INTEGRATION OF PATTERSON INFORMATION INTO DIRECT METHODS .3. THE USE OF HARKER SECTIONS

被引:3
作者
ALTOMARE, A
CASCARANO, G
GIACOVAZZO, C
机构
[1] Istituto di Ricerca per lo Sviluppo, Metodologie Cristallografiche CNR, Campus Universitario, 70124 Bari, via Salvemini
来源
ACTA CRYSTALLOGRAPHICA SECTION A | 1992年 / 48卷
关键词
D O I
10.1107/S0108767392000783
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
A recently described probabilistic approach [Giacovazzo (1991). Acta Cryst. A47, 256-263; Altomare, Cascarano & Giacovazzo (1992). Acta Cryst. A48, 30-36] is aimed at integrating information contained in Patterson peaks with direct-methods procedures. The approach is here extended to the information contained in Harker sections. It is also shown that, when heavy atoms are present, the structure seminvariants can be readily estimated by a combination of the so-called symmetry function with a special least-squares procedure.
引用
收藏
页码:495 / 500
页数:6
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