University Chemistry ›› 2024, Vol. 39 ›› Issue (3): 23-28.doi: 10.3866/PKU.DXHX202303003
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Yuqiao Zhou, Weidi Cao, Shunxi Dong, Lili Lin, Xiaohua Liu()
Received:
2023-03-01
Accepted:
2023-05-18
Published:
2023-07-06
Contact:
Xiaohua Liu
E-mail:liuxh@scu.edu.cn
Yuqiao Zhou, Weidi Cao, Shunxi Dong, Lili Lin, Xiaohua Liu. Study on the Teaching Reformation of Practical X-ray Crystallography[J].University Chemistry, 2024, 39(3): 23-28.
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教学目标 | 知识目标 | 1. | 掌握进行结构解析必需的晶体学基础知识 |
2. | 理解X射线特性和X射线衍射基本原理 | ||
3. | 理解X射线衍射仪结构解析软件运行原理 | ||
能力目标 | 1. | 熟练掌握X射线衍射仪使用方法收集高质量数据 | |
2. | 熟练运用软件解析晶体结构 | ||
3. | 学会分析判断结构常见问题并发表结构 | ||
情感价值目标 | 树立学生面对X射线单晶衍射测试和结构解析的信心 | ||
课堂教学大纲 | X射线原理 | 1. | X射线的产生、强度、吸收和选择 |
2. | 散射因子与X射线衍射几何 | ||
3. | 结构因子与相角问题 | ||
简明晶体学 | 1. | 格子与点阵,Bravais格子 | |
2. | 对称性操作 | ||
3. | 晶系、点群与空间群 | ||
结构解析技术 | 1. | 单晶培养技术和晶体选择 | |
2. | X射线衍射仪的发展历程 | ||
3. | Bruker APEX操作软件使用介绍 | ||
4. | 基于Bruker平台的SHELXTL程序讲解 | ||
5. | 如何判断结构可以发表 | ||
6. | 走进晶体学信息文件CIF | ||
7. | 氢原子相关问题 | ||
8. | “电子皆蓝色”——无序结构处理简介 | ||
9. | 简单孪晶数据处理方法 |
1 | 苏浩, 王鹏飞, 李晖.大学化学,2019,34(2),30. |
2 | 陈小明, 蔡继文.单晶结构分析原理与实践,北京:科学出版社,2007,1 |
3 | Müller, P.; Herbst-Irmer, R.; Spek, A. L.; Schneider, T. R.; Sawaya M. R. Crystal Structure Refinement: A Crystallographer's Guide to SHELXL. 陈昊鸿, 赵景泰, 译. 北京: 高等教育出版社, 2010: I. |
4 | Sheldrick, G. M..Acta Crystallogr.2008,A64,112. |
5 | Spek, A. L..Appl. Cryst.2009,36,7. |
6 | Spek, A. L..Acta Crystallogr.2009,D65,148. |
7 | Zhu, H. G.; Yang, G.; Chen, X. M.; Ng, S. W..Acta Cryst.2000,C56,e430. |
8 |
Vishweshwar, P.; McMahon, J. A.; Oliveira, M.; Peterson, M. L.; Zaworotko, M. J..J. Am. Chem. Soc.2005,127,16802.
doi: 10.1021/ja056455b |
9 |
Lou, B.; Boström, D.; Velaga, S. P..Cryst. Growth Des.2009,9,1254.
doi: 10.1021/cg8009749 |
10 |
Bond, A. D.; Boese, R.; Desiraju, G. R..Angew. Chem. Int. Ed.2007,46,615.
doi: 10.1002/anie.200602378 |
11 |
Bond, A. D.; Boese, R.; Desiraju, G. R..Angew. Chem. Int. Ed.2007,46,618.
doi: 10.1002/anie.200603373 |
12 |
Bond, A. D..CrystEngComm2012,14,2363.
doi: 10.1039/c2ce06662a |
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