A molecular dynamics simulation of (110) surface premelting in Ni

作者: H. Song , S.J. Fensin , M. Asta , J.J. Hoyt

DOI: 10.1016/J.SCRIPTAMAT.2010.03.032

关键词: NickelPhysical chemistryMelting pointPremeltingMolecular dynamicsThermodynamicsSurface (mathematics)ImaginationMaterials scienceChemical substanceAtomGeneral Materials ScienceCondensed matter physics

摘要: Molecular dynamics simulations were used to examine the premelting behavior of (1 1 0) surface for an embedded atom method model pure nickel. The distributions liquid layer widths obtained at five temperatures ranging from 2 30 K below melting point. results construct structural contribution disjoining potential, which describes short-ranged thermodynamic driving force premelting.

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