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Author:

Ashraf, Chowdhury Mahbub

Title:

DEVELOPMENT AND APPLICATIONS OF REAXFF REACTIVE FORCE FIELD SIMULATIONS IN COMBUSTION: FROM KINETICS TO DYNAMICS

Graduate Program:

Mechanical Engineering

Keywords:

Molecular dynamics
ReaxFF
Combustion
Chemical Kinetics
Pyrolysis
Oxidation

File:

Download dissertation_Chowdhury.pdf

Committee Members:

Prof. Adri van Duin, Dissertation Advisor/Co-Advisor
Prof. Adri van Duin, Committee Chair/Co-Chair
Prof. Richard Yetter, Committee Member
Prof. Jacqueline O'Connor, Committee Member
Prof. Lasse Jensen, Outside Member