Professional Documents
Culture Documents
FALLSEM2019-20 ECE1006 ETH VL2019201001488 Reference Material I 31-Jul-2019 Lecture-5 Wave Particle Duality and Schrodinger Equation
FALLSEM2019-20 ECE1006 ETH VL2019201001488 Reference Material I 31-Jul-2019 Lecture-5 Wave Particle Duality and Schrodinger Equation
FALLSEM2019-20 ECE1006 ETH VL2019201001488 Reference Material I 31-Jul-2019 Lecture-5 Wave Particle Duality and Schrodinger Equation
Equation
What is light? Is it a wave or a particle?
𝐸 𝑥, 𝑡 = 𝑦 sin(𝑘𝑥-𝜔𝑡)
𝐵 𝑥, 𝑡 = 𝑧 sin(𝑘𝑥-𝜔𝑡)
𝜔
= 𝑣 is the velocity of
𝑘 Electromagnetic wave
𝑣 = 𝑐 in free space
Photoelectric effect
The photoelectric effect refers to the emission, or ejection, of
electrons from the surface of, generally, a metal in response to
incident light.
Experimental Setup
Einstein’s explanation
• Light is comprised of particle-like quanta
each with energy 𝐸𝑞𝑢𝑎𝑛𝑡 = ℎν
• The quanta collide with electrons &
transfer all their energy to them
𝐾𝐸𝑒𝑙𝑒𝑐𝑡𝑟𝑜𝑛 = ℎ𝜈 − 𝜙
Light quanta “photons”
Einstein’s light quanta were given the name
“photons” by Arthur Compton.
𝐸 ℎ𝜈 ℎ
𝑃= = =
𝑐 𝑐 𝜆
Photon Energy for red light
Red light: ν = 4.0x1014 Hz
𝑚𝑒 = 9.1093897 × 10−31 Kg
𝑑Ψ
𝑖ђ = 𝐻Ψ
𝑑𝑡
Schrödinger Equation (1926)
Erwin Schrödinger
(1887-1961)
+∞
−∞
Ψ 2 𝑑𝜏 = 1
Normalization condition
Where, 𝐴 is a constant
𝑘 is the wave vector
𝜔 is the frequency of the wave
Now 𝒉 𝒉 𝟐𝝅
𝒑= = = ђ𝒌 𝑑𝑒 𝐵𝑟𝑜𝑔𝑙𝑖𝑒 𝑅𝑒𝑙𝑎𝑡𝑖𝑜𝑛
𝝀 𝟐𝝅 𝝀
ℎ = 6.626 × 10−34 J. s
ℎ
ђ= = 1.06 × 10−34 J. s = 0.6582 × 10−15 eV. s
2𝜋
𝒉
𝑬 = 𝒉𝝂 = 𝟐𝝅𝝂 = ђ𝝎 𝐸𝑖𝑛𝑠𝑡𝑒𝑖𝑛′ 𝑠 𝐸𝑞𝑢𝑎𝑡𝑖𝑜𝑛
𝟐𝝅
So, the wave function can be written as:
Ψ(𝑥, 𝑡) = 𝐴 𝑒 −𝑖(𝐸𝑡−𝑝𝑥)/ђ
Ψ(𝑥, 𝑡) = 𝐴 𝑒 −𝑖(𝐸𝑡−𝑝𝑥)/ђ
Differentiate Ψ w.r.t 𝑡
Now, differentiate Ψ w.r.t 𝑥
𝜕Ψ 𝑖 𝜕Ψ 𝑖
= 𝑝Ψ = − 𝐸Ψ
𝜕𝑥 ђ 𝜕𝑡 ђ
𝜕Ψ 𝜕Ψ
⇒ 𝑝Ψ = −𝑖ђ ⇒ 𝐸Ψ = 𝑖ђ
𝜕𝑥 𝜕𝑡
𝜕 𝜕
⇒ 𝑝 ⇔ −𝑖ђ ⇒ 𝐸 ⇔ 𝑖ђ
𝜕𝑥 𝜕𝑡
Momentum Operator Energy Operator
Now, take the second
derivative of Ψ w.r.t 𝑥
𝜕2Ψ 𝑖 𝑖 2
2
= − − 𝑝Ψ ђ2 𝜕2Ψ
𝜕𝑥 ђ ђ ⇒ 𝑇Ψ = −
2Ψ 2𝑚 𝜕𝑥2
𝜕
⇒ 𝑝2Ψ = −ђ2 2
𝜕𝑥 ђ2 𝜕2
⇒𝑇⇔−
𝑝2 ђ2 𝜕2Ψ 2𝑚 𝜕𝑥2
⇒ Ψ=−
2𝑚 2𝑚 𝜕𝑥2 Kinetic Energy Operator
For a free particle, Potential Energy V = 0
Total energy = K. E
𝑝2 𝜕Ψ ђ2 𝜕2Ψ
So, 𝐸= ⇒ −𝑖ђ =−
2𝑚 𝜕𝑡 2𝑚 𝜕𝑥2
𝑝2
So, 𝐸= + 𝑉(𝑥)
2𝑚
𝑝2
⇒ 𝐸Ψ = + 𝑉(𝑥) Ψ
2𝑚
𝜕Ψ(𝑥, 𝑡) ђ2 𝜕2
⇒ 𝑖ђ = − 2
+ 𝑉(𝑥) Ψ(𝑥, 𝑡)
𝜕𝑡 2𝑚 𝜕𝑥
𝐻: 𝐻𝑎𝑚𝑖𝑙𝑡𝑜𝑛𝑖𝑎𝑛
Classical variables Quantum operators
Position, 𝑥 𝑥
Linear momentum, 𝑃 𝜕
−𝑖ђ
𝜕𝑥
Potential Energy, 𝑈(𝑥) 𝑈(𝑥)
Kinetic Energy, 𝑇 = 𝑃2 /2m −
ђ2 𝜕2Ψ
2𝑚 𝜕𝑥2
Total Energy, 𝐸 𝜕
𝑖ђ
𝜕𝑡
Total Energy (Hamiltonian ђ2 𝜕 2
− + 𝑉(𝑥)
form) (𝐻 = 𝑇 + 𝑉) 2𝑚 𝜕𝑥2
So, 1-D time dependent Schrödinger’s Equation is
𝜕Ψ(𝑥,𝑡) ђ2 𝜕2
⇒ 𝑖ђ = − + 𝑉(𝑥) Ψ(𝑥, 𝑡)
𝜕𝑡 2𝑚 𝜕𝑥2
Ψ(𝑥, 𝑡) = 𝐴 𝑒 −𝑖(𝐸𝑡−𝑝𝑥)/ђ
= 𝐴 𝑒 (𝑖𝑝/ђ)𝑥 𝑒 − (𝑖𝐸/ђ)𝑡
= 𝜓𝑒 − (𝑖𝐸/ђ)𝑡
𝜕Ψ(𝑥,𝑡) ђ2 𝜕2
Now, ⇒ 𝑖ђ = − + 𝑉(𝑥) Ψ(𝑥, 𝑡)
𝜕𝑡 2𝑚 𝜕𝑥2
Partially differentiation will give
− (𝑖𝐸/ђ)𝑡
ђ2 − (𝑖𝐸/ђ)𝑡 𝜕2𝜓 − (𝑖𝐸/ђ)𝑡
⇒ 𝐸𝜓𝑒 =− 𝑒 + 𝑉(𝑥)𝜓𝑒
2𝑚 𝜕𝑥2
Dividing through by the common exponential factor gives
𝜕2𝜓 2𝑚 Steady-state Schrödinger equation
⇒ + 𝐸 − 𝑉 𝜓 = 0
𝜕𝑥2 ђ2 in one dimension
Steady-state Schrödinger equation in three dimensions
𝜕2𝜓 𝜕2𝜓 𝜕2𝜓 2𝑚
⇒ 2
+ 2
+ 2 + 2 𝐸−𝑉 𝜓 =0
𝜕𝑥 𝜕𝑦 𝜕𝑧 ђ
𝜕Ψ(𝑥,𝑦,𝑧,𝑡) ђ2 𝜕2 𝜕2 𝜕2
⇒ 𝑖ђ = − + + Ψ(𝑥, 𝑦, 𝑧, 𝑡) + 𝑉(𝑥, 𝑦, 𝑧) Ψ(𝑥, 𝑦, 𝑧, 𝑡)
𝜕𝑡 2𝑚 𝜕𝑥2 𝜕𝑦2 𝜕𝑧2