A folded ice monolayer

A highly stable ice monolayer with folded structural motifs is predicted by means of a novel tiling method augmented with ab initio calculations. This ice monolayer has every two neighboring water hexamers connected by a water square yet folded into two distinct planes, and is thus coined as a folde...

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Veröffentlicht in:	Physical chemistry chemical physics : PCCP 2020-09, Vol.22 (36), p.2388-2393
Hauptverfasser:	Xu, Ying, Xuan, Xiaoyu, Zhang, Zhuhua, Guo, Wanlin
Format:	Artikel
Sprache:	eng
Schlagworte:	Computer simulation Dynamic stability Molecular dynamics Monolayers Tiling
Online-Zugang:	Volltext
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