Improved generation of large-scale atomistic representations and pyrolysis/combustion simulations of Illinois coal and coal char using the Reaxff reactive force field
Jonathan P Mathews, Dissertation Advisor/Co-Advisor Jonathan P Mathews, Committee Chair/Co-Chair Ljubisa R Radovic, Committee Member Caroline Elaine Clifford, Committee Member Robert John Santoro, Committee Member Adrianus C Van Duin, Committee Member
