Capturing the Iron Carburization Mechanisms from the Surface to Bulk
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DOI: 10.1021/acs.jpcc.0c09001
Abstract: Reactive force field molecular dynamics is a powerful tool to simulate large-scale reactive events such as catalytic reactions and metallic corrosion, including the carburization or so-called metal... read more here.
Keywords: carburization; surface bulk; carburization mechanisms; iron carburization ... See more keywords