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

被引：9601

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.

引用

页码：115 / 119

页数：5

共 22 条

[1] SIR92 - a program for automatic solution of crystal structures by direct methods [J].