Open AccessPARAMETRIC STUDY OF REAXFF SIMULATION PARAMETERS FOR MOLECULAR DYNAMICS MODELING OF REACTIVE CARBON GASES
Author(s) -
Benjamin David Jensen
Publication year - 2020
Language(s) - English
Resource type - Dissertations/theses
DOI - 10.37099/mtu.dc.etds/643
Subject(s) - reaxff , molecular dynamics , parametric statistics , materials science , carbon fibers , chemistry , chemical physics , chemical engineering , computational chemistry , engineering , composite material , mathematics , statistics , interatomic potential , composite number