Thomas Ihn
Semiconductor Nanostructures
Fall 2017
Exercise sheet 2 handed out: 27.09.2016
Topics: graphene band structure, free electron model discussed: 04.10.2016
Problem 1: Graphene Band Structure
20
y zig-zag edge
10
armchair edge
A
energy (eV)
a2
t1 a π∗
t2 1
B t3 0
-10
K Γ M K
x wave vector
(a) graphene lattice (b) graphene bandstruc- (c) first Brillouin zone
ture
In this problem we try to approximate the π-band dispersion relation of graphene
(Fig. 1b). We describe the hexagonal two-dimensional crystal lattice (Fig. 1a) as a
Bravais lattice with the two basis vectors
√ √ −1/2
1/2
~a1 = 3a0 √ and ~a2 = 3a0 √ ,
3/2 3/2
where a0 ≈ 0.142 nm is the distance between nearest neighbor atoms. The primitive
cell spanned by these two vectors contains the basis of the lattice consisting of the two
atoms A and B.
1. Determine the basis vectors of the reciprocal lattice and construct the first Brillouin
zone (BZ). Show that the first Brillouin zone has the form depicted in Fig. 1c.
2. Consider the model of free electrons with the dispersion at the reciprocal lattice
position ~k given by
h̄2 (~k − G
~ 0 )2
En (~k) = ,
2m
where G ~ 0 is any reciprocal lattice vector (e.g. A, B, ... G) . Draw the energy
dispersions along Γ → K and along Γ → M by considering contributions from the
two sets of shortest reciprocal lattice vectors. Compare your drawing to Fig. 1b.
3. Consider the lowest doubly degenerate states at the M -point on the boundary of
the first BZ. Calculate the splitting of these degenerate states under the influence
of a small potential modulation.
4. Find reasons why the periodic potential modulation leaves a two-fold degeneracy
at the lowest K-point energy. Hint: think about the magnitude of the matrix
elements, and about the role of the structure factor in graphene.