典型单元倾斜及其原子装饰

IF 2.3 4区 化学 Q3 CHEMISTRY, MULTIDISCIPLINARY
Nobuhisa Fujita, Marek Mihalkovič, Christopher L. Henley
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引用次数: 0

摘要

正典单元平铺是一种几何框架,它使用四种基本多面体(称为正典单元)来模拟二十面体准晶体和相关周期近似物中的原子和团簇堆积。在过去的三十年中,人们越来越清楚地认识到,这一框架是描述相关结构的最合理方法,尽管在技术上远不如安曼-克拉默-内里平铺法(基于两个安曼斜方体的最简单的二十面体平铺几何)。细胞的几何排列带来了许多无法用简单线性代数处理的组合问题,使得用标准六维方案确定结构变得不可行。这篇最新的综述首先介绍了典型细胞平铺的动机、定义和数学事实。然后,将带领读者了解从较小的周期近似值到较大的周期近似值的具体结构动物园,并概述用于研究它们的技术和启发式方法。此外,还简要介绍了最近发现的准周期典型单元平铺。这篇综述的后半部分将基于正典单元平铺的装饰概念,对所有三个现有结构族中的真实原子结构进行原子建模。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

Canonical‐Cell Tilings and their Atomic Decorations

Canonical‐Cell Tilings and their Atomic Decorations
The canonical cell tiling is a geometrical framework that uses four kinds of basic polyhedra, called the canonical cells, to model the packing of atoms and clusters in icosahedral quasicrystals and related periodic approximants. Over the past three decades, it has become increasingly clear that this framework is the most sensible approach to describe related structures, albeit technically much less tractable than the Ammann‐Kramer‐Neri tiling, which is the simplest icosahedral tiling geometry based on the two Ammann rhombohedra. Geometrical arrangements of cells pose a number of combinatorial problems that cannot be handled using simple linear algebra, making it infeasible to determine structures using the standard six‐dimensional scheme. This up‐to‐date review begins with the motivation, definition, and mathematical facts about the canonical cell tiling. Then the reader is taken through the zoo of concrete structures, from smaller periodic approximants to larger ones, along with an overview of the techniques and heuristics used to study them. The recent discovery of a quasiperiodic canonical cell tiling is also briefly illustrated. The latter half of this review surveys the atomistic modeling of real atomic structures in all the three existing structural families based on the decoration concept of the canonical cell tiling.
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来源期刊
Israel Journal of Chemistry
Israel Journal of Chemistry 化学-化学综合
CiteScore
6.20
自引率
0.00%
发文量
62
审稿时长
6-12 weeks
期刊介绍: The fledgling State of Israel began to publish its scientific activity in 1951 under the general heading of Bulletin of the Research Council of Israel, which quickly split into sections to accommodate various fields in the growing academic community. In 1963, the Bulletin ceased publication and independent journals were born, with Section A becoming the new Israel Journal of Chemistry. The Israel Journal of Chemistry is the official journal of the Israel Chemical Society. Effective from Volume 50 (2010) it is published by Wiley-VCH. The Israel Journal of Chemistry is an international and peer-reviewed publication forum for Special Issues on timely research topics in all fields of chemistry: from biochemistry through organic and inorganic chemistry to polymer, physical and theoretical chemistry, including all interdisciplinary topics. Each topical issue is edited by one or several Guest Editors and primarily contains invited Review articles. Communications and Full Papers may be published occasionally, if they fit with the quality standards of the journal. The publication language is English and the journal is published twelve times a year.
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