Crystal Symmetry

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PH0101 UNIT 4 LECTURE 3

CRYSTAL SYMMETRY
CENTRE OF SYMMETRY
PLANE OF SYMMETRY
AXES OF SYMMETRY
ABSENCE OF 5 FOLD SYMMETRY

a rotation – inversion AXES


SCREW AXES
GLIDE PLANE
PH 0101 UNIT 4 LECTURE 3 1
CRYSTAL SYMMETRY
Crystals have inherent ‫ متأصل‬symmetry.
The definite ordered arrangement of the faces
and edges of a crystal is known as `crystal
symmetry’.
It is a powerful tool for the study of the internal
structure of crystals.
Crystals possess different symmetries or
symmetry elements.
PH 0101 UNIT 4 LECTURE 3 2
Why Is Symmetry Important?
• Identification of Materials
• Prediction of Atomic Structure
• Relation to Physical Properties
– Optical
– Mechanical
– Electrical and Magnetic

PH 0101 UNIT 4 LECTURE 3 3


CRYSTAL SYMMETRY

What is a symmetry operation ?

A `symmetry operation’ is one, that leaves


the crystal and its environment ‫بيئة‬
invariant.
It is an operation performed on an object or pattern
which brings it to a position which is absolutely
indistinguishable from the old position.
PH 0101 UNIT 4 LECTURE 3 4
CRYSTAL SYMMETRY

The seven crystal systems are characterised by


three symmetry elements. They are

Centre of symmetry

Planes of symmetry

Axes of symmetry.

PH 0101 UNIT 4 LECTURE 3 5


CENTRE OF SYMMETRY

It is a point such that any line drawn through it will


meet the surface of the crystal at equal distances
on either side.
Since centre lies at equal distances from various
symmetrical positions it is also known as `centre
of inversions’..‫مركز االنقالبات‬
It is equivalent to reflection through a point.

PH 0101 UNIT 4 LECTURE 3 6


CENTRE OF SYMMETRY

A Crystal may possess a number of planes or


axes of symmetry but it can have only one centre
of symmetry.
For an unit cell of cubic lattice, the point at the
body centre represents’ the `centre of
symmetry’ and it is shown in the figure.

PH 0101 UNIT 4 LECTURE 3 7


CENTRE OF SYMMETRY

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PLANE OF SYMMETRY

A crystal is said to have a plane of symmetry, when


it is divided by an imaginary plane into two halves,
such that one is the mirror image of the other.

In the case of a cube, there are three planes of


symmetry parallel to the faces of the cube and six
diagonal planes of symmetry

PH 0101 UNIT 4 LECTURE 3 9


PLANE OF SYMMETRY

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AXIS OF SYMMETRY

This is an axis passing through the crystal such that if


the crystal is rotated around it through some angle,
the crystal remains invariant.
The axis is called `n-fold, axis’ if the angle of rotation
is 360 .
n
If equivalent configuration occurs after rotation of
180º, 120º and 90º, the axes of rotation are known as
two-fold, three-fold and four-fold axes of symmetry
respectively.
PH 0101 UNIT 4 LECTURE 3 11
AXIS OF SYMMETRY

If equivalent configuration occurs after rotation of 180º,


120º and 90º, the axes of rotation are known as two-
fold, three-fold and four-fold axes of symmetry .
If a cube is rotated through 90º, about an axis normal to
one of its faces at its mid point, it brings the cube into
self coincident position.
Hence during one complete rotation about this axis, i.e.,
through 360º, at four positions the cube is coincident
with its original position.Such an axis is called four-fold
axes of symmetry or tetrad axis.
PH 0101 UNIT 4 LECTURE 3 12
AXIS OF SYMMETRY

If n=1, the crystal has to be rotated through an angle =


360º, about an axis to achieve self coincidence. Such an
axis is called an `identity axis’. Each crystal possesses an
infinite number of such axes.

If n=2, the crystal has to be rotated through an angle =


180º about an axis to achieve self coincidence. Such an
axis is called a `diad axis’.Since there are 12 such edges in
a cube, the number of diad axes is six.

PH 0101 UNIT 4 LECTURE 3 13


AXIS OF SYMMETRY

If n=3, the crystal has to be rotated through an


angle = 120º about an axis to achieve self
coincidence. Such an axis is called is `triad
axis’. In a cube, the axis passing through a
solid diagonal acts as a triad axis. Since there
are 4 solid diagonals in a cube, the number of
triad axis is four.
If n=4, for every 90º rotation, coincidence is
achieved and the axis is termed `tetrad axis’.
It is discussed already that a cube has `three’
tetrad axes.
PH 0101 UNIT 4 LECTURE 3 14
AXIS OF SYMMETRY

If n=6, the corresponding angle of rotation is


60º and the axis of rotation is called a hexad
axis. A cubic crystal does not possess any
hexad axis.

Crystalline solids do not show 5-fold axis of


symmetry or any other symmetry axis higher
than `six’, Identical repetition of an unit can take
place only when we consider 1,2,3,4 and 6 fold
axes.
PH 0101 UNIT 4 LECTURE 3 15
SYMMETRICAL AXES OF CUBE

PH 0101 UNIT 4 LECTURE 3 16


SYMMETRICAL ELEMENTS OF CUBE

(a) Centre of symmetry 1


(b) Planes of symmetry 9
(Straight planes -3,Diagonal planes -6)
(c) Diad axes 6
(d) Triad axes 4
(e) Tetrad axes 3
----
Total number of symmetry elements = 23
----
Thus the total number of symmetry elements of a cubic structure is
23.
PH 0101 UNIT 4 LECTURE 3 17
ABSENCE OF 5 FOLD SYMMETRY

We have seen earlier that the crystalline solids show only


1,2,3,4 and 6-fold axes of symmetry and not 5-fold axis of
symmetry or symmetry axis higher than 6.
The reason is that, a crystal is a one in which the atoms or
molecules are internally arranged in a very regular and
periodic fashion in a three dimensional pattern, and
identical repetition of an unit cell can take place only
when we consider 1,2,3,4 and 6-fold axes.

PH 0101 UNIT 4 LECTURE 3 18


MATHEMATICAL VERIFICATION

Let us consider a lattice P Q R S as shown in figure

 

P Q R S

a a a
PH 0101 UNIT 4 LECTURE 3 19
MATHEMATICAL VERIFICATION

Let this lattice has n-fold axis of symmetry and the


lattice parameter be equal to ‘a’.
Let us rotate the vectors Q P and R S through an
360o
angle  = , in the clockwise and anti clockwise
n
directions respectively.
After rotation the ends of the vectors be at x and y.
Since the lattice PQRS has n-fold axis of symmetry,
the points x and y should be the lattice points.

PH 0101 UNIT 4 LECTURE 3 20


MATHEMATICAL VERIFICATION

Further the line xy should be parallel to the line PQRS.


Therefore the distance xy must equal to some integral
multiple of the lattice parameter ‘a’ say, m a.
i.e., xy = a + 2a cos  = ma (1)

Here, m = 0, 1, 2, 3, ..................

From equation (1),

2a cos  = m a – a

PH 0101 UNIT 4 LECTURE 3 21


MATHEMATICAL VERIFICATION

i.e., 2a cos  = a (m - 1)

(or) cos  = m −1 N (2)


=
2 2
Here,
N = 0, 1, 2, 3, .....

since (m-1) is also an integer, say N.


We can determine the values of  which are allowed
in a lattice by solving the equation (2) for all values
of N.
PH 0101 UNIT 4 LECTURE 3 22
MATHEMATICAL VERIFICATION

For example, if N = 0, cos  = 0 i.e.,  = 90o


 n = 4.
In a similar way, we can get four more rotation axes
in a lattice, i.e., n = 1, n = 2, n = 3, and n = 6.
Since the allowed values of cos  have the limits –1
to +1, the solutions of the equation (2) are not
possible for N > 2.
Therefore only 1, 2, 3, 4 and 6 fold symmetry axes
can exist in a lattice.
PH 0101 UNIT 4 LECTURE 3 23
ROTATION AXES ALLOWED IN A
LATTICE
 3600 
N N/2 cos  (degrees) n=  
  
-2 -1 -1 180 2
-1 -1/2 -1/2 120 3
0 0 0 90 4
+1 +1/2 +1/2 60 6
+2 +1 +1 360 (or) 0 1

PH 0101 UNIT 4 LECTURE 3 24


ROTO INVERSION AXES

Rotation inversion axis is a symmetry element which


has a compound operation of a proper rotation and
an inversion.
A crystal structure is said to possess a rotation –
inversion axis if it is brought into self coincidence by
rotation followed by an inversion about a lattice point
through which the rotation axis passes.

PH 0101 UNIT 4 LECTURE 3 25


ROTO INVERSION AXES

X1

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ROTO INVERSION AXES

Let us consider an axis xx, normal to the circle passing


through the centre.
Let it operates on a point (1) to rotate it through 90o to the
position (4) followed by inversion to the position (2), this
compound operation is then repeated until the original
position is again reached.

PH 0101 UNIT 4 LECTURE 3 27


ROTO INVERSION AXES

Thus, from position (2), the point is rotated a further 90o


and inverted to the position (3); from position (3), the point
is rotated a further 90o and inverted to a position (4); from
position (4), the point is rotated a further 90o and inverted
to resume position (1).
Thus if we do this compound operation about a point four
times, it will get the original position. This is an example
for 4-fold roto inversion axis. Crystals possess 1,2,3,4
and 6-fold rotation inversion axes.
PH 0101 UNIT 4 LECTURE 3 28
TRANSLATIONAL SYMMETRY
SCREW AXES
This symmetry element has a compound operation of
a proper rotation with a translation parallel to the
rotation axis
This is shown in the figure.In this operation, a rotation
takes place from A to B by an amount of  and it
combines with a translation from B to C by an amount
of T, which is equivalent to a screw motion from A to C.
The symmetry element that corresponds to such a
motion is called a screw axis.

PH 0101 UNIT 4 LECTURE 3 29


TRANSLATIONAL SYMMETRY
SCREW AXES

θ
A
B

PH 0101 UNIT 4 LECTURE 3 30


TRANSLATIONAL SYMMETRY
GLIDE PLANE
This symmetry element also has a compound
operation of a reflection with a translation parallel
to the reflection plane.
Figure shows the operation of a glide plane
If the upper layer of atoms is moved through a
distance of a/2, and then reflected in the plane
mm1, the lower plane of atoms is generated.

PH 0101 UNIT 4 LECTURE 3 31


TRANSLATIONAL SYMMETRY
GLIDE PLANE

m m1

a/2

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COMBINATION OF SYMMETRY
ELEMENTS

Apart from the different symmetry elements different


combinations of the basic symmetry elements are also
possible.
They give rise to different symmetry points in the
crystal.

The combination of symmetry elements at a point is


called a `point group’.

PH 0101 UNIT 4 LECTURE 3 33


COMBINATION OF SYMMETRY
ELEMENTS

In crystals, 32 point groups are possible.

The combination of 32 point groups with 14


Bravais lattices lead to 230 unique
arrangements of points in space.

They are called as `space groups’.

PH 0101 UNIT 4 LECTURE 3 34


Physics is hopefully simple but Physicists are not

PH 0101 UNIT 4 LECTURE 3 35


• For this class, to recognize symmetry, you
need to be able to recognize mirror
planes (m); rotation axes (A2, A3, A4,
A6); and a center of symmetry (i).
Mirror planes are planes of reflection. A
rotation axis is an imaginary line whereby
a motif can be rotated two, three, four or
six times. A center of symmetry exists,
when a face, edge or point on a solid can
be projected PH 0101 UNIT 4 LECTURE 3 36
• through the center of the solid and appear
on the other side in a reversed position. In
the classroom I use three blocks: an
octahedron, a rhombohedron and a
tetrahedron to illustrate these symmetry
elements. Using these blocks we talk
about how to recognize mirror planes and
how to count the number found in a model.

PH 0101 UNIT 4 LECTURE 3 37


• There are 9, for example in an octahedron,
6 in the tetrahedron and 3 in the
rhombohedron. We also look at rotation
axes and students find 4-fold, 3-fold, 2-fold
and bar 4-fold (roto-inversion). In terms of
centers of symmetry, an octahedron and a
rhombohedron have a center, a
tetrahedron does not.

PH 0101 UNIT 4 LECTURE 3 38


PH 0101 UNIT 4 LECTURE 3 39

• For this class, to recognize symmetry, you
need to be able to recognize mirror
planes (m); rotation axes (A2, A3, A4,
A6); and a center of symmetry (i).
Mirror planes are planes of reflection. A
rotation axis is an imaginary line whereby
a motif can be rotated two, three, four or
six times. A center of symmetry exists,
PH 0101 UNIT 4 LECTURE 3 40
• when a face, edge or point on a solid can
be projected through the center of the
solid and appear on the other side in a
reversed position. In the classroom I use
three blocks: an octahedron, a
rhombohedron and a tetrahedron to
illustrate these symmetry elements. Using
these blocks we talk about how to
recognize mirror planes and how to count
PH 0101 UNIT 4 LECTURE 3 41
• the number found in a model. There are
9, for example in an octahedron, 6 in the
tetrahedron and 3 in the rhombohedron.
We also look at rotation axes and students
find 4-fold, 3-fold, 2-fold and bar 4-fold
(roto-inversion). In terms of centers of
symmetry, an octahedron and a
rhombohedron have a center, a
tetrahedron does not.
• Octohedron Rhombohedron
Tetrahedron
PH 0101 UNIT 4 LECTURE 3 42

There are six 6 crystal systems which can
be defined either on the basis of
symmetry, or, upon the basic building
block of the crystal. These are isometric;
tetragonal; orthorhombic; monoclinic;
triclinic; and hexagonal. A1, A2, and
A3 are used to define the isometric
system, but a, b, c are used for the more
general case. The angle between a and b
is g; between a and c is b; and between b
and c is a.
PH 0101 UNIT 4 LECTURE 3 43
• The building block, which makes up an
individual system, is known as the unit
cell:

• In most lattices the 3 shortest non-
coplanar periods are used to define the
primitive unit cell of the lattice. In general
the angle between any pair of lattice rows
will not necessarily be 90 degrees.
PH 0101 UNIT 4 LECTURE 3 44

• A crystal is a solid body bounded by
plane natural surfaces, which are the
external expression of a regular internal
arrangement of constituent atoms or ions.
The term crystal is the Anglicized Greek
word for ice and was generally employed
throughout the Middle Ages to designate
rock-crystal or quartz.

• PH 0101 UNIT 4 LECTURE 3 45
• Ahmed hamed ahmed

PH 0101 UNIT 4 LECTURE 3 46

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