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Author:

Krishnasamy Bharathi, Arvind

Title:

ANALYSIS OF THE THERMAL PROPERTIES OF ZINC OXIDE USING THE ReaxFF REACTIVE FORCE FIELD

Graduate Program:

Mechanical Engineering

Keywords:

nanowire
Zinc Oxide
ReaxFF

File:

Download Final_Draft.pdf

Committee Members:

Adrianus C Van Duin, Thesis Advisor/Co-Advisor
Adrianus C Van Duin, Thesis Advisor/Co-Advisor

Author:

Singhai, Shashank

Title:

APPLICATION OF THE REAXFF MOLECULAR SIMULATION METHOD FOR INVESTIGATING HYPERGOLICITY OF ENERGETIC IONIC LIQUIDS

Graduate Program:

Mechanical Engineering

Keywords:

ionic liquid
energetic
hypergolic
simulation
Reaxff
molecular dynamics
combustion

File:

Download S_Singhai-MSThesis-Fall2010.pdf

Committee Members:

Prof Adri Van Duin, Thesis Advisor/Co-Advisor
Adrianus C Van Duin, Thesis Advisor/Co-Advisor

Author:

Agrawalla, Satyam

Title:

DEVELOPMENT AND APPLICATION OF A REAXFF REACTIVE FORCE FIELD FOR HYDROGEN COMBUSTION

Graduate Program:

Mechanical Engineering

Keywords:

hydrogen combustion
ReaxFF
force field
reaction kinetics

File:

Download Thesis_Masters_Agrawalla_Satyam.pdf

Committee Members:

Prof Adri Van Duin, Thesis Advisor/Co-Advisor
Adrianus C Van Duin, Thesis Advisor/Co-Advisor