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首页> 外文期刊>Acta Crystallographica, Section B. Structural Science >Crystal chemistry of borates: the classification and algebraic description by topological type of fundamental building blocks
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Crystal chemistry of borates: the classification and algebraic description by topological type of fundamental building blocks

机译：硼酸盐的晶体化学：基本结构单元的拓扑类型分类和代数描述

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摘要

The structural characteristics of all the borates available were analyzed using the Inorganic Crystal Structure Database. The fundamental building blocks (FBBs) in 841 borates were systematically classified into 6 types in terms of their topological structures. By including the polymerization of the FBBs in the borate structure a novel systematic, classification and an algebraic description of borates have been proposed. The current systematic borate classification, in which all the identical FBBs can be classified into the same type, is more reasonable and provides new insight into the structural differences between various borates. The current, simpler, algebraic description is more extensive and can reflect more of the structural information of borates. This thus provides an impetus for elucidating the topological features of borates. Our work also provides much useful information on the design and search for novel borates, which is also helpful to classify newly synthesized borates and to strengthen the understanding of the overall scope of borate structures.
机译：使用无机晶体结构数据库分析了所有可用硼酸盐的结构特征。根据其拓扑结构，将841个硼酸盐中的基本构件（FBB）分为6种类型。通过在硼酸盐结构中包括多溴联苯的聚合反应，提出了一种新颖的硼酸盐体系，分类和代数描述。当前的系统性硼酸盐分类（其中所有相同的FBB都可以归为同一类型）更加合理，并为各种硼酸盐之间的结构差异提供了新的见识。当前的，更简单的代数描述更加广泛，可以反映更多硼酸盐的结构信息。因此，这为阐明硼酸盐的拓扑特征提供了动力。我们的工作还提供了有关设计和寻找新型硼酸盐的有用信息，这也有助于对新合成的硼酸盐进行分类并加强对硼酸盐结构整体范围的理解。

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