:: Zi Kui Liu, Committee Chair/Co-Chair
Long Qing Chen, Committee Chair/Co-Chair
Padma Raghavan, Committee Member
Jorge Osvaldo Sofo, Committee Member

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