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Author:

Yang, Hui

Title:

Multiscale Chemo-mechanical Mechanics of High-capacity Anode Materials in Lithium-ion Nano-batteries

Graduate Program:

Engineering Science and Mechanics

Keywords:

Lithium-ion battery
Anode materials
Chemomechanical modeling
Diffusion
Orientation-dependent interfacial mobility
Fracture

File:

Download MULTISCALE_CHEMO-MECHANICAL_MECHANICS_OF_HIGH-CAPACITY_ANODE_MATERIALS_IN_LITHIUM-ION_NANO-BATTERIES.pdf

Committee Members:

Sulin Zhang, Dissertation Advisor/Co-Advisor
Sulin Zhang, Committee Chair/Co-Chair
Charles E Bakis, Committee Member
Long Qing Chen, Committee Member
Adrianus C Van Duin, Committee Member

Author:

Hart, Kyle E

Title:

Development of Structure-property Relationships for Intrinsically Microporous Polymers through Molecular Simulations

Graduate Program:

Materials Science and Engineering

Keywords:

Molecular Simulation
Polymers of intrinsic microporosity
carbon dioxide adsorption
gas separation
PIMs

File:

Download Hart-Dissertation.pdf

Committee Members:

Coray M Colina, Dissertation Advisor/Co-Advisor
William George Noid, Committee Member
James Patrick Runt, Committee Member
Adrianus C Van Duin, Committee Member

Author:

Rygg, Alex Dale

Title:

The Hydrodynamics and Transport Phenomena of Olfaction in the Hammerhead Shark (sphyrna tudes): Implications for Bio-inspired Chemical Sensing

Graduate Program:

Mechanical Engineering

Keywords:

Olfaction
Computational Fluid Dynamics
Mass Transport
Chemical Sensing
Hammerhead Shark

File:

Download AlexRygg_Dissertation.pdf

Committee Members:

Brent Craven, Dissertation Advisor/Co-Advisor
Brent Craven, Committee Chair/Co-Chair
Eric Paterson, Committee Chair/Co-Chair
John Michael Cimbala, Committee Member
Robert Francis Kunz, Committee Member
Gary Stuart Settles, Committee Member
Adrianus C Van Duin, Committee Member

Author:

Verners, Osvalds

Title:

Molecular dynamics analysis of oxidation, segregation and stress corrosion failures of refractory alloys

Graduate Program:

Mechanical Engineering

Keywords:

oxidation
segregation
stress corrosion cracking
hydrogen embrittlement
alloys

File:

Download dissertation_Verners.pdf

Committee Members:

Adrianus C Van Duin, Dissertation Advisor/Co-Advisor
Adrianus C Van Duin, Committee Chair/Co-Chair
Md Amanul Haque, Committee Member
Zoubeida Ounaies, Committee Member
Sulin Zhang, Committee Member

Author:

Krcha, Matthew David

Title:

Cleanup of Biomass Gasification Effluent Using M-doped Ceria Catalysts

Graduate Program:

Chemical Engineering

Keywords:

Density Functional Theory
Catalysis
Ceria
Dopant
Hydrocarbon
Sulfur

File:

Download MatthewKrchaDissertation.pdf

Committee Members:

Michael John Janik, Dissertation Advisor/Co-Advisor
Michael John Janik, Committee Chair/Co-Chair
Robert Martin Rioux Jr., Committee Member
Scott Thomas Milner, Committee Member
Adrianus C Van Duin, Committee Member

Author:

Borner, Arnaud

Title:

Use of Advanced Particle Methods in Modeling Space Propulsion and its Supersonic Expansions

Graduate Program:

Aerospace Engineering

Keywords:

Molecular Dynamics
Water
Electrospray
DSMC
Electric Field
Ionic Liquid
Coarse-Grained

File:

Download AB-Dissertation.pdf

Committee Members:

Deborah A Levin, Dissertation Advisor/Co-Advisor
Adrianus C Van Duin, Committee Member
Barbara Jane Garrison, Committee Member
Dennis K Mc Laughlin, Committee Member

Author:

Hatzell, Marta Catherine

Title:

Electrochemical Energy Generation from Natural and Synthetic Salinity Gradients using Reverse Electrodialysis and Capacitive Mixing

Graduate Program:

Mechanical Engineering

Keywords:

Salinity Gradient Energy
Reverse Electrodialysis
Capacitive Mixing
Electrochemical Conversion
Hydrogen
Capacitor

File:

Download MartaHatzell_Dissertation08042014.pdf

Committee Members:

Bruce Ernest Logan, Dissertation Advisor/Co-Advisor
Adrianus C Van Duin, Committee Member
Chao Yang Wang, Committee Member
Michael Anthony Hickner, Committee Member

Author:

Parsons, Neal S

Title:

Improved Molecular Collision Models for Nonequilibrium Rarefied Gases

Graduate Program:

Aerospace Engineering

Keywords:

Rarefied Gases
Direct Simulation Monte Carlo
Nonequilibrium Gases
Reacting Flows
Hypersonics
Planetary Science

File:

Download ParsonsDissertation.pdf

Committee Members:

Deborah A Levin, Dissertation Advisor/Co-Advisor
Adrianus C Van Duin, Committee Member
Michael Matthew Micci, Committee Member
Michael John Janik, Committee Member

Author:

Goverapet Srinivasan, Sriram

Title:

Hyperthermal Oxidation and Pyrolysis of Carbon based Materials: Chemistry and Dynamics using the Reaxff Reactive Force Field

Graduate Program:

Mechanical Engineering

Keywords:

ReaxFF
Graphite oxidation
Diamond oxidation
Fullerene fragmentation
Gas surface interaction
hyperthermal etching

File:

Download Sriram_thesis.pdf

Committee Members:

Adrianus C Van Duin, Dissertation Advisor/Co-Advisor
Zoubeida Ounaies, Committee Member
Randy Lee Vander Wal, Committee Member
Lasse Jensen, Committee Member

Author:

Huang, Chung-hsuan

Title:

Soot nanostructure evolution from gas turbine engine, premixed and diffusion flame: Equivalence ratio, flame temperature, and fuel dependencies.

Graduate Program:

Energy and Mineral Engineering

Keywords:

Soot nanostructrue
AAFEX II
Premixed flame
diffusion
bunsen
SERDP
ChemKin
fullerenic soot
curvature
cyclopentadiene.

File:

Download 2014-12-1-Final-Chung-Hsuan_Huang_Thesis.1.pdf

Committee Members:

Randy Vander Wal, Dissertation Advisor/Co-Advisor
Randy Vander Wal, Committee Chair/Co-Chair
Andre Louis Boehman, Committee Member
Adrianus C Van Duin, Special Member
Thomas Litzinger, Special Member