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Physics PY4118Physics of Semiconductor Devices
Introduction
1.1Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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Department of Physics
PY4118 Physics of Semiconductor Devices
Book of Modules:� Module Objective: To introduce students to the physics of
semiconductors and semiconductor devices.
� Module Content: Topics in quantum mechanics and solid state physics as applied to electronic components such as diodes, transistors and optoelectronic devices. Specific topics include crystal lattice structure, charge carrier generation and recombination, mobility. Semiconductor PN junction characteristics are covered and applied to diodes, photo and solar cells, LEDs and semiconductor lasers. Bipolar transistors are also studied, as well as different field-effect transistors.
1.2Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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PY4118 Physics of Semiconductor Devices
Topic 1 – Quantum of Atoms
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PY4118 Physics of Semiconductor Devices
Topic 2 – Hybrid Orbitals
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PY4118 Physics of Semiconductor Devices
Topic 3 – Crystals & Symmetry
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PY4118 Physics of Semiconductor Devices
Topic 4 – Coupled States
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PY4118 Physics of Semiconductor Devices
Topic 5 – Bands
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Arising from many coupled states
PY4118 Physics of Semiconductor Devices
Topic 6 – Band Filling
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Topic 7 – Electrons and Holes
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Topic 8 – Carrier Motion
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Topic 9 – Generation & Recombination
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PY4118 Physics of Semiconductor Devices
Topic 10 – Continuity Equation
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Gdx
ndD
dx
dFn
dx
dnF
nn
dt
dn p
npn
p
n
n
ppp ++++−
−=2
2
0 µµτ
Gdx
pdD
dx
dFp
dx
dpF
pp
dt
dp npnp
np
p
nnn ++−−−
−=2
2
0 µµτ
What equations govern the way charges flow?
PY4118 Physics of Semiconductor Devices
Topic 11 – The Diode
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PY4118 Physics of Semiconductor Devices
Topic 12 – Metals with Semiconductors
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cE
vE
VACE
FEFEmetal
n-doped
VACEmqφ
sqφBqφ
smbi qqqV φφ −=
biqV
biqV
PY4118 Physics of Semiconductor Devices
Topic 13 – Transistors
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S G D
Source Gate Drain
n-channeln+ n+
Semi-insulating
PY4118 Physics of Semiconductor Devices
Topic 14 – Heterostructures
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Topic 15 – Processing?
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Physics PY4118Physics of Semiconductor Devices
The Hydrogen Atom
1.18Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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PY4118 Physics of Semiconductor Devices
The Hydrogen Atom� We will start with the quantum mechanical
description of the hydrogen atom
� This will be used to explain a great deal of how semiconductors form
� We start with the 3D Schrödinger equation
1.19Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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3D Schrödinger equation
( ) 02
22
2
2
2
2
2
=−+∂∂
+∂∂
+∂∂
ψψψψ
VEm
zyx h
04
2
sin
1
sinsin
11
0
2
22
2
22
2
2
2
=
++
∂∂
+
∂∂
∂∂
+
∂∂
∂∂
ψπεφ
ψθ
θψ
θθθ
ψ
r
eE
m
r
rrr
rr
h
r
eV
0
2
4πε−=
1.20Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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Spherical coordinates
PY4118 Physics of Semiconductor Devices
H Atom: separation of variables
04
sin2
sinsinsin
0
2
2
22
2
2
22
=
++
∂∂
+
∂∂
∂∂
+
∂∂
∂∂
ψπε
θφψ
θψ
θθ
θψ
θ
r
eE
mr
rr
r
h
Set: ( ) ( ) ( ) ( )φθφθψ ΦΘ= rRr ,,
And then divide by: ( ) ( ) ( )φθ ΦΘrR
1.21Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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PY4118 Physics of Semiconductor Devices
H Atom: separation of variables
2
2
0
2
2
22
22
1
4
sin2
sinsinsin
φπεθ
θθ
θθθ
∂Φ∂
Φ−=
++
∂Θ∂
∂∂
Θ+
∂∂
∂∂
r
eE
mr
r
Rr
rR
h
The term on the right has no dependence( )θ,r
Thus, we can write the equation as:
1.22Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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PY4118 Physics of Semiconductor Devices
H Atom: separation of variables
2
0
2
2
22
22
4
sin2
sinsinsin
lmr
eE
mr
r
Rr
rR
=
++
∂Θ∂
∂∂
Θ+
∂∂
∂∂
πεθ
θθ
θθθ
h
2
2
21lm=
∂Φ∂
Φ−
φ
A constant
The second equation has a easy general solution…
1.23Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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PY4118 Physics of Semiconductor Devices
H Atom: φ equation
02
2
2
=Φ+∂
Φ∂lm
φ
But, we can also say that:
φlimAe=Φ
( )φπφ +==Φ 2ll imimAeAe
Thus: int12 =→= l
mime lπ
Or: ℤ=lm
Discuss symmetry of solution:φlim
Ae=Φ
1.24Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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PY4118 Physics of Semiconductor Devices
H Atom: r,θ equations
==
++
∂Θ∂
∂∂
Θ+
∂∂
∂∂
2
0
2
2
22
22
4
sin2
sinsinsin
lmr
eE
mr
r
Rr
rR
πεθ
θθ
θθθ
h
For this equation, we divide by: θsin
∂Θ∂
∂∂
Θ−=
++
∂∂
∂∂
θθ
θθθ
πε
sinsin
1
sin
4
21
2
2
0
2
2
22
lm
r
eE
mr
r
Rr
rR h
Only:
Only:
r
θ
1.25Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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PY4118 Physics of Semiconductor Devices
H Atom: r,θ equations
( )1sinsin
1
sin 2
2
+=
∂Θ∂
∂∂
Θ− ll
ml
θθ
θθθ
Both must be constant!
A solution exists, when the constant is: ( ) =→+ lll 1
( )14
21
0
2
2
22 +=
++
∂∂
∂∂
llr
eE
mr
r
Rr
rR πεhOnly:
Only:
r
θ
1.26Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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PY4118 Physics of Semiconductor Devices
H Atom: r equation
First multiply by:2
r
R
( )0
1
4
212
0
2
2
2
2=
+−
++
∂∂
∂∂
Rr
ll
r
eE
m
r
Rr
rr πεh
This equation can be transformed into the Laguerre equation,
and this would take a few lectures
Instead, the solution will be discussed, and a link provided for
the detailed calculation.
https://faculty.washington.edu/seattle/physics227/reading/reading-26-27.pdf
1.27Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
H Atom: r equation
Solutions available when: 22
0
2
4
32 n
meEn
hεπ−=
( )rRnl
ln >
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PY4118 Physics of Semiconductor Devices
H Atom: r equation
( )rRnl
1.29Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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PY4118 Physics of Semiconductor Devices
H Atom: θ equations
( )1sinsin
1
sin 2
2
+=
∂Θ∂
∂∂
Θ− ll
ml
θθ
θθθ
( ) 0sin
1sinsin
12
2
=Θ
−++
∂Θ∂
∂∂
θθθ
θθlm
ll
But this equation is a function of and lm
Thus linking the angular equations.
We use: ( ) ( ) ( )φθφθ ΦΘ=,Y
l
1.30Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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PY4118 Physics of Semiconductor Devices
Quantum Numbers:
22
0
2
4
32 n
meEn
hεπ−=Principal Quantum Number: n
Orbital angular momentum quantum number: l
Magnetic quantum number: lm
Rules:
lm
nl
n
l ≤
<
> 0
And all are integers
=
gfdpsl
43210
Names of orbits
1.31Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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PY4118 Physics of Semiconductor Devices
H Atom: angular equation
The angular
equation can be
reduced to a
Legendre equation
(you saw this in 2nd
year E&M), with
following solutions:
1.32Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
PY4118 Physics of Semiconductor Devices
Radial wavefunction
Does this mean the electron exists in the nucleus?
( )rR10
1.33Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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Probability distribution functions
The probability that the electron exits in is:τd
( ) τψψτ ddrP*=
( )( )( ) τdRR ΦΦΘΘ= ***
( )( )( )φθθ dddrRrR ΦΦΘΘ= **2* sin
The probability that the electron exits in is:dr
( ) ∫∫ ΦΦΘΘ=ππ
φθθ2
0
*
0
**2 sin ddRdrRrdrrP
RdrRr*2=
Why do the integrals cancel?
1.34Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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Probability distribution functions
( )rP10
And the electron has a finite probability within the nucleus
1.35Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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PY4118 Physics of Semiconductor Devices
Probability
1.36Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
PY4118 Physics of Semiconductor Devices
Visualise Orbitals
� The best way today is:� Write a program� Download an app.
http://www.orbitals.com/orb/ov.htm
1.37Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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PY4118 Physics of Semiconductor Devices
s – orbitals (l=0)
1.38Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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PY4118 Physics of Semiconductor Devices
p – orbitals (l=1)
1.39Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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PY4118 Physics of Semiconductor Devices
d – orbitals (l=2)
1.40Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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PY4118 Physics of Semiconductor Devices
Some f and g – orbitals (l=3&4)
g g gg
f ff
1.41Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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PY4118 Physics of Semiconductor Devices
Question??
� If the course is on semiconductors, why are we worrying about the Hydrogen atom??
� Good question.
� We will discuss how electron orbits lead to crystal structures.
� But first…larger atoms…1.42
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Physics PY4118Physics of Semiconductor Devices
Larger Atoms
1.43Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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H vs larger atoms
H atom All other atoms
multi-electron atoms
1.44
PY4118 Physics of Semiconductor Devices
Quantum numbers
1.45
PY4118 Physics of Semiconductor Devices
Energy Ordering
1.46Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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PY4118 Physics of Semiconductor Devices
Aufbau Principle
electrons occupy lowest energy levels available
1.47Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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PY4118 Physics of Semiconductor Devices 1.48
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PY4118 Physics of Semiconductor Devices
Rules for filling orbitals
Bottom-up
(Aufbau’s principle)
Fill orbitals singly before doubling up
(Hund’s Rule)
Paired electrons have opposite spin
(Pauli exclusion principle)
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PY4118 Physics of Semiconductor Devices
PhosphorusSymbol: P
Atomic Number: 15
Full Configuration: 1s22s22p63s23p3
Valence Configuration: 3s23p3
Shorthand Configuration: [Ne]3s23p3
↑↓↑↓↑↓↑↓
↑↓↑↓↑↓↑↓
↑↓↑↓↑↓↑↓
↑↓↑↓↑↓↑↓ ↑↓↑↓↑↓↑↓ ↑↓↑↓↑↓↑↓
↑↑↑↑ ↑↑↑↑ ↑↑↑↑
↑↓↑↓↑↓↑↓ ↑↓↑↓↑↓↑↓ ↑↓↑↓↑↓↑↓ ↑↓↑↓↑↓↑↓ ↑↓↑↓↑↓↑↓ ↑↓↑↓↑↓↑↓ ↑↑↑↑ ↑↑↑↑ ↑↑↑↑
1s 2s 2p 3s 3p
Box Notation
1.50
PY4118 Physics of Semiconductor Devices 1.51
Physics PY4118Physics of Semiconductor Devices
Molecular Bonds
1.52Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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PY4118 Physics of Semiconductor Devices
Bonding Theories
� Valence Bond (VB) theory
� Focuses on atomic orbits
� Molecular Orbital (MO) theory
� Focuses on the modules orbitals (thus more complicated)
1.53Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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PY4118 Physics of Semiconductor Devices
Valence Bond Theory� Valence Bond Theory is an attempt to explain the
Covalent bond from a Quantum Mechanical view
� All orbitals of the same type (s, p, d, f) have the same energy
� According to this theory, a bond forms when two atomic orbitals
(s/s s/p p/p) “overlap”
� The space formed by the overlapping orbitals has a capacity for
two electrons that have opposite spins, +1/2 & -1/2 (exclusion
principle)
� Note: Each orbital forming the bond has at least one unfilled slot
to accommodate the electron being shared from the other
bonding orbital
1.54Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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PY4118 Physics of Semiconductor Devices
Valence Bond Theory� Valence bond theory (con’t)
� The bond strength depends on the attraction of the nuclei for
the shared electrons
� The greater the orbital overlap, the stronger (more stable) the
bond
� The extent of the overlap depends on the shapes and directions
of the orbitals
� An s orbital is spherical, but p and d orbitals have more electron
density in one direction than in another
� Whenever possible, a bond involving p or d electrons will be
oriented in the direction that maximizes overlap
1.55Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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PY4118 Physics of Semiconductor Devices
Valence Bond Theory
Hydrogen, H2 1s1
Hydrogen Fluoride, HF [He]2s22p5
To maximize overlap, half-filled H 1s and F 2p orbitals overlap along the long axis of the 2p orbital
Fluorine, F2 [He] 2s22p5
In F2, the half-filled 2 px orbital on one F atom points end to end toward the half-filled 2px of the other F to maximize overlap
1.56Coláiste na hOllscoile Corcaigh, Éire University College Cork, Ireland
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PY4118 Physics of Semiconductor Devices
Molecular Orbital Theory (1)
� Electrons are shared in a molecule when:� They have similar energy levels.� They overlap well.� They are close together.
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Molecular Orbital Theory (2)
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There is an optimum
bond length
PY4118 Physics of Semiconductor Devices
Molecular Orbital Theory (3)
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PY4118 Physics of Semiconductor Devices
Molecular Orbital Theory (4)
� Two similar atomic orbitals combine to form two molecular orbitals, one bonding (σ) and one antibonding (σ*).
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PY4118 Physics of Semiconductor Devices
Molecular Orbital Theory (5)� The electrons fill the molecular orbitals of molecules
like electrons fill atomic orbitals in atoms� Electrons go into the lowest energy orbital available
to form lowest potential energy for the molecule.� The maximum number of electrons in each
molecular orbital is two. (Pauli exclusion principle) � One electron goes into orbitals of equal energy, with
parallel spin, before they begin to pair up. (Hund'sRule.)
(With an atom, we used the Aufbau Principle)
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PY4118 Physics of Semiconductor Devices
Molecular Orbital Theory (6)
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MO Diagram for O2
Why is there no He2?
PY4118 Physics of Semiconductor Devices
Molecular Orbital Theory (7)
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MO Diagram for H2O