Solving Schrödinger's Equation for Cylindrical Boundaries

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SUMMARY

The discussion focuses on solving the time-independent Schrödinger equation for a particle confined within a cylindrical boundary, specifically for a cylinder of height h and radius a, where h is approximately equal to a. The participants utilized separation of variables to derive the eigenfunctions and eigenvalues, ultimately recognizing that the radial part of the equation resembles a Bessel equation. The first three eigenvalues were determined to be related to the roots of the Bessel function, with the final expressions for the energies being E1, E2, and E3 based on the lowest roots of the Bessel function and the boundary conditions applied.

PREREQUISITES
  • Understanding of the time-independent Schrödinger equation
  • Familiarity with separation of variables technique
  • Knowledge of Bessel functions and their properties
  • Basic concepts of quantum mechanics and eigenvalues
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  • Study the properties of Bessel functions and their applications in quantum mechanics
  • Learn about the method of separation of variables in solving partial differential equations
  • Explore the derivation and significance of eigenvalues in quantum systems
  • Consult tables of roots for Bessel functions to find specific eigenvalues
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Students and researchers in quantum mechanics, physicists working on wave functions in cylindrical coordinates, and anyone interested in solving boundary value problems in quantum systems.

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Homework Statement


I must get the first eigenvalues of the time independent Schrödinger's equation for a particle of mass m inside a cylinder of height h and radius a where ##h \sim a##.
The boundary conditions are that psi is worth 0 everywhere on the surface of the cylinder.

Homework Equations


##-\frac{\hbar ^2}{2m} \triangle \psi =E \psi##.
Laplacian in cylindrical coordinates.

The Attempt at a Solution


I've used separation of variables on the PDE, seeking for the solutions of the form ##\psi (\rho, \theta , z)=R(\rho) \Theta (\theta ) Z(z)##.
I reached that ##\frac{Z''}{Z}=\text{constant}=-\lambda ^2##. Assuming that the Z function is periodic and worth 0 at the top and bottom of the cylinder, I reached that ##Z(z)=B \sin \left ( \frac{n\pi n}{h} \right )## where n=1,2, 3, etc.
Then I reached that ##\frac{\Theta''}{\Theta} = -m^2## where m=0, 1, 2, etc (because it must be periodic with period 2 pi). So that ##\Theta (\theta )=C \cos (m \theta ) +D \sin (m \theta)##.
Then the last ODE remaining to solve is ##\rho ^2 R''+\rho R'+R \{ \rho ^2 \left [ \frac{2mE}{\hbar ^2} - \left ( \frac{n\pi}{h} \right )^2 \right ] -m^2 \}=0##. This is where I'm stuck.
It's very similar to a Bessel equation and Cauchy-Euler equation but I don't think it is either. So I don't really know how to tackle that ODE. Any idea? Wolfram alpha does not seem to solve it either: http://www.wolframalpha.com/input/?i=x^2y%27%27%2Bxy%27%2By%28x^2*k-n^2%29%3D0.
 
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TSny said:
Look's like Bessel's equation. See http://www.efunda.com/math/bessel/bessel.cfm
Hmm ok.
Of course, you'll need to rescale ##\rho## to simplify the expression inside your { }.
Hmm what do you mean exactly? I have an equation of the form ##\rho ^2 R''+\rho R' +R(\rho ^2 p^2 -m^2)## where p is a constant for a given n.
Rescaling rho means to get ##p^2=1##?
 


Yes. Define a new independent variable (##x##, say) in terms of ##\rho## such that you get the standard form of Bessel's equation.
 


TSny said:
Yes. Define a new independent variable (##x##, say) in terms of ##\rho## such that you get the standard form of Bessel's equation.

I try ##x=\rho p## so ##\rho =x/p## but then the ODE changes to ##\frac{x^2R''}{p^2}+\frac{xR'}{p}+R(x^2-m^2)=0##. I could multiply by ##p^2## but I would not get the standard form of the Bessel equation. I don't see how I could rescale the factor in front of rho ^2 without rescaling the coefficients in front of R'' and R.
 


You need to take care of the rescaling in the derivatives, too. For example, ##dR/d\rho = \left(dR/dx\right)\left(dx/d\rho\right)##
 


TSny said:
You need to take care of the rescaling in the derivatives, too. For example, ##dR/d\rho = \left(dR/dx\right)\left(dx/d\rho\right)##

Oh right, I totally missed this!
So indeed now I recognize a Bessel equation!
Therefore I get that the solutions of the form ##\psi =R ( \rho ) \Theta (\theta ) Z(z)=B_n \sin \left ( \frac{n\pi z}{h} \right ) [C_m \cos (m\theta ) + D_m \sin (m \theta )]J_m \left ( \rho \sqrt {\frac{2mE}{\hbar ^2} - \frac{n^2 \pi ^2}{h^2}} \right )##.
So the solution that satisfies the boundary condition is a linear combination of those.
I'm not 100% sure about what they mean by "eigenvalues". Eigenfrequencies? Lowest energies possible? (They only want the first 3 eigenvalues).
I'm pretty sure this will concern the cases (1) n=1 and m=0 and m=1. (2) n=2, m=0. But I'm not sure what they are asking me.
 


I think they want the three lowest energies. They are called eigenvalues because they are eigenvalues of the time independent Schrödinger equation ##H|\psi> = E|\psi>##
 


You don't seem to have used the boundary condition at ρ=a.
 
  • #10


TSny said:
I think they want the three lowest energies. They are called eigenvalues because they are eigenvalues of the time independent Schrödinger equation ##H|\psi> = E|\psi>##

Ok thanks!
Hmm I don't know how to get that information.
I have a feeling I should add a subscript "n" under "E" in ##\psi =R ( \rho ) \Theta (\theta ) Z(z)=B_n \sin \left ( \frac{n\pi z}{h} \right ) [C_m \cos (m\theta ) + D_m \sin (m \theta )]J_m \left ( \rho \sqrt {\frac{2mE}{\hbar ^2} - \frac{n^2 \pi ^2}{h^2}} \right )## and then isolate ##E_n## but not sure to what I should equate the equation.
 
  • #11


Follow haruspex's lead.
 
  • #12


Oh right guys sorry. And thanks for helping. I did not see haruspex's post.
So if ##x_p## is the p'th zero of the Bessel function then ##E_n= \left ( \frac{\hbar ^2}{2m} \right ) \left [ \left ( \frac{x_p}{a} \right ) ^2 +\left ( \frac{n^2 \pi ^2}{h^2} \right ) \right ]##. I guess I'll have to check if I can replace "p" by "n". It's not obvious to me at a first glance.
 
  • #13


Ok I've thought a bit on this. The first 3 lowest energy values are when ##x_p=x_0##. So ##E_1= \frac{\hbar ^2}{2m} \left [ \left ( \frac{x_0}{a} \right ) ^2 + \frac{\pi ^2}{h^2} \right ]##, ##E_2= \frac{\hbar ^2}{2m} \left [ \left ( \frac{x_0}{a} \right ) ^2 + \frac{4\pi ^2}{h^2} \right ]## and ##E_3= \frac{\hbar ^2}{2m} \left [ \left ( \frac{x_0}{a} \right ) ^2 + \frac{9\pi ^2}{h^2} \right ]##.
I'm not very confident because I don't know if ##\frac{\hbar ^2 }{2m} \left [ \left ( \frac{x_1}{a} \right ) ^2 + \frac{\pi ^2}{h^2} \right ] <\frac{\hbar ^2}{2m} \left [ \left ( \frac{x_0}{a} \right ) ^2 + \frac{9\pi ^2}{h^2} \right ]## for example.
 
  • #14


You'll need to consult a Table of Roots

The problem states that the height of the cylinder is approx. equal to the radius: h\approx a, which should help figure out the lowest three energies.
 
Last edited:
  • #15


TSny said:
You'll need to consult a Table of Roots

The problem states that the height of the cylinder is approx. equal to the radius: h\approx a, which should help figure out the lowest three energies.

Great and thank you once more.
I get from lower to upper: ##E_{1,0}##, ##E_{1,1}## and ##E_{2,0}## where the subscript are ##E_{n,p}##.
 
  • #16


I think that might be correct.
 
  • #17


:approve:
TSny said:
I think that might be correct.
Thanks for all.
 

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