Estimation of the solid-liquid interface energy for metal elements

Computational Materials Science(2019)

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摘要
•A new model is proposed to calculate the solid-liquid interface energy γsl.•The effect of temperature on γsl is discussed.•A linear relation between vibration entropy Svib and evaporation entropy Sb is found.
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关键词
Interface energy,Simulation and modelling,Evaporation entropy,Metals,Vibration entropy
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