Numerical solution to Schrödinger equation - eigenvalues

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SUMMARY

This discussion focuses on numerically solving the Schrödinger equation for the Woods-Saxon Potential to find energy eigenvalues and eigenfunctions. The Numerov-Cooley method is identified as an effective iterative technique for this purpose, where an initial guess for eigenenergy is refined through forward and backward integration of the wave function. The process involves comparing first derivatives to achieve convergence, ultimately revealing multiple solutions for various quantum systems, such as the harmonic oscillator.

PREREQUISITES
  • Understanding of the Schrödinger equation
  • Familiarity with the Woods-Saxon Potential
  • Knowledge of the Numerov-Cooley method
  • Basic concepts of tridiagonal matrices
NEXT STEPS
  • Study the implementation of the Numerov-Cooley method in numerical analysis
  • Explore the properties of tridiagonal matrices in quantum mechanics
  • Investigate the harmonic oscillator solutions and their significance in quantum systems
  • Learn about numerical integration techniques, specifically the Runge-Kutta method
USEFUL FOR

Quantum mechanics students, physicists working on numerical methods, and researchers interested in computational solutions to quantum systems will benefit from this discussion.

CINA
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Not sure whether to post this here or in QM: I trying to numerically solve the Schrödinger equation for the Woods-Saxon Potential and find the energy eigenvalues and eigenfucnctions but I am confused about how exactly the eigenvalues come about. I've solved some differential equations in the past using the Runge–Kutta method, but nothing with eigenvalues. From what I've seen Numerov's method is the way to solve Schrödinger's equation but I don't see how solutions that gives the energy eigenvalues or eigenfunctions. Wouldn't numerically solving the DE just give one solution? I seen some mention of "tridiagonal matrices" being generated somehow, but am not sure what the elements of that matrix would be. Any help would be appreciated.

Thanks
 
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CINA said:
Not sure whether to post this here or in QM: I trying to numerically solve the Schrödinger equation for the Woods-Saxon Potential and find the energy eigenvalues and eigenfucnctions but I am confused about how exactly the eigenvalues come about. I've solved some differential equations in the past using the Runge–Kutta method, but nothing with eigenvalues. From what I've seen Numerov's method is the way to solve Schrödinger's equation but I don't see how solutions that gives the energy eigenvalues or eigenfunctions. Wouldn't numerically solving the DE just give one solution? I seen some mention of "tridiagonal matrices" being generated somehow, but am not sure what the elements of that matrix would be. Any help would be appreciated.

Thanks

Numerov-Cooley (or Cooley Numerov) method is an iterative method to numerically solve the Schrödinger equation.

You guess the eigenenergy, forward and backward integrate the wave fnction to the midpoint, and compare first derivatives. In Cooley's implementation, the difference in first derivatives is used to calculate a correction to the energy. You redo the process until the first derivatives are "the same," going forward and backward. For most systems, there are many solutions possible [ e.g. harmonic oscillator, infinite solutions with E = (n+1/2) E_0 (n= 0, 1, 2, ...) ]
 

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