Powder diffraction (vol 1, 77, 2021)

被引:0
|
作者
Kaduk, James A.
Billinge, Simon J. L.
Dinnebier, Robert E.
Henderson, Nathan
Madsen, Ian
Cerny, Radovan
Leoni, Matteo
Lutterotti, Luca
Thakral, Seema
Chateigner, Daniel
机构
[1] Department of Physics, North Central College, Naperville, IL
[2] Department of Chemistry, Illinois Institute of Technology, Chicago, IL
[3] Deprtment of Applied Physics and Applied Mathematics, Columbia University, New York, NY
[4] Condensed Matter Physics and Materials Science Department, Brookhaven National Laboratory, Upton, NY
[5] Max Planck Institute for Solid State Research, Stuttgart
[6] Bruker AXS Inc., Madison, WI
[7] CSIRO Mineral Resources, Clayton South, Victoria
[8] Laboratory of Crystallography, University of Geneva, Geneva
[9] Department of Civil, Environmental, and Mechanical Engineering, University of Trento, Trento
[10] Saudi Aramco R&D Center, Dhahran
[11] Department of Industrial Engineering, University of Trento, Trento
[12] Department of Pharmaceutical Sciences & Research, University of Minnesota, Minneapolis, MN
[13] Université de Caen Normandie, CRISMAT-ENSICAEN, IUT Caen, Caen
来源
NATURE REVIEWS METHODS PRIMERS | 2021年 / 1卷 / 01期
关键词
D O I
10.1038/s43586-021-00085-4
中图分类号
O [数理科学和化学]; P [天文学、地球科学]; Q [生物科学]; N [自然科学总论];
学科分类号
07 ; 0710 ; 09 ;
摘要
Powder diffraction is a non-destructive technique, which is experimentally simple in principle. Because the physics behind diffraction is well understood, an exceptionally large amount of information can be obtained from a single measurement. The positions and relative intensities of the peaks yield a fingerprint that can be used for qualitative phase analysis. Quantitative phase analysis can be obtained by detailed analysis of the intensities. Unit cells can be derived from the peak positions. Crystal structures can be solved using powder diffraction data and refined by the Rietveld method. The peak profiles contain information about crystallite size, strain and nanostructure. Non-idealities in the intensities give information on texture. Abandoning the crystallographic model provides information about local structure, by pair distribution function analysis. For powder diffraction, everything is a sample; the technique is commonly applied to characterize minerals, ceramics, metals and alloys, catalysts, polymers, pharmaceuticals, organic compounds, environmental and forensic samples, among others. The major features of contemporary laboratory powder diffractometers are described. Methods for obtaining suitable powder specimens are summarized. Major applications of qualitative and quantitative phase analysis, structure solution, size/strain/nanostructure analysis using peak profiles, texture analysis and pair distribution function analysis are introduced. © 2021, Springer Nature Limited.
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