Zeolite Structure Determination from X Ray Diffraction用射线衍射法测定沸石结构.pdfVIP

Zeolite Structure Determination from X-Ray Diffraction H. van Koningsveld 1 and J. M. Bennett2 1 Laboratory of Organic Chemistry and Catalysis, Delft University of Technology, Julianalaan 136, 2628 BL Delft, The Netherlands; e-mail: havank@cad4sun.tn.tudelft.nl 2 661 Weadley Road, Radnor, PA 19087, USA; e-mail: JMBXrayse@ 1 Introduction . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2 Severe Overlap of Reflections in Powder Data . . . . . . . . . . . . . . 3 3 Incorrect Determination of the Space Group . . . . . . . . . . . . . . . 5 4 Effect of Framework Flexibility . . . . . . . . . . . . . . . . . . . . . . . 8 5 Disorder of Non-Framework Species . . . . . . . . . . . . . . . . . . . 16 6 Faulting within the Framework . . . . . . . . . . . . . . . . . . . . . . . 23 7 Isomorphous Replacement of Framework Atoms . . . . . . . . . . . . . 24 8 Crystal Size Limitations . . . . . . . . . . . . . . . . . . . . . . . . . . . 25 9 Conclusions . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25 References . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 26 1 Introduction Zeolites and related microporous materials are a class of materials with an ever widening range of compositions, structures and uses. Since the earliest days of zeolite science X-ray diffraction has been one of the basic and most useful tools for characterization. Initially X-ray diffraction was used to answer simple questions such as:“have I made a new material?”or:“has the crystallization process gone to completion?” Now the questions encompass everything that a researcher might want to k