Symmetry, Groups and Crystal Structures The Seven Crystal Systems.
Lecture 4 - Crystal Systems
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Transcript of Lecture 4 - Crystal Systems
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Chapter 3
CRYSTAL SYSTEMS
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Unit Cell (Lattice) Parameters
a, b, c are the
edge lengths
, , are the
inter-axial angles
Seven different
combinations of
edge lengths andinter axial angles
Distinct Crystal
System
x
y
z
a
b
c
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Seven Crystal Systems
1
2
3
4
5
6
73
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1. Cubic Crystals
x
y
z
a
b
c
Unit Cell Parameters
a = b = c
= = = 90o
Halite (a form of NaCl)
http://en.wikipedia.org/wiki/Image:Cubic_crystal_shape.png -
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2. Hexagonal Crystals
x
y
z
a
b
c
Unit Cell Parameters
Calcite
a = b c
= = 90o, = 120o
http://mineral.galleries.com/minerals/carbonat/calcite/calcite.htmhttp://en.wikipedia.org/wiki/Image:Hexagonal.png -
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3. Tetragonal Crystals
x
y
z
a
b
c
Unit Cell Parameters
a = b c
= = = 90o
Ruby Hematite
http://en.wikipedia.org/wiki/Image:Tetragonal.png -
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4. Rhombohedral (Trigonal)
Crystals
x
y
z
a
b
c
Unit Cell Parameters
a = b c
Quartz
= = 90o
http://en.wikipedia.org/wiki/Image:Rhombohedral.png -
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5. Orthorhombic Crystals
x
y
z
a
b
c
Unit Cell Parameters
BariteTopaz
= = = 90oa b c
http://en.wikipedia.org/wiki/Image:Orthorhombic.png -
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6. Monoclinic Crystals
x
y
z
a
b
c
Unit Cell Parameters
Gypsum Muscovite
a b c
= = 90o
http://mineral.galleries.com/minerals/silicate/muscovit/mus-17.jpghttp://mineral.galleries.com/minerals/sulfates/gypsum/gypsum.htm -
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7. Triclinic Crystals
x
y
z
a
b
c
Unit Cell Parameters
Oligoclase
(Na-Ca-Al Silicate)
Kyanite
(Al Silicate)
a b c
http://en.wikipedia.org/wiki/Image:Triclinic.png -
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Crystallographic Points,
Directions, Planes
Needs either a point within the unit cell, acrystallographic direction or a
crystallographic plane of atoms to describe
the crystal
Becomes more important when the co-
ordinate axes are not perpendicular to each
other
HexagonalRhombohedral
Monoclinic
Triclinic
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Crystallographic Points
(point coordinates)
Point P (q,r,s) (q,r,s) 1
q corrsponds to
distance qa
rcorresponds to
distance rb
s corresponds to
distance sc
x
y
z
a
b
cP (q,r,s)
qa
rb
sc
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Crystallographic Points
Find Point P (, 1, ) Substitute q = , r = 1,
and s =
x
y
z
a
b
cP (, 1, )
a
1b
c
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Crystallographic Directions
A line between two points, or a vector.1. Draw a vector that passes through the origin of the
co-ordinate system
2. Determine the length of the vector projection on
three axesmeasured in terms of unit celldimensions a, b, c
3. Reduce them to smallest integer values
4. Represent as [uvw] no commas.
u, v, w correspond to reduced projections along x, y, z
axes
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Example for direction [uvw]
Step 1: A vector is positioned such that it passesthrough the origin of the coordinate system
X
Y
Z
What are the indices for theVector shown?
0.4 nm
0.5 nm
0.3 nm
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Example for direction [uvw]
Step 2: Lengths of the vector projection on each of thethree axes are determined; these are indicated in
terms of unit cell dimensions a,b,c
X
Y
Z
0.4 nm
0.5 nm
0.3 nm
Projections
X Y Z
0a 0.5b 0.5c
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Example for direction [uvw]
Step 3: These projections are multiplied to reducethem to the smallest integer value
X
Y
Z
0.4 nm
0.5 nm
0.3 nm
Projections
X Y Z
0a 0.5b 0.5c
0 0.5 0.5Reduction
0 1 1Reduction
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Example for direction [uvw]
Step 4: The reduced integers are enclosed in squarebrackets without comma
X
Y
Z
0.4 nm
0.5 nm
0.3 nm
Projections
X Y Z
0a 0.5b 0.5c
0 0.5 0.5Reduction
0 1 1Reduction
[011]
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Example for direction [uvw]
Negative directions get a hat
X
Y
Z
0.4 nm
0.5 nm
0.3 nm
Projections
X Y Z
0a 0.5b 0.5c
0 0.5 0.5Reduction
0 1 1Reduction
[011]
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Example for direction [uvw]
Negative directions get a hat
X
Y
Z
0.4 nm
0.5 nm
0.3 nm
Projections
X Y Z
0a 0.5b 0.5c
0 0.5 0.5Reduction
0 1 1Reduction
[011]
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Indices for the Direction
1. Take the projection on the X-axis: a/2
2. Take the projection on the Y-axis: b
3. Take the projection on the Z-axis: 0c
b
c
a
x
y
z
Reduce them into smallest integers
[ 1 0] or [1 2 0] ?
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Crystallographic Planes
In all crystal structuresother than hexagonal,
crystallographic planes
are specified by three
Miller Indices(hkl)
Any two planes parallel
to each other are
equivalent and have
identical indices
The unit cell system is
the basis
x
y
z
a
b
c
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23
Crystallographic Planes
Adapted from Fig. 3.26,
Callister & Rethwisch 4e.
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Determining h,k,l
1. If the plane passes through selected origin,select another origin
2. Read off intercepts of plane with axes interms ofa, b, c
3. Take the reciprocals of these numbers
A plane that parallels an axis has infinite intercept
hence zero index
4. Reduce to set ofsmallest integers5. Represent as (hkl)
An intercept on the negative side denoted with a
bar on the top of the index
D t i Mill I di f th
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Determine Miller Indices for the
Plane
b
c
a
x
y
z
c/2
x
Step 1: Redefine Origin
b
c
ay
z
c/2y
z
x
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Determine Miller Indices for the
Plane
Step 2: Determine the plane intercepts
x b
c
a y
z
c/2y
z
x
x y z
Intercepts inf a -b c/2
Intercepts
(Lattice par.) inf -1 1/2
Determine Miller Indices for the
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Determine Miller Indices for the
Plane
Step 3: Determine the reciprocals
x b
c
a y
z
c/2y
z
x
x y z
Reciprocals 0 -1 2
Step 4: Reduction to integersnot needed
Step 5: (012)
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Miller Indices for the Plane
x
y
z
O
O
z
x
-b
c/2
1. Plane parallel to X-axis is a, intercept
is , index is 0
2. Intercept along Y-axis isb,
intercept is -1, index is -1
3. Intercept along Z-axis is c/2,
intercept is , index is 2
Miller Indices for this plane : [012]
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Miller Indices for the Plane
z
y
x
1. Plane parallel to X-axis is a, interceptis , index is 0
2. Intercept along Y-axis is b/2,intercept is 1/2, index is 2
3. Plane parallel to Z-axis is c, interceptis , index is 0
Miller Indices :
(020)
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Constructing a Plane (011)
0 indicates that the
plane is parallel to X-
axis
-1 indicates that the
intercept along Y axisisb
1 indicates that the
intercept along Z axis
is cx
y
z
a
b
c
-b
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Constructing a (110) Plane
1 indicates that theintercept along X-axisis a
1 indicates that the
intercept along Y axisis b
0 indicates that theplane is parallel to
the Z-axis
x
y
z