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Quantum Mechanics



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   Quantum Mechanics



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Quantum Simple Harmonic
Oscillator QSHO




Quantum Mechanics
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© The scientific sentence. 2010

Hermite polynomials



1. Hermite polynomials


In Physics, Hermite polynomials are used give determine the 
eigenstates of the quantum harmonic oscillator. They are the 
set of sequences:

The Hermite differential equation is:

y"(x) - 2xy'(x) + 2ny(x) = 0

The solution of this non-linear second-order ordinary differential 
equation is the set of Hermite polynomials.

Hn = (- 1)n exp{x2} dn(exp{- x2})/dxn.
Hn is the polynomial of degree n. 

Here some first sequences:

H0(x) = 1
H1(x) = 2x
H2(x) = 4x2 - 2
H3(x) = 8x3 - 12x
H4(x) = 16x4 - 48x2 + 12
H5(x) = 32x5-160x3 + 120x


The Hermite polynomial are orthogonal with the 
weight w(x) = exp{- x2}. Thus:
∫ Hn(x) Hm(x) exp{- x2} dx = δ(n,m) [x: from - ∞ to ∞]


Recursion relations

Hn+1(x) = 2xHn(x)- H'n(x)
H'n(x) = 2nHn - 1(x)
Hn+1(x) = 2xHn(x) - 2nHn- 1(x)


2. Quantum Simple Harmonic Oscillator (QSHO)

2.1. Schrödinger’s Equation for QSHO
The Schrödinger’s equation for QSHO is: - ħ 2/2m Ψ"(x) + (1/2) k x2 Ψ(x) - E Ψ(x) = 0 or: Ψ"(x) + [ (2m/ħ2)E - (mk/ħ2) x2]Ψ(x) = 0 Where 2πħ is the Planck constant, m is the mass of the particle, k is the spring constant and E is the energy of the particle. Let's write: x = z/α then: Ψ'(x) = α Ψ'(z) Ψ"(x) = α2 Ψ"(z) Therefore α2 Ψ"(z) + [ (2m/ħ2)E - (mk/ħ2) (z/α)2]Ψ(x) = 0 Dividing by α2 , yields: Ψ"(z) + [ (2m/ħ2 α2 )E - (mk/ħ2) (z2/α)4]Ψ(x) = 0 Let's define: km/ħ2α4 = 1, so α4 = mk/ħ2 We have then: Ψ"(z) + [ (2m/ħ2 α2 )E - z2]Ψ(x) = 0 Now, let's define: Ψn (z) = exp{- z2/2} Hn(z) Therefore: Ψ'n (z) = - z Ψn (z) + exp{- z2/2} H'n(z) Ψ"n (z) = - Ψn - zΨ'n (z) + exp{- z2/2} H"n(z) - z exp{- z2/2} H'n(z) = Ψ"(z)n (z) = - Ψn - z [- z Ψn (z) + exp{- z2/2} H'n(z)] + exp{- z2/2} H"n(z) - z exp{- z2/2} H'n(z) = - Ψn + z2Ψn (z) - z exp{- z2/2} H'n(z) + exp{- z2/2} H"n(z) - z exp{- z2/2} H'n(z) = (z2 - 1)Ψn (z) - 2xexp{- z2/2} H'n(z) + exp{- z2/2} H"n(z) The Schrodinger's equation becomes: z2Ψ - Ψn (z) - 2 z exp{- z2/2} H'n(z) + exp{- z2/2} H"n(z) + [ (2mE/ħ2α2) - z2]Ψ(z) = 0 Or: - 2 z H'n(z) + H"n(z) + [ (2mE/ħ2α2) - 1]H(z) = 0 Rearranging: H"n(z) - 2 z H'n(z) + [(2mE/ħ2α2) - 1]H(z) = 0 then the Schrodinger's equation becomes the Hermite equation with: 2mE/ħ2α2) - 1 = 2n, so E = (ħ2α2/2m) (2n + 1) We have α2/2m = (k/m)1/2/2ħ, then E = (ħ2(k/m)1/2/2ħ) (2n + 1) = (ħ(k/m)1/2) (n + 1/2) Let's write: ω2 = k/m Therefore: E = ħω (n + 1/2) E = ħω (n + 1/2) The wave function becomes: Ψn (z) = Ψn (z) = exp{- z2/2} Hn(z) is the solution of the schrodinger equation, with z = α x α4 = mk/ħ2. E = (ħ2α2/2m) (2n + 1)
2.2. Normalization of the function Ψn (z)
The hermite polynomials are orthogoal as follows:

∫ exp{- z2} Hn(z) Hm dz = (2n π1/2 n!)δ(n,m) [from _∞ to ∞]

Then:
∫ |Ψn (z)|dz = 1, so
∫ N2 exp{- z2} H2n(z) = 1  [from _∞ to ∞]
Then
N = [n!2n π1/2]- 1/2

Therefore:
Ψn (z) = [n! 2n π1/2]- 1/2 exp{- z2/2} Hn(z)

or:
Ψn (x) = [n! 2n π1/2]- 1/2 exp{- (αx)2/2} Hn(x)

The results are:

Ψn (x) = [n! 2n π1/2]- 1/2 exp{- (αx)2/2} Hn(x)
E = (ħ2α2/2m) (2n + 1) = ħω (n + 1/2)
α4 = mk/ħ2  ω2 = k/m
The energy is not null even at the ground 
state where n = 0. 
The transition energy between states is ħω.





  


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