On the challenge of sampling multiple nucleation pathways: A case study of heterogeneous ice nucleation on FCC (211) surface

Heterogeneous ice nucleation is ubiquitous but its microscopic mechanisms can be extraordinarily complex even on a simple surface. Such complexity poses a challenge in modeling nucleation using advanced sampling methods. Here, we investigate heterogeneous ice nucleation on an FCC (211) surface by a...

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Veröffentlicht in:	The Journal of chemical physics 2023-03, Vol.158 (12), p.124501-124501
Hauptverfasser:	Zhao, Wanyu, Li, Tianshu
Format:	Artikel
Sprache:	eng
Schlagworte:	Accuracy Anisotropy Complex systems Complexity Ice formation Mathematical models Nucleation Order parameters Parameter identification Physics Sampling methods
Online-Zugang:	Volltext
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