Quantum Mechanics Variational Method

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SUMMARY

The forum discussion focuses on using the variational method in quantum mechanics to approximate the energy of a particle in a box with the trial wavefunction ψT = x(a-x²). The user derived an energy expression E = 1-(3/5)a² / [a(a²/7-1/15)] but encountered discontinuities at a = 0 and a = √(7/15). After correcting an integration error, the revised expression still exhibited similar discontinuity issues, prompting a request for clarification on the underlying cause.

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Homework Statement


Consider a particle in a box in the interval [-a,a]. Use the trial wavefunction

ψT = x(a-x2)

to obtain an approximate energy for the first excited state of the box as a function of a.

Homework Equations



Schrödinger equation, Hamiltonian for atomic units is 1/2(d2/dx2)

Normalized energy E = ∫-aaψ*Hψdx/∫-aaψ*ψdx

The Attempt at a Solution



Right, so I just plugged in ψT to the energy equation, and after evaluating the integrals, got E = 1-(3/5)a2 / [a(a2/7-1/15)]. The problem is, this function is discontinuous. It is discontinuous at 0, which makes sense to me, and at a = √(7/15), which I don't understand. I'm pretty sure my integrations were done properly... can anyone either explain this discontinuity to me, or tell me why my set-up was flawed?

Thanks!
 
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Okay, I found one error in my integration. The revised function is E = 1-(3/5)a / [a(a^2/7-1/15)]. Still has the same discontinuity problems, though.
 

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