Kinetic Monte Carlo simulations of precipitation

被引:14
|
作者
Clouet, Emmanuel [1 ]
Hin, Celine [1 ]
Gendt, Dominique [1 ]
Nastar, Maylise [1 ]
Soisson, Frederic [1 ]
机构
[1] CEA Saclay, Serv Rech Met Phys, F-91191 Gif Sur Yvette, France
关键词
D O I
10.1002/adem.200600183
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
We present some recent applications of the atomistic diffusion model and of the kinetic Monte Carlo (KMC) algorithm to systems of industrial interest, i.e. Al-Zr-Sc and Fe-Nb-C alloys, or to model systems. These applications include study of homogeneous and heterogeneous precipitation as well as of phase transformation under irradiation. The KMC simulations are also used to test the main assumptions and limitations of more simple models and classical theories used in the industry, e.g. the classical nucleation theory.
引用
收藏
页码:1210 / 1214
页数:5
相关论文
共 50 条
  • [31] Kinetic Monte Carlo simulations of vacancy evolution in graphene
    Parisi, L.
    Di Giugno, R.
    Deretzis, I.
    Angilella, G. G. N.
    La Magna, A.
    MATERIALS SCIENCE IN SEMICONDUCTOR PROCESSING, 2016, 42 : 179 - 182
  • [32] Atomistic Monte Carlo simulations of radiation induced segregation and precipitation
    Soisson, Frederic
    SOLID-SOLID PHASE TRANSFORMATIONS IN INORGANIC MATERIALS 2005, VOL 1, 2005, : 819 - 834
  • [33] Monte Carlo simulations of segregation and precipitation in alloys under irradiation
    Soisson, F
    PHILOSOPHICAL MAGAZINE, 2005, 85 (4-7) : 489 - 495
  • [34] Kinetic Monte Carlo study of Al-Mg precipitation
    Slabanja, M
    Wahnström, G
    ACTA MATERIALIA, 2005, 53 (13) : 3721 - 3728
  • [35] Copper precipitation in iron: a comparison between metropolis Monte Carlo and lattice kinetic Monte Carlo methods
    Khrushcheva, O
    Zhurkin, EE
    Malerba, L
    Becquart, CS
    Domain, C
    Hou, M
    NUCLEAR INSTRUMENTS & METHODS IN PHYSICS RESEARCH SECTION B-BEAM INTERACTIONS WITH MATERIALS AND ATOMS, 2003, 202 : 68 - 75
  • [36] Kinetic Monte Carlo Simulations of Scintillation Processes in NaI(Tl)
    Kerisit, Sebastien
    Wang, Zhiguo
    Williams, Richard T.
    Grim, Joel Q.
    Gao, Fei
    IEEE TRANSACTIONS ON NUCLEAR SCIENCE, 2014, 61 (02) : 860 - 869
  • [37] Kinetic Monte Carlo Simulations of Defects in Anatase Titanium Dioxide
    Weiler, Benedikt
    Gagliardi, Alessio
    Lugli, Paolo
    JOURNAL OF PHYSICAL CHEMISTRY C, 2016, 120 (18): : 10062 - 10077
  • [38] Kinetic Monte-Carlo simulations of soot particle aggregation
    Balthasar, M
    Kraft, M
    Frenklach, M
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2005, 229 : U860 - U860
  • [39] Atomistic kinetic Monte Carlo simulations of polycrystalline copper electrodeposition
    Treeratanaphitak, Tanyakarn
    Pritzker, Mark D.
    Abukhdeir, Nasser Mohieddin
    ELECTROCHEMISTRY COMMUNICATIONS, 2014, 46 : 140 - 143
  • [40] General Method for Speeding Up Kinetic Monte Carlo Simulations
    Rego, Artur S. C.
    Brandao, Amanda L. T.
    INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH, 2020, 59 (19) : 9034 - 9042