Crystal Structure PPT4.2
Crystal Structure PPT4.2
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COURSE OUTCOMES
CO Title Level
Number On completion of this course, the students are expected
to learn
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Fig. 1 Introduction [1]
HISTORY OF POWDER METHOD
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Fig. 2 Instrument [2]
ORIGINAL POWDER SETUPS
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Fig. 3 Instrument [2]
MODERN POWDER SETUPS
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Fig. 4 Instrument [2]
POWDER
DIFFRACTION
METHOD
Powder diffraction is a scientific technique
using X-ray, neutron, or electron diffraction
on powder or microcrystalline samples for
structural characterization of materials. An
instrument dedicated to performing such
powder measurements is called a powder
diffractometer.
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Fig. 5 Introduction [3]
PROCESS
• A is a source of X- rays. These X-rays are generated by a cathode ray tube.
• Slits (S1 and S2) are used to adjust the shape of the beam, collimate to concentrate and direct the
X-rays beam toward the sample so that the powdered specimen (P) get a narrow pencil of X-rays.
• Fine powder is struck on a hair by means of gum. It is suspended vertically in the axis of a
cylindrical camera. This enables sharp lines to be obtained on the photographic film which is
surrounding the powder crystal in the form of a circular arc.
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PROCESS
• The X-rays after falling on the powder passes out of the camera through a cut in the film so as to
minimize the fogging produced by the scattering of the direct beam.
• When the geometry of the incident X-rays impinging the sample satisfies the Bragg Equation,
constructive interference occurs and the intensity of the reflected X-rays is recorded by a detector.
• The detector also processes this X-ray signal and convert it into a count rate, which is then output
to a device such as a printer or computer monitor.
• In a more complicated apparatus, also a goniometer can be used for fine adjustment of the
sample and the detector positions.
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SCHEMATIC OF X-RAY DIFFRACTOMETER
Fig. 6 Diffractometer[1] 10
OBTAINING DATA
• The crystal structure can be obtained from the arrangement of the traces and their relative intensities.
• A diffraction pattern plots intensity against the angle of the detector, 2θ. The result obtained is called
diffractogram.
• Absolute intensity (number of X-rays observed in an given peak) may vary by instrumental and experimental
parameters.
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APPLICATIONS AND LIMITATIONS
Applications
1. X-ray powder diffraction is most widely used for the identification of unknown crystalline materials (e.g.
2. Determination of unknown solids is critical to studies in geology, environmental science, material science,
Limitation:-
1. Crystal structure determination from powder diffraction data is extremely challenging due to the overlap of
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reflections in a powder experiment.
SUMMARY
Introduction to Powder Method
Application
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FAQS
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REFERENCES
Reference Website
[1] https://www.spec2000.net/00-login-1.htm
[2] https://slidetodoc.com/introduction-to-powder-x-ray-diffraction-18-th/
[3] https://physics.stackexchange.com/questions/193802/x-ray-diffraction-on-thin-film
[4] https://serc.carleton.edu/research_education/geochemsheets/techniques/XRD.html
[5]]file:///C:/Users/admin/Desktop/PowderMethodsHandout.pdf
[6] http://prism.mit.edu/xray/Basics%20of%20X-Ray%20Powder%20Diffraction.pdf
[7] https://en.wikipedia.org/wiki/Powder_diffraction
[8] file:///C:/Users/admin/Downloads/crystals-07-00142.pdf
[9] http://ww1.iucr.org/iucr-top/comm/cteach/pamphlets/2/node8.html
[10] https://www.youtube.com/watch?v=rImvmfjl2-E
[11] https://www.youtube.com/watch?v=ieYucsUlBqo 15
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