Multiscale simulations in face-centered cubic metals: A method coupling quantum mechanics and molecular mechanics

于潇翔, 王崇愚

Yu Xiao-Xiang (于潇翔), Wang Chong-Yu (王崇愚)

中国物理B . 2013, (2): 27101 -027101 . DOI: 10.1088/1674-1056/22/2/027101