L-15 Solution of Schrodinger Equation For Particle in A Box

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Particle in a One-Dimensional Box with infinitely hard walls (Infinite Potential

Well)
Consider a particle of mass m moving along x-axis between the two rigid walls x=0 & x=L. The
particle is free to move between the walls. The potential energy of the particle between the two
walls is zero and no force is acting on the particle. The particle does not loose energy when it
strikes back and forth in the potential well because the walls are infinitely rigid. Let U(x) is the
potential energy function. Then U(x) can be represented mathematically as

V(x) = 0 for 0 <x< L


V(x) = ∞ for x ≤ 0 and x ≥ L

The wave function for the particle can be determined by solving the Schrodinger equation, i.e.
d ψ 2 m(E−U )
2

2
+ 2
ψ=0
dx ℏ
2
d ψ 2 mE
Since U=0 inside the box, we get 2
+ 2 ψ =0
dx ℏ

The general solution of this equation is ψ (x )= A sin(¿ kx)+ B cos(¿ kx) ¿ ¿


Where A and B are arbitrary constants to be determined from the boundary conditions and k is given by

k=
√ 2 mE
ℏ2
.

The boundary conditions are ψ(x) = 0, at x = 0 and at x = L.


For x = 0, ψ (x )= A sin(¿ kx)+ B cos(¿ kx)⇒ B=0 ¿ ¿
Thus, the wave function becomes ψ n= A sin (¿ kx )¿
Further ψ(x) = 0, at x = L gives
sin(¿ kL)=0 ⇒ kL=nπ ¿
Since A cannot be zero as this will make the wave function zero everywhere.

k= , n=1, 2 , 3 etc
L

The wave function becomes ψ n= A sin ( nπL ) x


The subscript n in ψn means that the wave-function depends on n. The allowed energies are
obtained using

( )
nπ 2
2 2
n π 2 m En n2 π2 2
ℏ nπ
2
k= ⇒k = 2 ⇒ 2
= 2
⇒ E n =
L L ℏ L 2m L

( )
2 2
ℏ nπ 2
En = ⇒ En ∝ n
2m L

Each value of the energy E n for n = 1, 2, 3 etc is called an energy Eigen value and corresponding
wave function is called Eigen function. Thus, inside the box, the particle can only have the
discrete energy values. The allowed wave functions and the allowed energy values E n exist only
for integral values of n. The number n is called the quantum number. Hence energy spectrum
consists of discrete energy levels where the spacing between the levels is determined by the values
of n and L.

Wave Functions: The constant A can be determined by using this information that the
probability of finding an electron somewhere inside the box is unity, i.e.
L

∫ ψ n¿ ψ n dx=1
0
This is called as normalisation condition. We get,


L L L
A ∫ sin
2

0
( )
2 nπ
L
x dx=1⇒ A ∫ 1−cos
2

0
(
2 nπ
L )
x dx=2 ⇒ A ∫ dx=2 ⇒ A=
2

0
2
L
Thus the normalized wave function is given by

ψ n=
√ 2
L
sin ( )

L
x

The energy levels and the wave functions corresponding to n=1, 2, 3, and 4 are shown below;
The probabilities of finding the particle are given by |ψ|2 and are shown below for first three wave
functions.

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