A Modified Embedded Atom Method (MEAM) Interatomic Potential for the Fe-C-H System
published by Sungkwang Mun
in 2021
in Physics
and research's language is
English
Download
Abstract in English
We develop an Fe-C-H interatomic potential based on the modified embedded-atom method (MEAM) formalism based on density functional theory to enable large-scale modular dynamics simulations of carbon steel and hydrogen.