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Roll # : M.Phil-SSP-03-F-19
Subject: X-Ray Diffraction(SSP 512)
Submitted To: Dr. Shahid Atiq Sb
Basis And Lattice Points
A lattice Point is a hypothetical regular and periodic
arrangement of points in space. All the points have the
same surrounding in the same orientation
It is used to describe the structure of crystal.
A basis is a atom or group of atoms associated with each
lattice point in crystal.
lattice + basis = crystal
Lattice types in 2D
There are 5 lattice types in 2-D.
Oblique
Rectangular
Centered Rectangular
Hexagonal
Square
Lattice types in 3D
There are 7 lattice types in 3-D
The first five decreasing in symmetry.
Start with cube at the top and distorting progressively
The other two don’t fit into sequence of decreasing
Symmetry.
Rhombohedral formed by cube stretched or
Compressed along diagonal
Planes and Directions
Planes are determined by Miller indices (hkl)
In cubic system (100) means 3 sets (100(010)(001)
[uvw] with square brackets indicates one direction
through the lattice
<uvw> indicates [uvw] and all the similar direction which
are related by symmetry
In cubic system <100> means six directions
Miller’s and Weber’s indices
Planes
are known by their Miller indices (h k l) and directions (u,v,w)
Find the intercepts of plane along three crystallographic axes
Take reciprocal of these intercepts
If fractions, remove these fractions by multiplying with a suitable numbers
Enclose the resultant set of numbers in small brackets, i.e. ( )
These are required hkl values of required plane
(hkl) means a set of parallel planes
means all the set of planes
[uvw] describe the direction of planes
Direction of hexagonal lattice is given by weber indices [uvjw]
J= -(u+v)
Zone of planes
A
group of Planes with a common line of intersection is called a Zone of planes.
The line of intersection is the zone axis
Three sets of planes (), () and () belong to one zone if the determinant is zero.
The planes (111),(110) and (11) belong to one zone because their determinant is zero.
Atomic/fractional Coordinates
A crystal structure is described by fractional coordinates xyz of each
atom in the unit cell.
Fractional coordinates of Cu structure
Kα1: 0.709 Å
Kα2 : 0.710 Å
Kβ1 : 0.632 Å
Absorption of X-rays
Interaction of X-rays with matter results in partial transmission and
partial absorption ((Photoelectric effect and Compton effect)
Long wavelengths are easily absorbed (soft X rays)
Short wavelengths are highly penetrating (hard rays )
Intensity I of an X-ray beam decreases as it passes through any
homogeneous medium and is proportional to the distance
traversed x. This is given by
proportionality constant µ is called the linear
absorption coefficient
Filters
Filters are used to block or reduce the intensity of Kβ
Filter is made of material whose K absorption edge lies between Kα and Kβ
X-ray diffraction requires monochromatic radiation
Filtration is never perfect
Detection Of X-Rays
Fluorescent screens (ZnS with trace of Ni)
Photographic Film
Geiger Counter, Proportional Counter,
Scintillation detector
Coherent and Incoherent scattering
Scattering occurs when an X-ray photon interacts with one of
the electrons of the absorbing element. If this collision is elastic
(no energy is lost in the collision process), the scattering is said
to be coherent
If this collision is inelastic (energy is lost in the collision
process), the scattering is said to be Incoherent