Quantum Mechanics: Instructor: Dr. SDV TIET, Patiala
Quantum Mechanics: Instructor: Dr. SDV TIET, Patiala
Quantum Mechanics: Instructor: Dr. SDV TIET, Patiala
(a) (b)
The diffraction pattern of aluminium foil produced (a) by x-
rays and (b) by electrons.
“Thomson, the father, was awarded the Nobel Prize for having
shown that the electron is a particle, and Thomson, the son,
for having shown that the electron is a wave.”
Heisenberg uncertainty principle :
Hence, we can not know the future because we can not know
the present because of associated uncertainties.
ℎ
Mathematically, 𝛥𝑥 𝛥𝑝 ≥
4𝜋
And so Ψ 2 = Ψ ∗ Ψ = A − i B A + i B = A2 + B2
𝑥2
𝑃𝑥1 𝑥2 = න 𝛹 2 𝑑𝑥
𝑥1
Expectation value: how to extract information from a
wave function.
𝜕𝛹 ℏ2 𝜕 2 𝛹
𝑖ℏ =− 2
+ 𝑈𝛹
𝜕𝑡 2𝑚 𝜕𝑥
Time-independent Schrodinger equation:
For a particle whose potential energy doesn’t depend on time
explicitly, forces acting on the particle and hence, potential energy
U, vary with position of the particle only. In that case, Schrodinger
equation can be simplified by removing reference to t.
Time variations of all wavefunctions of particles acted on forces
independent of time have the same form as that of
free/unrestricted particle
The wave function can be written as 𝛹 𝑥, 𝑡 = 𝜙 𝑥 𝑒 −𝑖𝜔𝑡
𝜕𝛹 𝑥, 𝑡 𝑑𝜙 𝑥 −𝑖𝜔𝑡
= 𝑒
𝜕𝑥 𝑑𝑥
𝜕 2 𝛹 𝑥, 𝑡 𝑑 2 𝜙 𝑥 −𝑖𝜔𝑡 (4)
2
= 2
𝑒
𝜕𝑥 𝑑𝑥
𝜕𝛹 𝑥, 𝑡
= 𝜙 𝑥 ሺ−𝑖𝜔)𝑒 −𝑖𝜔𝑡 (5)
𝜕𝑡
Time-independent Schrodinger equation:
Using equation (4) and (5) in Schrodinger equation
𝜕𝛹 ℏ2 𝜕 2 𝛹
𝑖ℏ =− 2
+ 𝑈𝛹 gives
𝜕𝑡 2𝑚 𝜕𝑥
2 2
−𝑖𝜔𝑡
ℏ −𝑖𝜔𝑡
𝑑 𝜙 𝑥 −𝑖𝜔𝑡
𝑖ℏ𝜙 𝑥 ሺ−𝑖𝜔)𝑒 =− 𝑒 + 𝑈𝜙 𝑥 𝑒
2𝑚 𝑑𝑥 2
Dividing both sides by𝑒 −𝑖𝜔𝑡
ℏ2 𝑑 2 𝜙 𝑥
ℏ𝜔𝜙ሺ𝑥) = − 2
+ 𝑈𝜙 𝑥
2𝑚 𝑑𝑥
ℏ2 𝑑 2 𝜙 𝑥
⇒𝐸𝜙 𝑥 =− 2
+ 𝑈𝜙 𝑥
2𝑚 𝑑𝑥
Time-independent Schrodinger equation:
ℏ2 𝑑 2 𝜙
− 2
+ 𝑈𝜙 = 𝐸𝜙 (6)
2𝑚 𝑑𝑥
In three dimensions, equation (6) can be written as
ℏ2 𝑑 2 𝜙 𝑑 2 𝜙 𝑑 2 𝜙
− 2
+ 2 + 2 + 𝑈𝜙 = 𝐸𝜙
2𝑚 𝑑𝑥 𝑑𝑦 𝑑𝑧
ℏ2 𝑑 2 𝜙
− 2
+ 𝑈𝜙 = 𝐸𝜙
2𝑚 𝑑𝑥
2𝑚𝐸
𝐿 = 𝑛𝜋 n = 1,2,3……….. (10)
ℏ
Particle in a box or infinite well:
2𝑚𝐸
𝐿 = 𝑛𝜋 n = 1,2,3……….. (10)
ℏ
From equation (10) it is clear that energy of the particle can have
certain values, which are eigenvalues. These eigenvalues
constitute energy levels of the system and are given by (10) as
𝑛𝜋ℏ 𝑛 2 𝜋 2 ℏ2
2𝑚𝐸𝑛 = ⇒ 2𝑚𝐸𝑛 =
𝐿 𝐿2
𝑛 2 𝜋 2 ℏ2
𝐸𝑛 = n=1,2,3 …… (11)
2𝑚𝐿2
Particle in a box or infinite well:
𝑛 2 𝜋 2 ℏ2
𝐸𝑛 = n=1,2,3 …… (11)
2𝑚𝐿2
Conclusions :
1. Trapped particle can not have an arbitrary energy. Boundary
conditions or its confinement restricts its wave function and
hence particle is allowed to have only certain specific energies
and no others (No counterpart in classical). Exact energies
depend on mass of particle and details how it is trapped.
2. Because Planck's constant is so small – quantization of energy
clearly noticeable only when m and L are also small.
Particle in a box or infinite well:
3. A trapped particle can not have zero energy. The de Broglie
wavelength (𝜆 = ℎ/𝑚𝑣) is infinite when 𝑣 = 0. There is no way a
trapped particle can have an infinite wavelength, so particle
must have at least some kinetic energy. Exclusion of 𝐸 = 0 has
no counterpart in classical physics.
𝑛 2 𝜋 2 ℏ2
𝐸𝑛 = n=1,2,3 …… (11)
2𝑚𝐿2
Particle in a box or infinite well:
Wavefunction :
n=1,2,3 ……
Particle in a box or infinite well:
𝑛𝜋𝑥
𝜙𝑛 = 𝐴𝑠𝑖𝑛 n=1,2,3 ……
𝐿
𝜙𝑛 is a well behave wave function because :
1. For each value of n, 𝜙𝑛 is finite, single valued function of x and
𝜕𝜙𝑛
𝜙𝑛 and are continuous.
𝜕𝑥
2. The integral 𝜙𝑛 2 over all space is finite.
∞ 𝐿 𝐿
2 𝑑𝑥 2 𝑑𝑥
𝑛𝜋𝑥
න 𝜙𝑛 = න 𝜙𝑛 = 𝐴2 න 𝑠𝑖𝑛2 𝑑𝑥
−∞ 0 0 𝐿
𝐿
𝐴2 2𝑛𝜋𝑥
= න 1 − 𝑐𝑜𝑠 𝑑𝑥
2 0 𝐿
𝐴2 𝐿 𝐿
2𝑛𝜋𝑥
= න 𝑑𝑥 − න 𝑐𝑜𝑠 𝑑𝑥
2 0 0 𝐿
Particle in a box or infinite well:
∞ 2 𝐿 𝐿
2
𝐴 2𝑛𝜋𝑥
න 𝜙𝑛 𝑑𝑥 = න 𝑑𝑥 − න 𝑐𝑜𝑠 𝑑𝑥
−∞ 2 0 0 𝐿
𝐿
𝐴2 𝐿 2𝑛𝜋𝑥
= 𝑥− 𝑠𝑖𝑛
2 2𝑛𝜋 𝐿 0
𝐴2 𝐿 2𝑛𝜋𝐿 𝐿 2𝑛𝜋0
= 𝐿− 𝑠𝑖𝑛 −0− 𝑠𝑖𝑛
2 2𝑛𝜋 𝐿 2𝑛𝜋 𝐿
2
𝐿
=𝐴
2
∞
𝐿
2
⇒ න 𝜙𝑛 𝑑𝑥 = 𝐴 2 (12)
−∞ 2
2 𝑛𝜋𝑥 n = 1,2,3………...
𝜙𝑛 = 𝑠𝑖𝑛
𝐿 𝐿
which leads to
2 𝜋𝑥 2 2𝜋𝑥
𝜙1 = sin ; 𝜙2 = sin
𝐿 𝐿 𝐿 𝐿
2 3𝜋𝑥
𝜙3 = sin
𝐿 𝐿
Particle in a box or infinite well:
The ground state (lowest energy) of this particle :
when 𝑥 = 0, 𝜙 = 0
2 𝜋𝑥 when 𝑥 = 𝐿/2, 𝜙 = 𝑚𝑎𝑥
𝜙1 = sin ; when 𝑥 = 𝐿, 𝜙 = 0
𝐿 𝐿
2
𝜙1 𝜙1
0 L x
0 L x
2
𝜙2 𝜙2
0 L/2 L x 0 L/2 L
𝜙3 𝜙3 2
0 L/2 L x 0 L/2 L
Comparison of different states for particle in a box :
𝜙3 𝜙3 2
𝜙2 𝜙2 2
𝜙1 𝜙1 2
x=L x=L x=0 x=L
Classical physics, of course, suggests same probability for
the particle being anywhere in the box.
𝜙3
𝜙2
𝜙1
Potential energies are never infinite in real world and well with
infinitely hard walls (infinite potential well) has no physical
counterpart.
I II III
x=0 x=L x
𝜙𝐼+ 𝜙𝐼𝐼𝐼
𝜙𝐼𝐼
𝜙𝐼−
x=0 x=L x
2𝑚ሺ𝑈−𝐸)
Where 𝑘2 =
ℏ
The higher the barrier and wider it is, less will be the chance
that the particle can get through the barrier.
Book: Concepts of Modern Physics by Arthur Beiser