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a
0
L/2
L
Solution.
For unperturbed infinite potential well, Schrodinger equation is
(0) (0) (x) = E (0) (0) (x).
H
n
n
n
(1)
(2)
n2 h2
, n N.
(3)
8mL
Wave function and probability density of the first few levels for a particle in an
unperturbed infinite potential well are illustrated in Figure 2.
En(0) =
Figure 2. Wave function and probability density of the first few levels for a particle
in an unperturbed infinite potential well. Ref. [1].
Total Hamiltonian of the system will,
=H
(0) + H
0.
H
(4)
S L+a
L
,L
0, x 0,
2
0 =
2
H
(5)
La L+a
,
, x
2
2
2
La
So, the space where perturbation is equal to 0 is 0,
(from 0 to rectan2
L+a
gular box) and
, L . Part of the space where is the perturbation is is
2
La L+a
,
.
2
2
In order to solve the problem, we need to find eigenvalues of the perturbed
Hamiltonian given by Eq. (5) with accuracy to the first-order correction. In timeindependent nondegenerate perturbation theory, first-order correction to the energy
is
D
E Z
(1)
(0) 0 (0)
0 (0) dV.
En = n H n = n(0) H
(6)
n
V
ZL
=
0 n(0) (x)dx.
n(0) (x)H
(7)
We solve this by substituting the perturbation Hamiltonian, Eq. (5), and we get
three integrals because we divided space from the well begin 0 to perturbation ,
and to the end of well L. After substitution of Eq. (5) in Eq. (7)), we get
En(1) =
La
L+a
Z2
Z2
ZL
+
(8)
La
2
L+a
2
First and third integral are zero, so we only need to solve one in the middle. Using
eigenfunction of unperturbed problem, Eq. (2), we can solve integral
L+a
Z2 r
L+a
En(1)
Z2
=
n(0) (x)
La
2
n(0) (x)dx
2
nx
sin
L
L
2
nx
sin
L
L
(9)
La
2
L+a
2
=
L
Z2
nx
a
sin
dx =
L
L
2n
2
na
2 cos n sin
.
L
La
2
Complete solution of the integral in the Eq. above is given in Supplementary part
at the end of document. Using fact that cos n = (1)n , we find that the first-order
correction to energy is
a (1)n
na
(1)
En =
sin
.
(10)
L
n
L
3
sin
.
8mL
L
n
L
(11)
This is the solution to the given problem. Lets discuss the effect of the size of
the perturbation on the first-order correction to the energy.
The first-order correction to the energy (in units of ) of the nth level,for the
L
(green squares), for first 15 levels are
case when a = L5 (red circles) and a = 10
plotted in the Figure 3. On the x-axis is the ordinal number of the level and on
the y-axis is the first-order correction to the energy. The only purpose of line that
connects the points is to see the trend of change of the energy correction.
0.40
= L5
= 10L
0.35
0.30
En(1) 1
0.25
0.20
0.15
0.10
0.05
0.00
10
12
14
16
En(1) =
2
L
Z2
= 1 cos , we get
L+a
Z2
2nx
2 nx
sin
dx =
1 cos
dx
L
L
L
La
2
(13)
La
2
L+a
L+a
Z2
Z2
dx
La
2
cos
2nx
dx
L
La
2
a
L
+
a
2n
2n
L+a La
L
2 sin
2
sin
L
2
2
L 2n
L
L
=
L
2n
na
2 cos n sin
L
,
sin
.
where we used trigonometric expression sin sin = 2 cos +
2
2
Refrences
[1] Fitts, D. D. PRINCIPLES OF QUANTUM MECHANICS as Applied to Chemistry and Chemical Physics. Cambridge University Press (Virtual Publishing),
(2002).