Cho Jung, Choi Hyun June, Guo Peng, Shin Jiho, Zou Xiaodong, Hong Suk Bong
Center for Ordered Nanoporous Materials Synthesis, Division of Environmental Science and Engineering, POSTECH, Pohang, 37673, Korea.
Inorganic and Structural Chemistry and Berzelii Center EXSELENT on Porous Materials, Department of Materials and Environmental Chemistry, Stockholm University, SE-106 91, Stockholm, Sweden.
Chemistry. 2017 Nov 13;23(63):15922-15929. doi: 10.1002/chem.201702417. Epub 2017 Sep 18.
The structure solution, prediction, and targeted synthesis of a family of embedded isoreticular zeolites (EIZs) with expanding structural complexity, denoted the RHO family, were reported recently. Here, the naming and building rules of body-centered cubic EIZs with the lta cage as the lattice point are presented. The rearrangement of a pair of pau and d8r cages between two lta cages and its repetitive insertion, combined with the strong reflections and fragment methods, allows the creation of three other new zeolite families, designated the HPO, RHO(b), and KFI families. Among them, the KFI family is found to be the only EIZ family, on the basis of the similarity of structure factor amplitudes and phases of strong reflections, that is, structural coding, within its family members. The structural credibility of this family is confirmed by both local interatomic distances and T-T-T angle analyses. The existence of tetragonal EIZ families is also demonstrated. The overall results provide useful insights into the prediction of unprecedented EIZ families.
最近报道了一族结构复杂性不断增加的嵌入同网沸石(EIZs)的结构解析、预测和靶向合成,该族沸石被称为RHO族。本文介绍了以lta笼为晶格点的体心立方EIZs的命名和构建规则。一对pau笼和d8r笼在两个lta笼之间的重排及其重复插入,结合强反射和片段方法,可创建另外三个新的沸石族,分别命名为HPO、RHO(b)和KFI族。其中,基于其家族成员内强反射的结构因子振幅和相位的相似性,即结构编码,发现KFI族是唯一的EIZ族。通过局部原子间距离和T-T-T角分析证实了该族的结构可信度。还证明了四方EIZ族的存在。总体结果为预测前所未有的EIZ族提供了有用的见解。