Some thoughts on choosing the correct space group

被引:173
作者
Marsh, RE
机构
来源
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE | 1995年 / 51卷
关键词
D O I
10.1107/S0108768195008901
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
Some problems that may lead to incorrect assignments of space group are identified and discussed, and some suggestions for avoiding these problems are made. Along the way, about four dozen structures listed in the Cambridge Structural Database are identified as having, almost surely, been described in space groups of unnecessarily low symmetry.
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页码:897 / 907
页数:11
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