Assignment - 1 - Crystallography I - Solutions
Assignment - 1 - Crystallography I - Solutions
Assignment - 1
1. Find the lattice and basis vectors for graphene which is a two-dimensional crystal
made out of carbon atoms as shown below.
Solution:
In the above figure we a have a graphene crystal structure. Now, the lattice vectors are,
√3 1 √3 1
𝑎
⃗⃗⃗⃗1 = √3 𝑎𝐶𝐶 ( , ) 𝑎𝑛𝑑 ⃗⃗⃗⃗
𝑎2 = √3 𝑎𝐶𝐶 ( , − )
2 2 2 2
1 √3
⃗⃗⃗⃗⃗
𝑎′1 = 𝑎𝐶𝐶 ( , )
2 2
Here, length of 𝐴′ 𝐵 ′,
𝜋
= 𝑎 + 2𝑎 sin 𝛼 = 𝑎 + 2𝑎 sin (𝜃 − ) = 𝑎 − 2𝑎 cos 𝜃
2
It will satisfy the rotation symmetry if this length is multiplication of some integer m. So,
𝑚𝑎 = 𝑎 − 2𝑎 cos 𝜃
The integer m can take values 1, 2, 3, 4 and 6 but can not take the value 5. For 𝑚 = 5, we
get, cos 𝜃 = −2 which is not possible as | cos 𝜃 | = 1.
3. Express the primitive lattice vectors for a face centered cubic lattice.
On left side we have an FCC unit cell and on the right side a shaded region which is its
primitive unit cell. So, for the primitive lattice vectors are,
𝑎
𝑎
⃗⃗⃗⃗1 =(𝑖̂ + 𝑘̂ ),
2
𝑎
𝑎2 = (𝑗̂ + 𝑘̂ ),
⃗⃗⃗⃗
2
𝑎
𝑎3 =
⃗⃗⃗⃗ (𝑖̂ + 𝑗̂) ,
2
And 𝛼 = 𝛽 = 𝛾 = 60°.
Identify the Bravais lattice type and write the lattice and basis vectors.
Solution: CsCl is made of two interpenetrating simple cubic lattices where one type of ion
sits at the center of another type.
The lattice vectors are,
𝑎
⃗⃗⃗⃗1 = 𝑎𝑖̂, 𝑎2 = 𝑎𝑗̂
⃗⃗⃗⃗ 𝑎𝑛𝑑 𝑎3 = 𝑎𝑘̂
⃗⃗⃗⃗
And basis vector is,
𝑎
⃗⃗⃗⃗⃗
𝑎′1 = (𝑖̂ + 𝑗̂ + 𝑘̂ ).
2