Inorganic double-helix nanotoroid of simple lithium-phosphorus species

Alexander S. Ivanov, Alexander I. Boldyrev, Gernot Frenking

科研成果: 期刊稿件文章同行评审

13 引用 (Scopus)

摘要

A theoretical study of Li90P90, which possesses a circular double-helix structure that resembles the Watson-Crick DNA structure, is reported. This is a new bonding motif in inorganic chemistry. The calculations show that the molecule might become synthesized and that it could be a model for other inorganic species which possess a double-helix structure. Running rings: Theoretical prediction of the existence of inorganic double-helical toroid-like structures at the atomic level is reported. The geometry, electronic, and structural properties of an unusually simple circular double helix made of 90 phosphorus and 90 lithium atoms were studied using ab initio calculations. The shape of this cluster is very similar to nature's circular DNA (see graphic).

源语言英语
页(从-至)2431-2435
页数5
期刊Chemistry - A European Journal
20
9
DOI
出版状态已出版 - 24 2月 2014
已对外发布

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