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Seminars Crystallography and Diffraction

Educational innovation in university levels: Crystallography and X - ray diffraction

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Page 1: Educational innovation in university levels: Crystallography and X - ray diffraction

Seminars

Crystallography and Diffraction

Page 2: Educational innovation in university levels: Crystallography and X - ray diffraction

How atoms are ordered in the lattice?

It is studied by Crystallography

Page 3: Educational innovation in university levels: Crystallography and X - ray diffraction

How atoms are ordered in the lattice?

It is studied by Crystallography

All information needed is included in the

International Tables for Crystallography

Page 4: Educational innovation in university levels: Crystallography and X - ray diffraction

How atoms are ordered in the lattice?

It is studied by Crystallography

Each particular structure can be

described using a given Space Group

All information needed is included in the

International Tables for Crystallography

Page 5: Educational innovation in university levels: Crystallography and X - ray diffraction

How atoms are ordered in the lattice?

It is studied by Crystallography

Each particular structure can be

described using a given Space Group

All information needed is included in the

International Tables for Crystallography

To learn more about Space Groups, see the following Seminars:

Space Group Overview

Space Group Symbol

Getting the Table of Equivalent Positions

Page 6: Educational innovation in university levels: Crystallography and X - ray diffraction

Atoms in 3D-lattices form planes …

Page 7: Educational innovation in university levels: Crystallography and X - ray diffraction

Atoms in 3D-lattices form planes …

- Vertical

Page 8: Educational innovation in university levels: Crystallography and X - ray diffraction

Atoms in 3D-lattices form planes …

- Vertical - Horizontal

Page 9: Educational innovation in university levels: Crystallography and X - ray diffraction

Atoms in 3D-lattices form planes …

- Vertical - Horizontal

- and in many other directions …

Page 10: Educational innovation in university levels: Crystallography and X - ray diffraction

Can we calculate the spacing between planes?

spacing

Atoms in 3D-lattices form planes …

- Vertical - Horizontal

- and in many other directions …

Page 11: Educational innovation in university levels: Crystallography and X - ray diffraction

Can we calculate the spacing between planes?

spacing

Yes, we can.

Atoms in 3D-lattices form planes …

- Vertical - Horizontal

- and in many other directions …

Page 12: Educational innovation in university levels: Crystallography and X - ray diffraction

Can we calculate the spacing between planes?

spacing

Yes, we can.

For orthogonal systems (square

angles, 90°) it is quite easy.

Atoms in 3D-lattices form planes …

- Vertical - Horizontal

- and in many other directions …

Page 13: Educational innovation in university levels: Crystallography and X - ray diffraction

Can we calculate the spacing between planes?

spacing

Yes, we can.

For orthogonal systems (square

angles, 90°) it is quite easy.

To learn about it, see the seminar:

Spacing in Orthogonal Systems

Atoms in 3D-lattices form planes …

- Vertical - Horizontal

- and in many other directions …

Page 14: Educational innovation in university levels: Crystallography and X - ray diffraction

Throwing a

X-ray beam on

Page 15: Educational innovation in university levels: Crystallography and X - ray diffraction

Throwing a

X-ray beam on

… and using

a detector …Detector

Page 16: Educational innovation in university levels: Crystallography and X - ray diffraction

Throwing a

X-ray beam on

… and using

a detector …

Inte

nsi

ty

Position of the detector

… one gets a signal so-called diffractogramDetector B

Page 17: Educational innovation in university levels: Crystallography and X - ray diffraction

Throwing a

X-ray beam on

… and using

a detector …

Inte

nsi

ty

Position of the detector

… one gets a signal so-called diffractogramDetector B

Each peak is assigned to a plane of the lattice

Page 18: Educational innovation in university levels: Crystallography and X - ray diffraction

Throwing a

X-ray beam on

… and using

a detector …

Inte

nsi

ty

Position of the detector

… one gets a signal so-called diffractogramDetector B

Each peak is assigned to a plane of the lattice

If we know the position of the peak,

we can calculate the spacing between planes

Page 19: Educational innovation in university levels: Crystallography and X - ray diffraction

Throwing a

X-ray beam on

… and using

a detector …

Inte

nsi

ty

Position of the detector

… one gets a signal so-called diffractogramDetector B

Each peak is assigned to a plane of the lattice

If we know the position of the peak,

we can calculate the spacing between planes

To learn about it, see the seminar:

Bragg Equation

Page 20: Educational innovation in university levels: Crystallography and X - ray diffraction

Throwing a

X-ray beam on

Inte

nsi

ty

Position of the detector

Detector B

If we know the spacing of all planes,

then we can get the index of the planes,

as well as the centering of the unit cell.

… and using

a detector …… one gets a signal so-called diffractogram

Page 21: Educational innovation in university levels: Crystallography and X - ray diffraction

Inte

nsi

ty

Position of the detector

Detector B

If we know the spacing of all planes,

then we can get the index of the planes,

as well as the centering of the unit cell.

It is easy to do it in the cubic system. To learn about it, see the seminar:

Indexing in the Cubic System

… and using

a detector …… one gets a signal so-called diffractogram

Page 22: Educational innovation in university levels: Crystallography and X - ray diffraction

Inte

nsi

ty

Position of the detector

Detector B

Finally, if we know the width of the peaks,

we can calculate the particle size,

and an average of the defects in the lattice

… and using

a detector …… one gets a signal so-called diffractogram

Page 23: Educational innovation in university levels: Crystallography and X - ray diffraction

Inte

nsi

ty

Position of the detector

Detector B

Finally, if we know the width of the peaks,

we can calculate the particle size,

and an average of the defects in the lattice

Scherrer Equation

It is easy to calculate the particle size. To learn how, see the seminar:

Williamson-Hall Equation

… and using

a detector …… one gets a signal so-called diffractogram

Page 24: Educational innovation in university levels: Crystallography and X - ray diffraction

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