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Can thin disk-like ice clusters be more stable than compact droplet-like ice clusters?

Hideki Tanaka, Ryoichi Yamamoto, Kenichiro Koga, X. C. Zeng

Research output: Journal Publications and ReviewsRGC 21 - Publication in refereed journalpeer-review

Abstract

The relative stability of water clusters of two different morphologies has been examined with the size N ranging from 54 to 864; the first one is a circular fragment of bilayer ice (a disk-like cluster), and the second one is a spherical fragment of normal cubic ice (a droplet-like cluster). We found a crossover at Nc ≃ 1000, below which the disk-like cluster becomes more energetically favorable. The crossover arises because the potential energy (per molecule) for the droplet-like cluster decreases linearly with N-1/3 whereas it decreases by N-1/2 for the disk-like cluster. © 1999 Elsevier Science B.V. All rights reserved.
Original languageEnglish
Pages (from-to)378-384
JournalChemical Physics Letters
Volume304
Issue number5-6
DOIs
Publication statusPublished - 7 May 1999
Externally publishedYes

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