Physics Unit I Part I Notes
Physics Unit I Part I Notes
Crystallography
(Outcomes: Explain the properties of crystal structure and apply them in
crystallography using X-ray diffraction techniques)
Introduction:
Solid: Solid is one of the three main states of matter, in which the particles
(atoms or molecules or ions) are closely packed together and are not free to
move.
On the basis of arrangement of constituent particles solids are divided into,
1. Crystalline solids
2. Amorphous(non-crystalline)solids
Crystalline Solids:
If the atoms or molecules in a solid are arranged in some regular fashion, then
the solid is known as crystalline solid.
In a crystalline solid, each atom or molecule is fixed at a definite point in space
at a definite distance and in a definite angular orientation to other atoms or
molecules surrounding it. The crystalline state of solid is characterized by regular
and periodic arrangement of atoms or molecules.
Figure 3.Crystalstructure
Crystal systems:
The vectors a , b, c (axial lengths vectors) may or may not be equal. Also the
interfacial angles α, β and γ may or may not be right angles.
Based on these conditions, there are seven crystal systems. All these
crystal systems are divided to 7 groups or basic systems. The seven basic crystal
systems are distinguished from one another by the angles between the three
axes and the intercepts of the faces along them.
On the basis of the length and directions of the axes of the symmetry all the
crystals may be classified into following seven systems.
The basic crystal systems are 1) Cubic, 2) Tetragonal, 3) Orthorhombic, 4)
Rhombohedral (or) Trigonal, 5) Hexagonal, 6) Monoclinic, and 7) Triclinic.
1. Cubic crystal: In this crystal, all the three axial lengths of the unit cell are
equal and the three axes are mutually perpendicular to each other. I.e.,
a=b=c & α=β=γ=90°.
Examples: NaCl, CaF, Diamond, Cu, etc.
2. Tetragonal crystal: In this crystal, two axial lengths of the unit cell are
equal while the third one is longer and the three axes are mutually
P:Primitive,I:BodycenteredF:FacecenteredC:Basecentered.
Bravais Lattices:
In the year of 1948, Bravais showed that there are only fourteen independent
ways of arranging the points in three dimensional space such that each
arrangement confirms to the definition of space lattice. So, there are 14
lattices are sufficient to describe all the crystals.
Definition: There are fourteen different ways of arranging the points in three
dimensional space such that each point has identical surrounding. These 14
space lattices are known as Bravais lattices.
Simple or Primitive (P): If the atoms are placed only at the corner of the
unit cell (cube) then it is called primitive and is denoted by ‘P.
Body centered (I): If the atoms are placed at the corners of the unit cell
(cube) and the center of the unit cell (where body diagonals intersect)
then it is said to be body centered and is denoted by ‘I’.
Face Centered (F): If the atoms are placed at the corners of the unit cell
(cube)and the center of their faces then it is said to be Face centered
and is denoted by ‘F’.
Base centered (C): If the atoms are placed at the corners of the unit cell
(cube) and the center of the two bases of the unit cell (cube) then it is
Fig.8Typesofunitcells
1. Cubic crystal structure: (P, I, F)
In this crystal structure, there exists three (3) lattices and they are: Simple or
Primitive (P), Body centered (I), and Face centered (F).
2. Tetragonal crystal structure:(P, I)
In this crystal structure, there are only two (2) lattices exists and they are:
Simple or Primitive (P), and Body centered (I).
3. Orthorhombic crystal structure:(P, I, F, C)
In this crystal structure, there are only four (4) lattices exists and they are:
Simple or Primitive cubic (P), Body centered cubic (I), Face centered
cubic (F) and Base centered (C).
4. Rhombohedral or Trigonal crystal structure:(P)
In this crystal structure, there is only one (1) lattice exists and that is Simple
or Primitive (P).
5. Hexagonal crystal structure:(P)
In this crystal structure, there is only one (1) lattice exists and that is Simple
or Primitive (P).
6. Monoclinic crystal structure:(P, I)
In this crystal structure, there are only two (2) lattices exists and they are:
Simple or Primitive (P), and Body centered (I).
7. Triclinic crystal structure:(P)
In this crystal structure, there is only one (1) lattice exists and that is Simple
or Primitive (P).
The fourteen Bravais lattices are shown below:
Lattice Planes:
The crystal lattices may be considered as made up of an aggregate of set of
equidistant parallel planes passing through lattice points which are known as
lattice planes. For a given lattice, the lattice planes can be chosen in different
ways as shown in the figure below. These planes are known as crystallographic
planes or atomic planes.
Example 1:
1. The plane cuts X- axis at ‘1a’ distance, Y-axis at ‘∞’ and Z-axis at ‘∞’.
2. Expressing these intercepts in terms of lattice parameters (1a, ∞b, ∞C) and
the intercepts are (1, ∞, ∞).
1 1 1
3. Reciprocals of the above intercepts ( 1 , ∞ , ∞ ) i.e. (1, 0, 0).
4. Reduce the reciprocals of intercepts into smallest integers it is noted that
here the reciprocals of the intercepts already smallest whole numbers.
Hence, the smallest numbers are (1, 0, 0).
5. Write these smallest numbers in parenthesis i.e. (1 0 0) and these are the
miller indices.
Fig. (a) BCGF plane with miller indices (100) (b) ADGF plane with miller indices
(101), and (c) AHF plane with miller indices (111).
2. Different crystal planes with miller indices:
1
Fig: (112) plane with intercepts of (1, 1, 2 ) on coordinate axes.
2. (120):
Given miller indices (h k l) = (120)
1 1 0 1
Reciprocals of miller indices = ( 1 , 2 , 1 ) = (1, 2 , ∞)
1
Now the intercepts are (1, 2 , ∞)
The above intercepts are marked on three crystallographic axes and
joining them then the (120) plane is formed/drawn.
1
Fig: (120) plane with intercepts of (1, 2
, ∞)on coordinate axes.
Inter-planar spacing:
The separation between successive lattice planes is known as inter-planar
spacing. It is defined as spacing between a plane (h k l) and other parallel
plane passing through the origin. The inter-planar spacing is denoted by dhkl. The
inter-planar distance for cube, tetragonal and orthorhombic crystals for which
α=β=γ=90° can be calculated by the following formula, dhkl=
1
Special Cases:
(i) Cubic system: for Cubic system, a= b= c then, dhkl= 𝐡
𝟏
𝐤 𝒍
√( )𝟐+( )𝟐 +( )𝟐
𝐚 𝐚 𝐚
Therefore,𝑑 = √ 𝑎
ℎ2 +𝑘2+𝑙2
(ii) Tetragonal system: for tetragonal system, a=b≠c then, dhkl= 𝐡+𝐤 𝟐
𝟏
𝒍
√( ) + ( )𝟐
𝐚 𝐜
Fig. (a)
Fig. (b)
Fig. (c)
Fig. Powder method (a) Experimental arrangement (b) Reflection of X ray from
the crystal plane, and (c) Reflection ray pattern on the photographic film.
The film is removed from the camera, processed and flattened. It shows the
diffraction lines and the holes for the incident and transmitted beams. The
distance between two successive arcs “S” is measured and using the relation,
S 180
4θ = ( ), Where ‘R’ is the radius of the camera. A list of θ values can be
R π
obtained. Since the wavelength λ is known, substituting these θ values in Bragg’s
formula, a list of inter-planar spacing ‘d’ can be calculated. Each spacing is the
distance between neighboring planes (hkl). From the ratio of inter-planar
spacing, the type of the lattice can be identified as well as lattice parameter is