SIR97:: a new tool for crystal structure determination and refinement

被引：9578
作者：
Altomare, A
Burla, MC
Camalli, M
Cascarano, GL
Giacovazzo, C
Guagliardi, A
Moliterni, AGG
Polidori, G
Spagna, R
机构：
[1] Univ Bari, Dipartimento Geomineral, IRMEC, I-70125 Bari, Italy
[2] Piazza Univ, Dipartimento Sci Terra, I-06100 Perugia, Italy
[3] CNR, Ist Strutturist Chim G Giacomello, Monterotondo Stn, I-00016 Monterotondo, Italy
来源：
JOURNAL OF APPLIED CRYSTALLOGRAPHY | 1999年 / 32卷
关键词：
D O I：
10.1107/S0021889898007717
中图分类号：
O6 [化学];
学科分类号：
0703 ;
摘要：
SIR97 is the integration of two programs, SIR92 and CAOS, the first devoted to the solution of crystal structures by direct methods, the second to refinement via least-squares-Fourier procedures Several new features have been introduced in SIR97 with respect to the previous version, SIR92: greater automatization, increased efficiency of the direct methods section, and a powerful graphics interface. The program also provides publication tables and CIF files.
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收藏
页码：115 / 119
页数：5
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