Shuttleworth equation: A molecular simulations perspective

Even though the study of interfacial phenomena can be traced back to Laplace and was given a solid thermodynamic foundation by Gibbs, it appears that some concepts and relations among them are still causing some confusion and debates in the literature, particularly for interfaces involving solids. I...

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Veröffentlicht in:	The Journal of chemical physics 2020-10, Vol.153 (15), p.154705-154705
Hauptverfasser:	Di Pasquale, Nicodemo, Davidchack, Ruslan L.
Format:	Artikel
Sprache:	eng
Schlagworte:	Free energy Lennard-Jones potential Mathematical analysis Molecular dynamics Simulation Solid surfaces Statistical mechanics Surface tension
Online-Zugang:	Volltext
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