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Lecture 2 Perturbation Theory PDF
Lecture 2 Perturbation Theory PDF
Perturbation theory
Quantum mechanics 2 - Lecture 2
Igor Lukačević
4 Literature
Contents
4 Literature
Hψn = En ψn
A question
Does anyone have an idea how?
Assume
H = H 0 + λH 0
Assume
H = H0 + λH 0
unperturbed Hamiltonian
perturbation Hamiltonian
small parameter
Assume
H = H 0 + λH0
unperturbed Hamiltonian
perturbation Hamiltonian
small parameter
Assume
H = H 0 + λH 0
unperturbed Hamiltonian
perturbation Hamiltonian
small parameter
Assume
] H’ is small compared to H0
] eigenstates and eigenvalues of H do not differ much from those of H0
] eigenstates and eigenvalues of H0 are known
Assume
] H’ is small compared to H0
] eigenstates and eigenvalues of H do not differ much from those of H0
] eigenstates and eigenvalues of H0 are known
expand
Assume
] H’ is small compared to H0
] eigenstates and eigenvalues of H do not differ much from those of H0
] eigenstates and eigenvalues of H0 are known
expand
and sort
.
Making hψn0 | (λ1 ) and using the normalization property of ψn0 , we get
Example 1
Example 1
r
2 nπ
Unperturbed w.f.: ψn0 (x) = sin x
a a
Example 1
r
2 nπ
Unperturbed w.f.: ψn0 (x) = sin x
a a
Perturbation Hamiltonian: H 0 = V0
Example 1
Find the first-order corrections to the energy of
a particle in a infinite square well if the “floor”
of the well is raised by an constant value V0 .
r
2 nπ
Unperturbed w.f.: ψn0 (x) = sin x
a a
Perturbation Hamiltonian: H 0 = V0
First-order correction:
En1 = hψn0 |V0 |ψn0 i = V0 hψn0 |ψn0 i = V0
Example 1
Find the first-order corrections to the energy of
a particle in a infinite square well if the “floor”
of the well is raised by an constant value V0 .
r
2 nπ
Unperturbed w.f.: ψn0 (x) = sin x
a a
Perturbation Hamiltonian: H 0 = V0
First-order correction:
En1 = hψn0 |V0 |ψn0 i = V0 hψn0 |ψn0 i = V0
Example 1
Find the first-order corrections to the energy of
a particle in a infinite square well if the “floor”
of the well is raised by an constant value V0 .
r
2 nπ
Unperturbed w.f.: ψn0 (x) = sin x
a a
Perturbation Hamiltonian: H 0 = V0
First-order correction:
En1 = hψn0 |V0 |ψn0 i = V0 hψn0 |ψn0 i = V0
Example 1 (cont.)
Example 1 (cont.)
Example 1 (cont.)
In conclusion
First-order perturbation theory gives:
often accurate energies
poor wave functions
Example 2
Example 2
Example 2
Compute the first-order corrections for a
harmonic oscilator with applied small
perturbation W = ax 3 .
~ 2 d2 1
Hamiltonian: H = − + kx 2 + ax 3
2mdx 2
0 0 1
H eigenenergies: En = n + ~ω
2
Example 2
Compute the first-order corrections for a
harmonic oscilator with applied small
perturbation W = ax 3 . Don’t forget...
2 2
~ d 1 n Hn (ξ)
Hamiltonian: H = − + kx 2 + ax 3
2mdx 2 0 1
1 2ξ
0 0 1 2 4ξ 2 − 2
H eigenenergies: En = n + ~ω
2 3 8ξ 3 − 12ξ
4 16ξ 4 − 48ξ 2 + 12
H0 eigenfunctions:
s 5 32ξ 5 − 160ξ 3 + 120ξ
√
r
0 1 α − αx2 2
ψn (x) = n
e Hn (x α)
2 n! π
Example 2
Compute the first-order corrections for a
harmonic oscilator with applied small
perturbation W = ax 3 .
Don’t forget...
~ 2 d2 1
Hamiltonian: H = − + kx 2 + ax 3
2mdx 2 n Hn (ξ)
0 1
0 0 1 1 2ξ
H eigenenergies: En = n + ~ω
2 2 4ξ 2 − 2
3 8ξ 3 − 12ξ
H0 eigenfunctions:
s 4 16ξ 4 − 48ξ 2 + 12
√ 32ξ 5 − 160ξ 3 + 120ξ
r
0 1 α − αx2 2 5
ψn (x) = n
e Hn (x α)
2 n! π
Example 2
Compute the first-order corrections for a
harmonic oscilator with applied small
perturbation W = ax 3 .
~ 2 d2 1
Hamiltonian: H = − + kx 2 + ax 3 Don’t forget...
2mdx 2
n Hn (ξ)
1
H0 eigenenergies: En0 = n + ~ω 0 1
2 1 2ξ
2 4ξ 2 − 2
H0 eigenfunctions:
s 3 8ξ 3 − 12ξ
√ 4 16ξ 4 − 48ξ 2 + 12
r
0 1 α − αx2 2
ψn (x) = e Hn (x α) 5 32ξ 5 − 160ξ 3 + 120ξ
2n n! π
Example 2
Compute the first-order corrections for a
harmonic oscilator with applied small
perturbation W = ax 3 .
~ 2 d2 1
Hamiltonian: H = − + kx 2 + ax 3
2mdx 2 Don’t forget...
0 0 1 n Hn (ξ)
H eigenenergies: En = n + ~ω
2 0 1
1 2ξ
H0 eigenfunctions:
s 2 4ξ 2 − 2
√ 3 8ξ 3 − 12ξ
r
0 1 α − αx2 2
ψn (x) = e Hn (x α) 4 16ξ 4 − 48ξ 2 + 12
n
2 n! π 5 32ξ 5 − 160ξ 3 + 120ξ
Example 2
Compute the first-order corrections for a
harmonic oscilator with applied small
perturbation W = ax 3 .
~ 2 d2 1
Hamiltonian: H = − + kx 2 + ax 3
2mdx 2
0 0 1 Don’t forget...
H eigenenergies: En = n + ~ω
2
n Hn (ξ)
H0 eigenfunctions:
s 0 1
1 2ξ
√
r
0 1 α − αx2 2 2 4ξ 2 − 2
ψn (x) = e Hn (x α)
n
2 n! π 3 8ξ 3 − 12ξ
4 16ξ 4 − 48ξ 2 + 12
⇒ En1 = hψn0 |ax 3 |ψn0 i = 0 5 32ξ 5 − 160ξ 3 + 120ξ
Example 2
Compute the first-order corrections for a
harmonic oscilator with applied small
perturbation W = ax 3 .
Don’t forget...
s
3 (n + 1)(n + 2)(n + 3)
hn|ax |n + 3i = a· n Hn (ξ)
(2α)3
0 1
1 2ξ
s
(n + 1)3 4ξ 2 − 2
hn|ax 3 |n + 1i = 3a · 2
(2α)3 3 8ξ 3 − 12ξ
s 4 16ξ 4 − 48ξ 2 + 12
n3 5 32ξ 5 − 160ξ 3 + 120ξ
hn|ax 3 |n − 1i = 3a ·
(2α)3
s
n(n − 1)(n − 2)
hn|ax 3 |n − 3i = a·
(2α)3
Example 2
Compute the first-order corrections for a
harmonic oscilator with applied small
perturbation W = ax 3 .
s
3 (n + 1)(n + 2)(n + 3) Energy differences
hn|ax |n + 3i = a·
(2α)3
s m En − Em
n+3 −3~ω
3 (n + 1)3 n+1 −~ω
hn|ax |n + 1i = 3a ·
(2α)3 n-1 ~ω
s n-3 3~ω
n3
hn|ax 3 |n − 1i = 3a ·
(2α)3
s
n(n − 1)(n − 2)
hn|ax 3 |n − 3i = a·
(2α)3
Example 2
Compute the first-order corrections for a harmonic oscilator
with applied small perturbation W = ax 3 .
s
3 (n + 1)(n + 2)(n + 3)
hn|ax |n + 3i = a· Energy differences
(2α)3
s
3 (n + 1)3 m En − Em
hn|ax |n + 1i = 3a · n+3 −3~ω
(2α)3
s n+1 −~ω
n3 n-1 ~ω
3
hn|ax |n − 1i = 3a · n-3 3~ω
(2α)3
s
3 n(n − 1)(n − 2)
hn|ax |n − 3i = a·
(2α)3
" r r
a 1 n(n − 1)(n − 2) 0 n 0
⇒ ψn1 = ψn−3 + 3n ψn−1
2~ωα 3 2α 2α
r r #
n+1 0 1 (n + 1)(n + 2)(n + 3) 0
−3(n + 1) ψn+1 − ψn+3
2α 3 2α
.
Making hψn0 | (λ2 ), using the normalization property of ψn0 and orthogonality
between ψn0 and ψn1 , we get
Contents
4 Literature
A question
What’s wrong with
0
X |hψm |H 0 |ψn0 i|2
En2 = , m, n ≤ q
m6=n
En − Em0
0
Construct
q
1m
X 0
0 ϕn = anm ψm
H = H0 + H
H0 ψn0 = En0 ψn0 - i=1
which diagonalizes submatrix
E10 q-fold degenerate
of H 0 :
hϕn |H 0 |ϕk i = E 0 δnk
2m
Nondegenerate q 3m
detH 0 − En0 I = 0
X
perturbation theory (H 0 − E 0 δ)a = 0
-
with basis B
XXX
y
6m XX
6m 5m XXXX 4m
XX
8
? X?
7m
{ϕn } {ani } E10 , E20 , . . . , Eq0
Gives new basis B
Igor Lukačević Perturbation theory
Contents
Time-independent nondegenerate perturbation theory
General formulation
Time-independent degenerate perturbation theory
Example: Two-dimensional harmonic oscilator
Time-dependent perturbation theory
Literature
Matrix H 0 in basis B
0 0
H11 H1,q+1 ...
..
0
.
0
Hq/2,q/2
..
0
H =
0 .
0
0 Hqq
Hq+1,1
..
.
Construct
q
1m
X 0
0 ϕn = anm ψm
H = H0 + H
H0 ψn0 = En0 ψn0 - i=1
which diagonalizes submatrix
E10 q-fold degenerate
of H 0 :
hϕn |H 0 |ϕk i = E 0 δnk
2m
Nondegenerate q 3m
detH 0 − En0 I = 0
X
perturbation theory (H 0 − E 0 δ)a = 0
-
with basis B
XXX
y
6m XX
6m 5m XXXX 4m
XX
8
? X?
7m
{ϕn } {ani } E10 , E20 , . . . , Eq0
Gives new basis B
Igor Lukačević Perturbation theory
Contents
Time-independent nondegenerate perturbation theory
General formulation
Time-independent degenerate perturbation theory
Example: Two-dimensional harmonic oscilator
Time-dependent perturbation theory
Literature
q
X 0
For n = 1, (Hpm − En0 δpm )anm = 0 appear as
m=1
0
− E10 0 0 0
H11 H12 H13 ... H1q a11
0 0
H21 H22 − E10 H230
... H2q0 a12
=0
.. .. .. .. .. ..
. . . . . .
0
Hq1 a1q
Construct
q
1m
X 0
0 ϕn = anm ψm
H = H0 + H
H0 ψn0 = En0 ψn0 - i=1
which diagonalizes submatrix
E10 q-fold degenerate
of H 0 :
hϕn |H 0 |ϕk i = E 0 δnk
2m
Nondegenerate q 3m
detH 0 − En0 I = 0
X
perturbation theory (H 0 − E 0 δ)a = 0
-
with basis B
XXX
y
6m XX
6m 5m XXXX 4m
XX
8
? X?
7m
{ϕn } {ani } E10 , E20 , . . . , Eq0
Gives new basis B
Igor Lukačević Perturbation theory
Contents
Time-independent nondegenerate perturbation theory
General formulation
Time-independent degenerate perturbation theory
Example: Two-dimensional harmonic oscilator
Time-dependent perturbation theory
Literature
The q roots of secular equation detH 0 − En0 I = 0 are the diagonal elements of
the submatrix of H 0 .
Construct
q
1m
X 0
0 ϕn = anm ψm
H = H0 + H
H0 ψn0 = En0 ψn0 - i=1
which diagonalizes submatrix
E10 q-fold degenerate
of H 0 :
hϕn |H 0 |ϕk i = E 0 δnk
2m
Nondegenerate q 3m
detH 0 − En0 I = 0
X
perturbation theory (H 0 − E 0 δ)a = 0
-
with basis B
XXX
y
6m XX
6m 5m XXXX 4m
XX
8
? X?
7m
{ϕn } {ani } E10 , E20 , . . . , Eq0
Gives new basis B
Igor Lukačević Perturbation theory
Contents
Time-independent nondegenerate perturbation theory
General formulation
Time-independent degenerate perturbation theory
Example: Two-dimensional harmonic oscilator
Time-dependent perturbation theory
Literature
Construct
q
1m
X 0
0 ϕn = anm ψm
H = H0 + H
H0 ψn0 = En0 ψn0 - i=1
which diagonalizes submatrix
E10 q-fold degenerate
of H 0 :
hϕn |H 0 |ϕk i = E 0 δnk
2m
Nondegenerate q 3m
detH 0 − En0 I = 0
X
perturbation theory (H 0 − E 0 δ)a = 0
-
with basis B
XXX
y
6m XX
6m 5m XXXX 4m
XX
8
? X?
7m
{ϕn } {ani } E10 , E20 , . . . , Eq0
Gives new basis B
Igor Lukačević Perturbation theory
Contents
Time-independent nondegenerate perturbation theory
General formulation
Time-independent degenerate perturbation theory
Example: Two-dimensional harmonic oscilator
Time-dependent perturbation theory
Literature
Construct
q
1m
X 0
0 ϕn = anm ψm
H = H0 + H
H0 ψn0 = En0 ψn0 - i=1
which diagonalizes submatrix
E10 q-fold degenerate
of H 0 :
hϕn |H 0 |ϕk i = E 0 δnk
2m
Nondegenerate q 3m
detH 0 − En0 I = 0
X
perturbation theory (H 0 − E 0 δ)a = 0
-
with basis B
XXX
y
6m XX
6m 5m XXXX 4m
XX
8
? X?
7m
{ϕn } {ani } E10 , E20 , . . . , Eq0
Gives new basis B
Igor Lukačević Perturbation theory
Contents
Time-independent nondegenerate perturbation theory
General formulation
Time-independent degenerate perturbation theory
Example: Two-dimensional harmonic oscilator
Time-dependent perturbation theory
Literature
Construct
q
1m
X 0
0 ϕn = anm ψm
H = H0 + H
H0 ψn0 = En0 ψn0 - i=1
which diagonalizes submatrix
E10 q-fold degenerate
of H 0 :
hϕn |H 0 |ϕk i = E 0 δnk
2m
Nondegenerate q 3m
detH 0 − En0 I = 0
X
perturbation theory (H 0 − E 0 δ)a = 0
-
with basis B
XXX
y
6m XX
6m 5m XXXX 4m
XX
8
? X?
7m
{ϕn } {ani } E10 , E20 , . . . , Eq0
Gives new basis B
Igor Lukačević Perturbation theory
Contents
Time-independent nondegenerate perturbation theory
General formulation
Time-independent degenerate perturbation theory
Example: Two-dimensional harmonic oscilator
Time-dependent perturbation theory
Literature
Construct
q
1m
X 0
0 ϕn = anm ψm
H = H0 + H
H0 ψn0 = En0 ψn0 - i=1
which diagonalizes submatrix
E10 q-fold degenerate
of H 0 :
hϕn |H 0 |ϕk i = E 0 δnk
2m
Nondegenerate q 3m
detH 0 − En0 I = 0
X
perturbation theory (H 0 − E 0 δ)a = 0
-
with basis B
XXX
y
6m XX
6m 5m XXXX 4m
XX
8
? X?
7m
{ϕn } {ani } E10 , E20 , . . . , Eq0
Gives new basis B
Igor Lukačević Perturbation theory
Contents
Time-independent nondegenerate perturbation theory
General formulation
Time-independent degenerate perturbation theory
Example: Two-dimensional harmonic oscilator
Time-dependent perturbation theory
Literature
Two-dimensional harmonic
oscilator Hamiltonian:
px2 + py2 K
H0 = + (x 2 + y 2 )
2m 2
ψnp = ϕn (x)ϕp (y ) |npi
Enp = ~ω(n + p + 1) is
(n + p + 1)-fold degenerate.
What’s the degeneracy of |01i
state?
Two-dimensional harmonic
oscilator Hamiltonian:
px2 + py2 K
H0 = + (x 2 + y 2 )
2m 2
ψnp = ϕn (x)ϕp (y ) |npi
Enp = ~ω(n + p + 1) is
(n + p + 1)-fold degenerate.
What’s the degeneracy of |01i
state?
E10 = E01 = 2~ω0 .
ϕ1 = aψ10 + bψ01
ϕ2 = a0 ψ10 + b 0 ψ01
ϕ1 = aψ10 + bψ01
ϕ2 = a0 ψ10 + b 0 ψ01
K0 mω0
E= , β2 =
2β 2 ~
ϕ1 = aψ10 + bψ01
ϕ2 = a0 ψ10 + b 0 ψ01
K0 mω0
E= , β2 =
2β 2 ~
solve the secular equation
E+ = E10 + E
−E 0
E E10
= 0 ⇒ E 0 = ±E
−E 0
@
E
@@ E− = E10 − E
E 0 = +E ϕ1 = √1 (ψ10
2
+ ψ01 )
=⇒
E 0 = −E ϕ2 = √1 (ψ10
2
− ψ01 )
E 0 = +E ϕ1 = √1 (ψ10
2
+ ψ01 )
=⇒
E 0 = −E ϕ2 = √1 (ψ10
2
− ψ01 )
HW
How does the threefold-degenerate energy
E = 3~ω0
H 0 = K 0 xy ?
Contents
4 Literature
Problem
If the system is initially in H0 , what is the probability that, after time t,
transition to another state (of H0 ) occurs?
Problem
If the system is initially in H0 , what is the probability that, after time t,
transition to another state (of H0 ) occurs?
Let us assume:
H(~r , t) = H0 (~r ) + λH 0 (~r , t)
ψn (~r , t) = ϕn (~r )e −iωt
H0 ϕn = En0 ϕn
X
Ψ(~r , t) = cn (t)ψn (~r , t) , t > 0
n
∂Ψ
i~ = (H0 + λH 0 )Ψ
∂t
Problem
If the system is initially in H0 , what is the probability that, after time t,
transition to another state (of H0 ) occurs?
Let us assume:
H(~r , t) = H0 (~r ) + λH(~r , t)
ψn (~r , t) = ϕn (~r )e −iωt
H0 ϕn = En0 ϕn
X
Ψ(~r , t) = cn (t)ψn (~r , t) , t > 0
n
∂Ψ
i~ = (H0 + λH 0 )Ψ
∂t
Inserting Ψ(~r , t) and cn (t) = cn0 + λcn1 (t) + λ2 cn2 (t) + . . . into time-dependent
S.E. and factorizing the perturbation Hamiltonian as H 0 (~r , t) = H0 (~r )f (t) gives
Probability that the system has undergone a transition from state ψl to state
ψk at time t
0 2 Z t 2
H 0
Pl→k = Plk = |cn |2 = kl e iωkl t f (t 0 )dt 0
~ −∞
Contents
4 Literature
Literature