Identification of and symmetry computation for crystal nets

被引:287
作者
Delgado-Friedrichs, O [1 ]
O'Keeffe, M
机构
[1] Univ Tubingen, Dept Comp Sci, D-72076 Tubingen, Germany
[2] Arizona State Univ, Dept Chem, Tempe, AZ 85287 USA
来源
ACTA CRYSTALLOGRAPHICA A-FOUNDATION AND ADVANCES | 2003年 / 59卷
关键词
D O I
10.1107/S0108767303012017
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
Exact methods are presented to determine whether two periodic nets are combinatorially isomorphic and to compute the full combinatorial symmetry group of a net. It is found that for a large class of nets, which includes all known zeolite nets and most other known crystal nets, this group can be realized as a crystallographic space group.
引用
收藏
页码:351 / 360
页数:10
相关论文
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