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Lecture 05
1
𝑈(𝑥) = 𝑘𝑥 2 𝒙
2
Potential energy for atom and many other practical systems are close to harmonic
around equilibrium point but deviates at larger distance from equilibrium
Harmonic approximation
Taylor series expansion
𝟏
𝑼 𝒙 = 𝑼 𝒙𝟎 +𝑼′ 𝒙𝟎 𝒙 − 𝒙𝟎 + 𝑼"(𝒙𝟎 ) 𝒙 − 𝒙𝟎 𝟐+𝑶(𝟑)
𝟐!
𝒅𝑼 𝒅𝟐 𝑼
Here 𝑼′ 𝒙 = 𝑼" 𝒙 =
𝒅𝒙 𝒅𝒙𝟐
𝒙 − 𝒙𝟎
We are taking the expansion around the 𝑼(𝒙)
equilibrium distance, x0.
Hence 𝑈 ′ 𝑥0 = 0 , since the force is
zero (potential has an extremum).
𝒙
Let us assume that 𝑈 𝑥0 = 0 , the 𝑼𝟎
potential at the equilibrium (reference) is
zero. 𝒙𝟎 𝒙
𝒙𝟎
𝒙 𝒙 − 𝒙𝟎
PH 101: PHYSICS 1 Lecture 05 [4]
Harmonic approximation
Taylor series expansion examples:
PH 101: PHYSICS 1 Lecture 05 [5]
Spring constant
𝑘 = 𝑼"(𝒙𝟎 )
𝒙
Thus, frequent of vibration about equilibrium,
𝒙𝟎 𝒙 𝒌
𝝎=
𝒎
𝑘
For two particle system (molecule), frequency of vibration, 𝜔 =
𝜇
𝑚1 𝑚2
where, the reduced mass () of oscillator is 𝜇 =
𝑚1 +𝑚2
PH 101: PHYSICS 1 Lecture 05 [6]
−𝛼(𝑥−𝑥0 ) 2
𝑈 𝑥 =𝐷 1−𝑒
𝑈 𝑥0 = 0
𝑈 ∞ =𝐷
Interatomic distance
To break the molecule one has to
supply energy, D. This is a
convenient model for diatomic
molecules.
PH 101: PHYSICS 1 Lecture 05 [7]
𝒌 𝟐𝑫
𝝎= =𝜶
𝝁 𝝁
Lecture 05
PH 101: PHYSICS 1 [8]
dU 𝒊𝒏 𝟐𝑫 𝒂𝒏𝒅 𝟑𝑫?
Y
(𝑥, 𝑦)
𝒅𝒓
(𝑥 + 𝑑𝑥, 𝑦 + 𝑑𝑦)
𝒓
𝒓 + 𝒅𝒓
X
Rate of change of potential energy is different in different directions
Total change in potential energy due to change of 𝑥 by 𝑑𝑥 and 𝑦 by 𝑑𝑦
𝝏𝑼 𝝏𝑼
𝒅𝑼 = 𝒅𝒙 + 𝒅𝒚
𝝏𝒙 𝝏𝒚
𝝏𝑼 𝝏𝑼 𝝏𝑼
𝒅𝑼 = 𝒅𝒙 + 𝒅𝒚 + 𝒅𝒛
𝝏𝒙 𝝏𝒚 𝝏𝒛
PH 101: PHYSICS 1 Lecture 05 [11]
Potential energy in 3D
We can write;
𝝏𝑼 𝝏𝑼 𝝏𝑼
𝒅𝑼 = 𝒅𝒙 + 𝒅𝒚 + 𝒅𝒛
𝝏𝒙 𝝏𝒚 𝝏𝒛
𝝏𝑼 𝝏𝑼 𝝏𝑼
𝒅𝑼 = ෝ+
𝒙 ෝ+
𝒚 ෝ + 𝒅yෝ
𝒛ො ∙ (𝒅𝒙 𝒙 𝒚 + 𝒅𝒛ො𝒛)
𝝏𝒙 𝝏𝒚 𝝏𝒛
𝝏 𝝏 𝝏
𝒅𝑼 = ෝ+
𝒙 ෝ+
𝒚 ෝ + 𝒅yෝ
𝒛ො 𝑼 ∙ (𝒅𝒙 𝒙 𝒚 + 𝒅𝒛ො𝒛)
𝝏𝒙 𝝏𝒚 𝝏𝒛
𝒅𝑼 = 𝜵𝑼 ∙ 𝒅𝒓
𝝏 𝝏 𝝏
𝜵 symbols stands for an operator 𝜵 = ෝ
𝒙 + ෝ
𝒚 + 𝒛ො
𝝏𝒙 𝝏𝒚 𝝏𝒛
𝜵𝑼 ➔ This operation is known as gradient of 𝑼.
𝝏𝑼 𝝏𝑼 𝝏𝑼
Since, 𝑑𝑈 = −𝐹Ԧ ∙ 𝑑 𝑟Ԧ ➔ 𝑭 = −𝜵𝑼 = − ෝ
𝒙 + ෝ
𝒚 + 𝒛ො
𝝏𝒙 𝝏𝒚 𝝏𝒛
𝝏𝑼 𝝏𝑼 𝝏𝑼
𝑭𝐱 = − & 𝑭𝐲 = − & 𝑭𝐳 = −
𝝏𝒙 𝝏𝒚 𝝏𝒛
PH 101: PHYSICS 1 Lecture 05 [12]
𝜕𝑈 1 𝜕𝑈
𝑑𝑈 = 𝑟Ƹ + 𝜃መ . 𝑑𝑟𝑟Ƹ + 𝑟𝑑𝜃𝜃መ = 𝛻𝑈 ∙ 𝑑 𝑟Ԧ
𝜕𝑟 𝑟 𝜕𝜃
𝜕𝑈 1 𝜕𝑈
𝛻𝑈 = 𝑟Ƹ + 𝜃 (In-plane polar coordinate)
𝜕𝑟 𝑟 𝜕𝜃
= − 𝐹𝑟 𝑑𝑟 + 𝐹𝜃 𝑟𝑑𝜃
𝜕𝑈 1 𝜕𝑈
𝐹𝑟 = − ; 𝐹𝜃 = −
𝜕𝑟 𝑟 𝜕𝜃
PH 101: PHYSICS 1 Lecture 05 [13]
𝝏𝑼 𝝏𝑼 𝝏𝑼
𝒅𝑼 = 𝒅𝒓 + 𝒅𝜽+ 𝒅𝒛
𝝏𝒓 𝝏𝜽 𝝏𝒛
𝝏𝑼 𝟏 𝝏𝑼 𝝏𝑼
𝒅𝑼 = ෝ𝒓 + +
𝜽 + 𝒅𝒛ො𝒛 = 𝜵𝑼 ∙ 𝒅𝒓
𝒛ො . 𝒅𝒓ෝ𝒓 + 𝒓𝒅𝜽𝜽
𝝏𝒓 𝒓 𝝏𝜽 𝝏𝒛
𝝏𝑼 𝟏 𝝏𝑼 𝝏𝑼
𝜵𝑼 = ෝ𝒓 +
𝜽+ 𝒛ො
𝝏𝒓 𝒓 𝝏𝜽 𝝏𝒛
𝝏𝑼 𝟏 𝝏𝑼 𝝏𝑼
𝑭𝒓 = − ,𝑭 = − ,𝑭 = −
𝝏𝒓 𝜽 𝒓 𝝏𝜽 𝒛 𝝏𝒛
PH 101: PHYSICS 1 Lecture 05 [14]
𝝏𝑼 𝝏𝑼 𝝏𝑼
𝒅𝑼 = 𝒅𝒓 + 𝒅𝜽+ 𝒅𝝋
𝝏𝒓 𝝏𝜽 𝝏𝝋
𝝏𝑼 𝟏 𝝏𝑼 𝟏 𝝏𝑼
𝒅𝑼 = 𝒓ො +
𝜽+ 𝝋 + 𝒓𝒔𝒊𝒏𝜽𝒅𝝋ෝ
ෝ . 𝒅𝒓ො𝒓 + 𝒓𝒅𝜽𝜽 𝝋 = 𝜵𝑼 ∙ 𝒅𝒓
𝝏𝒓 𝒓 𝝏𝜽 𝒓 sin 𝜽 𝝏𝝋
𝝏𝑼 𝟏 𝝏𝑼 𝟏 𝝏𝑼
𝜵𝑼 = 𝒓ො + +
𝜽 ෝ
𝝋
𝝏𝒓 𝒓 𝝏𝜽 𝒓 sin 𝜽 𝝏𝝋
= − 𝐹𝑟 𝑑𝑟 + 𝐹𝜃 𝑟𝑑𝜃 + 𝐹𝜑 𝑟𝑠𝑖𝑛𝜃𝑑𝜑
𝝏𝑼 𝟏 𝝏𝑼 𝟏 𝝏𝑼
𝑭𝒓 = − , 𝑭𝜽 = − , 𝑭𝝋 = −
𝝏𝒓 𝒓 𝝏𝜽 𝒓 sin 𝜽 𝝏𝝋
PH 101: PHYSICS 1 Lecture 05 [15]
Work done by all type of forces do not converted to potential energy stored in the
system, it may lost by dissipation in the form of heat, sound etc. Those forces are
dissipative force/non-conservative force, Example: Friction
𝐵 𝐵 𝐵 𝑭 C
𝒅𝒓
𝑊𝐴𝐷𝐵 = න 𝐹Ԧ ∙ 𝑑 𝑟Ԧ = න −𝛻𝑈 ∙ 𝑑 𝑟Ԧ = න −𝑑𝑈
𝐴 𝐴 𝐴
A
= 𝑈𝐴 − 𝑈𝐵 E
𝑾𝑨𝑪𝑩𝑫𝑨 = 𝑼𝑨 − 𝑼𝑩 + 𝑼𝑩 − 𝑼𝑨 = 𝟎
Total work done by a conservation force along a closed path is always zero