Influence of Light Impurities on the Crystal-Melt Interface Velocity in Ni and Ag. Molecular Dynamics Simulation

被引:16
|
作者
Poletaev, G. M. [1 ]
Zorya, I., V [2 ]
机构
[1] Polzunov Altai State Tech Univ, Barnaul 656038, Russia
[2] Siberian State Ind Univ, Novokuznetsk 654007, Russia
关键词
molecular dynamics; metal; crystallization; impurity; crystal-melt interface; POTENTIALS; METALS; ATOMS;
D O I
10.1134/S1063785020060231
中图分类号
O59 [应用物理学];
学科分类号
摘要
The influence of impurities of light elements (C, N, and O) on the crystal-melt interface velocity in fcc metals (Ni and Ag) has been investigated by the molecular dynamics method. Dependences of the crystallization rate on the impurity concentration are obtained. It is shown that the presence of impurities reduces significantly the crystal-melt interface velocity in metals. Impurity atoms induce local lattice strain, which leads to deceleration of the crystal-melt interface; as a rule, the stronger this strain is, the more significant the deceleration of the crystal-melt interface by impurity atoms is.
引用
收藏
页码:575 / 578
页数:4
相关论文
共 50 条
  • [1] Influence of Light Impurities on the Crystal–Melt Interface Velocity in Ni and Ag. Molecular Dynamics Simulation
    G. M. Poletaev
    I. V. Zorya
    Technical Physics Letters, 2020, 46 : 575 - 578
  • [2] Crystal-Melt Interface Growth Velocity of Ni-Zr Alloys Through Molecular Dynamics Simulations
    Ramakrishnan, R.
    Phanikumar, Gandham
    Sankarasubramanian, R.
    TRANSACTIONS OF THE INDIAN INSTITUTE OF METALS, 2015, 68 (06) : 1113 - 1117
  • [3] Non-equilibrium molecular dynamics simulation of a crystal-melt interface
    Mori, A
    Shirazawa, F
    Inoue, N
    RUSSIAN JOURNAL OF PHYSICAL CHEMISTRY, 2004, 78 : S176 - S181
  • [4] DYNAMICS AT THE NONEQUILIBRIUM CRYSTAL-MELT INTERFACE
    MESQUITA, ON
    CUMMINS, HZ
    PHYSICOCHEMICAL HYDRODYNAMICS, 1984, 5 (5-6): : 389 - 399
  • [5] Computer simulation study of surface wave dynamics at the crystal-melt interface
    Benet, Jorge
    MacDowell, Luis G.
    Sanz, Eduardo
    JOURNAL OF CHEMICAL PHYSICS, 2014, 141 (03):
  • [6] Atomistic simulation study of the structure and dynamics of a faceted crystal-melt interface
    Buta, Dorel
    Asta, Mark
    Hoyt, Jeffrey J.
    PHYSICAL REVIEW E, 2008, 78 (03)
  • [7] CONSTRUCTION AND INVESTIGATION OF A HARD-SPHERE CRYSTAL-MELT INTERFACE BY A MOLECULAR-DYNAMICS SIMULATION
    MORI, A
    MANABE, R
    NISHIOKA, K
    PHYSICAL REVIEW E, 1995, 51 (05) : R3831 - R3833
  • [8] Crystal-melt coexistence in FCC and BCC metals: A molecular-dynamics study of crystal-melt interface free energies
    Wu, Lingkang
    Wang, Hao
    Zhu, Yiying
    Li, Mo
    MATERIALIA, 2021, 15
  • [9] ASYMMETRY OF DYNAMICS AT THE GROWING CRYSTAL-MELT INTERFACE
    MESQUITA, ON
    NEAL, DG
    COPIC, M
    CUMMINS, HZ
    PHYSICAL REVIEW B, 1984, 29 (05): : 2846 - 2849
  • [10] SIMULATION OF A CRYSTAL-MELT INTERFACE IN A MONOATOMIC SYSTEM
    ZELL, J
    MUTAFTSC.B
    JOURNAL OF CRYSTAL GROWTH, 1971, 13 (MAY) : 231 - &