Prediction of anion distributions using Pauling's second rule

被引：65

作者：

Fuertes, Amparo ^{[1
]}

机构：

[1] CSIC, Inst Ciencia Mat Barcelona, Bellaterra 08193, Spain

来源：

INORGANIC CHEMISTRY | 2006年 / 45卷 / 24期

关键词：

D O I：

10.1021/ic061640r

中图分类号：

O61 [无机化学];

学科分类号：

070301 ; 081704 ;

摘要：

Pauling's second crystal rule is shown to be able to predict in a general and simple way the distribution of anions in mixed oxyanion systems such as oxynitrides and oxyhalides with diverse compositions and structure types. Results are presented in a plot correlating the charge of the anions obtained from the observed occupancies in crystallographic positions with the calculated bond strength sums for these sites.

引用

页码：9640 / 9642

页数：3

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