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Phys 460 Lecture 8
(
pdf version - 6 slides/page
)
Wednesday, September 20, 2006
Lecturer: Richard Martin
Homework 4
Reading:
Kittel, Chapt. 4
Vibrations of atoms in crystals
Outline
From previous lectures:
Typical Crystal Structures
Diffraction, Fourier Analysis, and the Reciprocal Lattice
Crystal binding, elastic waves
Why are vibrations important?
Atoms vibrate because of
Thermal motion
Quantum motion - uncertainty principle - even at T=0
Illustrates key idea of solid state physics
Importance of Brillouin Zone
Transformation from classical vibrations to quantized particles of vibration
We will consider simple examples to show the effects
Displacements of atoms and harmonic forces
Define vector displacement DeltaR
n
= u
n
for each atom n (use interger n to avoid confusion with the imaginary number i)
Energy increases quadratically E = E
0
+ (1/2)Sum
nj
u
n
D
nj
u
j
Force on atom n = F
n
= - dE/dR
i
= Sum
j
D
nj
u
j
D's are called "Force Constants"
Example : Central Forces
Energy per cell = E = (1/2N)Sum
nj
phi(|R
n
- R
n+j
|)
To second order E = E
0
+ (1/4)Sum
nj
phi
j
'' |u
n
- u
n+j
|
2
,
phi
j
'' = phi''(|R
n
- R
n+j
|) = second derivative of phi evaluated at |R
n
- R
n+j
|
Force = F
n
= Sum
j
phi
j
'' (u
n
- u
n+j
)
Linear chain: R
n
= na - all motion u
n
is along a line
Assume nearest neighbor forces only:
j = +1 and j = -1 and phi
1
'' = phi
-1
'' = phi''
F
n
= phi'' Sum
j
(u
n+1
- u
n
) = phi'' (u
n+1
+ u
n-1
- 2u
n
)
Like springs: F
n
= K (u
n+1
+ u
n-1
- 2u
n
)
Solution: u
n
(t) = exp(ik(na) - i omega t)
Leads to: M omega
2
= phi'' [exp(ika) + exp(-ika) - 2]
and omega
2
= (phi''/M) [cos(ka) - 2] = (phi''/ M) sin
2
(ka/2)
Role of Brillouin Zone
Vibrations completely described by k inside BZ
Periodic for k outside BZ
Vibration is identical (not independent) for k and k+G where G is any recip. lattice vector
Simplest example in higher dimensions - simple cubic with central forces
Longitudinal motion - same as linear chain
Transverse - unstable with only nearest-neighbor central forces
Stable with second-nearest-neighbor central forces
Crystals with central forces actually occur in close packed structures or with long range forces, e.g., Coulomb
Longitudinal and transverse modes of close packed structures stable with only nearest-neighbor central forces
Homework example
Email clarification questions and corrections to
rmartin@uiuc.edu
Email questions on solving problems to
xin2@.uiuc.edu