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Start Over Committee Member Randy Lee Vander Wal Keyword ReaxFF

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

open_access
Open Access
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

2. ReaxFF reactive force field investigations in combustion and nascent soot formation

open_access
Open Access
Author:
Shabnam, Sharmin
Title:
ReaxFF reactive force field investigations in combustion and nascent soot formation
Graduate Program:
Mechanical Engineering
Keywords:
ReaxFF
Combustion
Soot Formation
Pyrolysis and Oxidation
Molecular Dynamics Simulations
Inert Dilution
Nickel
Fuel Mixtures
File:
Download Dissertation_Sharmin_MAY2020.pdf
Committee Members:
Adrianus C Van Duin, Dissertation Advisor/Co-Advisor
Adrianus C Van Duin, Committee Chair/Co-Chair
Richard A Yetter, Committee Member
Randy Lee Vander Wal, Committee Member
Michael John Janik, Outside Member
Karen Ann Thole, Program Head/Chair