Bond-order potential for atomistic simulations in iron

被引:0
|
作者
Krasko, Genrich L. [1 ]
Rice, B. [2 ]
Yip, Aid S. [1 ]
机构
[1] Department of Nuclear Engineering, Massachusetts Inst. of Technology, Cambridge, MA 02139-4307, United States
[2] Weapons and Mat. Research Division, Army Research Laboratory, Aberdeen Prvng. Grnd., MD 21005-5069, United States
来源
关键词
D O I
暂无
中图分类号
学科分类号
摘要
引用
收藏
页码:129 / 136
相关论文
共 50 条
  • [31] Phase transitions in titanium with an analytic bond-order potential
    Ferrari, Alberto
    Schroeder, Malte
    Lysogorskiy, Yury
    Rogal, Jutta
    Mrovec, Matous
    Drautz, Ralf
    MODELLING AND SIMULATION IN MATERIALS SCIENCE AND ENGINEERING, 2019, 27 (08)
  • [32] The influence of lead on mechanical properties of BCC and FCC iron from a constructed bond-order potential
    Dikang Peng
    Jinglun Hu
    Yuchuan Jiang
    Lei Sun
    Haoran Gong
    Lingyun Yang
    Chaoping Liang
    The European Physical Journal Plus, 138
  • [33] The influence of lead on mechanical properties of BCC and FCC iron from a constructed bond-order potential
    Peng, Dikang
    Hu, Jinglun
    Jiang, Yuchuan
    Sun, Lei
    Gong, Haoran
    Yang, Lingyun
    Liang, Chaoping
    EUROPEAN PHYSICAL JOURNAL PLUS, 2023, 138 (12):
  • [34] Intrinsic long-range bond-order potential for carbon: Performance in Monte Carlo simulations of graphitization
    Los, JH
    Fasolino, A
    PHYSICAL REVIEW B, 2003, 68 (02)
  • [35] RAPIDLY CONVERGENT BOND ORDER EXPANSION FOR ATOMISTIC SIMULATIONS
    AOKI, M
    PHYSICAL REVIEW LETTERS, 1993, 71 (23) : 3842 - 3845
  • [36] Relation between the kernel polynomial method and the bond-order potential
    Qin, T.
    PHYSICAL REVIEW B, 2010, 81 (07):
  • [37] An analytical bond-order potential for the aluminum copper binary system
    Zhou, X. W.
    Ward, D. K.
    Foster, M. E.
    JOURNAL OF ALLOYS AND COMPOUNDS, 2016, 680 : 752 - 767
  • [38] Convergence of an analytic bond-order potential for collinear magnetism in Fe
    Ford, Michael E.
    Drautz, Ralf
    Hammerschmidt, Thomas
    Pettifor, D. G.
    MODELLING AND SIMULATION IN MATERIALS SCIENCE AND ENGINEERING, 2014, 22 (03)
  • [39] Atomistic mechanism of graphene growth on a SiC substrate: Large-scale molecular dynamics simulations based on a new charge-transfer bond-order type potential
    Takamoto, So
    Yamasaki, Takahiro
    Nara, Jun
    Ohno, Takahisa
    Kaneta, Chioko
    Hatano, Asuka
    Izumi, Satoshi
    PHYSICAL REVIEW B, 2018, 97 (12)
  • [40] An analytic bond-order potential for the Fe-Cu system
    Hou, Huai Yu
    Wang, Rong Shan
    Wang, Jing Tao
    Liu, Xiang Bing
    Chen, Guang
    Huang, Ping
    MODELLING AND SIMULATION IN MATERIALS SCIENCE AND ENGINEERING, 2012, 20 (04)