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Patrick Puppel
Outline
~2 2
∂
i~ ψ = − ∇ +V ψ
∂t 2m
Formalism (1)
Coordinates
A point in space and time is represented by a 4-vector
x µ ≡ (x 0 , x k ) ≡ (x 0 , x 1 , x 2 , x 3 ) where x 0 = ct and x k = r
Covariant and contravariant vectors
We have to distinguish between covariant and contravariant
vectors. They are connected by
X
aµ = gµν aν = gµν aν
ν
1 0 0 0
0 −1 0 0
where gµν is a metric tensor with gµν =
0 0 −1 0
0 0 0 −1
Patrick Puppel Dirac Equation and Hydrogen Atom
Why do we need the Dirac Equation?
The Dirac Equation The mathematical Formalism
The Hydrogen Atom Klein-Gordon equation
Dirac equation
Formalism (2)
Lorentz Transformation
The Lorentz transformation along the x-axis is given by
x 0 = γ(x − vt)
v
t 0 = γ(t − x)
c2
q
where γ = 1/ 1 − vc 2 . By introducing the matrix Λµν the
2
transformation becomes
µ
x 0 = Λµν x ν .
Formalism (3)
aµ b µ = aµ bµ = a0 b 0 − a.b
Gradient
We keep the differential operator ∇ and define a covariant and
contravariant vector
∂µ ≡ (∂/∂ct, ∇)
∂ µ ≡ g µν ∂ν ≡ (∂/∂ct, −∇)
Formalism (4)
Electromagnetic fields
The electrical potential ϕ(r, t) and the vector potential A(r, t) are
combined to a 4-vector
Aµ ≡ (ϕ, A)
Units
Without getting any problems we can set ~ = c = 1.
x µ = (ct, r) → (t, r)
p µ = (E /c, p) → (E , p)
H → H − eϕ and p → p − eA
Klein-Gordon equation
(E − eϕ)2 = (p − eA)2 + m2 .
Dµ D µ + m2 ψ = 0.
Solution
We have to linearize the equation, i.e. to find an equation that is
linear in p µ and leads to the Dirac equation.
Dirac equation
Ansatz
In order to find a wave equation that describes a free electron
Dirac made the ansatz
HD = α.p + βm.
E ψ = HD ψ = [α.p + βm] ψ
or
[E − α.p − βm] ψ = 0.
Properties of α and β
(αk )2 =1
(β)2 =1
αk αl + αl αk = 0 (k 6= l)
αk β + βαk =0
[E − α.p − βm] ψ = 0
γ µ ≡ (γ 0 , γ 1 , γ 2 , γ 3 ) ≡ (γ 0 , γ)
γ0 ≡ β γ ≡ βα
[iγ µ Dµ − m] ψ = 0
Representation of α and β
We found earlier:
(αk )2 =1
(β)2 =1
αk αl + αl αk = 0 (k 6= l)
αk β + βαk =0
Representation of γ µ
∂ φ 0 σ 1 0 φ
i = (p − eA) + m + eϕ
∂t χ σ 0 0 −1 χ
1
Using the approximation χ ≈ 2m (σ.P)φ and P = p − eA we
obtain a differential equation for φ:
∂φ 1
i = (σ.P)(σ.P)φ + eϕφ
∂t 2m
Rewriting the equation by using B = ∇ × A and e = −|e|
(electron charge) leads to a Schrödinger like equation:
∂φ 1 2 |e|
i = (−i∇ + |e|A) + σ.B − |e|ϕ φ
∂t 2m 2m
∂φ 1 2 |e|
i = (−i∇ + |e|A) + σ.B − |e|ϕ φ
∂t 2m 2m
Now we compare this equation to the Pauli equation (Schrödinger
equation for a particle with spin):
∂ψs 1 2
i = (−i∇ + |e|A) + µ.B − |e|ϕ ψs
∂t 2m
|e|
Comparing with µ = g 2m s, where s = 12 σ, leads to g = 2.
HD ≡ α.p + βm + V (r ).
Quantum Numbers
We assume that the wave function
φ
ψ≡
χ
The function YLJM may be the eigenfunction of the state (JM). The
1 1
L=l =J+ κ L = l0 = J − κ
2 2
1 φ
Considering P (0) χφ = (−)J+ 2 κ −χ
we can define the wave
equation
1 F (r ) YlJM
M
ψκJ =
r iG (r ) YlM0J
M = E ψM .
We have to solve the problem HD ψκJ κJ
∂
Therefore we introduce pr = −i 1r ∂r r and αr = (α.r̂). In order to
obtain another expression for α.p we calculate
Now we multiply this equation with αr /r from the left side and use
the identity αr2 = 1:
i
α.p = αr pr + (1 + σ.L)
r
Derivation of F and G
With the expression for α.p we write down the problem again:
i M M
αr pr + (1 + σ.L) + mβ + V (r ) ψκJ = E ψκJ
r
From this equation we get two coupled differential equations:
" #
d κ(J + 21 )
− + G = (E − m − V )F
dr r
" #
d κ(J + 12 )
+ F = (E + m − V )G
dr r
The differential equations can be solved be assuming that F and G
can be represented by a power series. This leads to an expression
for the energy levels of the bound states of the hydrogen atom.
Patrick Puppel Dirac Equation and Hydrogen Atom
Dirac Equation with a Central Potential
The Dirac Equation
Separation of the Radial and Angular Components
The Hydrogen Atom
Energy Levels of the Hydrogen Atom
Energy Levels
Finally we can write down an expression for the energy levels of the
hydrogen atom:
− 21
Z 2e 4
EnJ =m 1+
(n − J )2
r
1 1
J = J + − (J + )2 − Z 2 e 4
2 2
or
" ! #
Z 2 e 4 (Z 2 e 4 )2 n 3
EnJ =m 1− − 1
− + ...
2n2 2n4 J+ 2
4
n l J √ EnJ
1
1S 1 1 0 2 m 1 − Z 2e 4
2 q √
1 2e4
2S 1 2 0 2 m 1+ 1−Z
2 q √2
1 2e4
2P 1 2 1 2 m 1+ 1−Z 2
2
3 m
√
2 4
2P 3
2
2 1 2 2 4−Z e
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