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- W1996293889 abstract "The kinetics of isothermal crystallization and melting are studied for elemental Ni employing non-equilibrium molecular-dynamics simulations based on interatomic potentials of the embedded-atom-method form. These simulations form the basis for calculations of the magnitude and crystalline anisotropy of the kinetic coefficient $ensuremath{mu},$ defined as the constant of proportionality between interface velocity and undercooling. We obtain highly symmetric rates for crystallization and melting, from which we extract the following values of $ensuremath{mu}$ for low index ${100},$ ${110},$ and ${111}$ interfaces: ${ensuremath{mu}}_{100}=35.8ifmmodepmelsetextpmfi{}22,$ ${ensuremath{mu}}_{110}=25.5ifmmodepmelsetextpmfi{}1.6,$ and ${ensuremath{mu}}_{111}=24.1ifmmodepmelsetextpmfi{}4.0$ in units of cm/s K. The results of the present study are discussed in the context of previous molecular-dynamics simulations for related systems, and kinetic models based upon transition-state and density-functional theories." @default.
- W1996293889 created "2016-06-24" @default.
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- W1996293889 date "2004-01-28" @default.
- W1996293889 modified "2023-10-10" @default.
- W1996293889 title "Kinetic coefficient of Ni solid-liquid interfaces from molecular-dynamics simulations" @default.
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- W1996293889 doi "https://doi.org/10.1103/physrevb.69.024108" @default.
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