Silicon-Oxygen Equilibrium in δ-iron at the Solid-Liquid Equilibrium Temperature
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چکیده
منابع مشابه
Use of equilibrium and nonequilibrium molecular dynamics to determine solid-liquid phase coexistence at equilibrium
It is often difficult to determine the solid-liquid transition by conventional simulation techniques because of the computational challenges posed by two dense phases. Hansen and Verlet [Han69] reported the first molecular simulation results for solid-liquid phase coexistence. They used a thermodynamic integration algorithm that involves the accurate evaluation of free energies. The widely used...
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ژورنال
عنوان ژورنال: Transactions of the Iron and Steel Institute of Japan
سال: 1981
ISSN: 0021-1583,1881-1183
DOI: 10.2355/isijinternational1966.21.624