Articles with "potential prediction" as a keyword



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Construction of Al-Mg-Zn Interatomic Potential and the Prediction of Favored Glass Formation Compositions and Associated Driving Forces

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Published in 2022 at "Materials"

DOI: 10.3390/ma15062062

Abstract: An interatomic potential is constructed for the ternary Al-Mg-Zn system under a proposed modified tight-binding scheme, and it is verified to be realistic. Applying this ternary potential, atomistic simulations predict an intrinsic glass formation region… read more here.

Keywords: glass; glass formation; potential prediction; interatomic potential ... See more keywords