Articles with "metals atomistic" as a keyword



Solid–liquid interfacial properties of refractory metals from atomistic simulations

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Published in 2025 at "Modelling and Simulation in Materials Science and Engineering"

DOI: 10.1088/1361-651x/ade17a

Abstract: In this work, we use molecular dynamics simulations to compute anisotropic solid–liquid interfacial properties for refractory metals Mo, Nb, Ta, V and W using an accurate tabulated Gaussian approximation potential. The capillary fluctuation method is… read more here.

Keywords: properties refractory; metals atomistic; refractory metals; interfacial properties ... See more keywords